0 B14R2.101 C(#Cc1c[nH]cn1)c2ccccc2 271570a_100000069678_100000756875 [0,0,0,0,0,0|1,0,1]=2 1 B14R2.101 C(#Cc1cc[nH]n1)c2ccccc2 271570a_100000069678_100000062575 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.101 C(#Cc1ccco1)c2ccccc2 271570a_100000069678_100009814098 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.101 C(#Cc1cccs1)c2ccccc2 271570a_100000069678_100011215356 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.101 C(#Cc1ccoc1)c2ccccc2 271570a_100000069678_100011215275 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.101 C(#Cc1ccsc1)c2ccccc2 271570a_100000069678_100000738268 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.101 C(#Cc1ccsn1)c2ccccc2 271570a_100000069678_100009818082 [0,0,0,0,0,0|3,0,1]=4 7 B14R2.101 C(#Cc1cn[nH]c1)c2ccccc2 271570a_100000069678_100000238712 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.101 C(#Cc1cnco1)c2ccccc2 271570a_100000069678_100020591547 [0,0,0,0,0,0|2,0,2]=4 9 B14R2.101 C(#Cc1cncs1)c2ccccc2 271570a_100000069678_100011934649 [0,0,0,0,0,0|2,0,2]=4 10 B14R2.101 C(#Cc1cscn1)c2ccccc2 271570a_100000069678_100000751502 [0,0,0,0,0,0|2,0,1]=3 11 B14R2.101 C(#Cc1nc[nH]n1)c2ccccc2 271570a_100000069678_100000761765 [0,0,0,0,0,0|2,0,1]=3 12 B14R2.101 C(#Cc1ncc[nH]1)c2ccccc2 271570a_100000069678_100025796157 [0,0,0,0,0,0|3,0,1]=4 13 B14R2.101 C(#Cc1ncco1)c2ccccc2 271570a_100000069678_100011787736 [0,0,0,0,0,0|3,0,1]=4 14 B14R2.101 C(#Cc1nccs1)c2ccccc2 271570a_100000069678_100000211983 [0,0,0,0,0,0|3,0,1]=4 15 B14R2.101 C(#Cc1ncns1)c2ccccc2 271570a_100000069678_100000693119 [0,0,0,0,0,0|2,0,2]=4 16 B14R2.101 C(=Cc1c[nH]cn1)c2ccccc2 271570a_100102527694_100000756875 [0,0,0,0,0,0|1,0,1]=2 17 B14R2.101 C(=Cc1c[nH]cn1)c2cccnc2 271570a_100102525586_100000756875 [0,0,0,0,0,0|2,0,1]=3 18 B14R2.101 C(=Cc1cc[nH]n1)c2ccccc2 271570a_100102527694_100000062575 [0,0,0,0,0,0|3,0,1]=4 19 B14R2.101 C(=Cc1ccco1)c2ccccc2 271570a_100102527694_100009814098 [0,0,0,0,0,0|3,0,1]=4 20 B14R2.101 C(=Cc1cccs1)c2ccccc2 271570a_100102527694_100011215356 [0,0,0,0,0,0|3,0,1]=4 21 B14R2.101 C(=Cc1ccoc1)c2ccccc2 271570a_100102527694_100011215275 [0,0,0,0,0,0|3,0,1]=4 22 B14R2.101 C(=Cc1ccsc1)c2ccccc2 271570a_100102527694_100000738268 [0,0,0,0,0,0|3,0,1]=4 23 B14R2.101 C(=Cc1ccsn1)c2ccccc2 271570a_100102527694_100009818082 [0,0,0,0,0,0|3,0,1]=4 24 B14R2.101 C(=Cc1cn[nH]c1)c2ccccc2 271570a_100102527694_100000238712 [0,0,0,0,0,0|3,0,1]=4 25 B14R2.101 C(=Cc1cnco1)c2ccccc2 271570a_100102527694_100020591547 [0,0,0,0,0,0|2,0,2]=4 26 B14R2.101 C(=Cc1cncs1)c2ccccc2 271570a_100102527694_100011934649 [0,0,0,0,0,0|2,0,2]=4 27 B14R2.101 C(=Cc1cscn1)c2ccccc2 271570a_100102527694_100000751502 [0,0,0,0,0,0|2,0,1]=3 28 B14R2.101 C(=Cc1cscn1)c2cccnc2 271570a_100102525586_100000751502 [0,0,0,0,0,0|3,0,1]=4 29 B14R2.101 C(=Cc1nc[nH]n1)c2ccccc2 271570a_100102527694_100000761765 [0,0,0,0,0,0|2,0,1]=3 30 B14R2.101 C(=Cc1nc[nH]n1)c2cccnc2 271570a_100102525586_100000761765 [0,0,0,0,0,0|3,0,1]=4 31 B14R2.101 C(=Cc1ncc[nH]1)c2ccccc2 271570a_100102527694_100025796157 [0,0,0,0,0,0|3,0,1]=4 32 B14R2.101 C(=Cc1ncco1)c2ccccc2 271570a_100102527694_100011787736 [0,0,0,0,0,0|3,0,1]=4 33 B14R2.101 C(=Cc1nccs1)c2ccccc2 271570a_100102527694_100000211983 [0,0,0,0,0,0|3,0,1]=4 34 B14R2.101 C(=Cc1ncns1)c2ccccc2 271570a_100102527694_100000693119 [0,0,0,0,0,0|2,0,2]=4 35 B14R2.101 C1=CC(=NNc2ccccc2)CC1 4a_100015195140_100000239507 [0,0,0,0,0,0|3,0,1]=4 36 B14R2.101 C1=CCC(=NNc2ccccc2)C1 4a_100015195140_100000766571 [0,0,0,0,0,0|3,0,1]=4 37 B14R2.101 c1cc(ccn1)CSc2c[nH]cn2 62a_100000756875_100015193705 [0,0,0,0,0,0|3,0,0]=3 38 B14R2.101 c1cc(ccn1)CSc2c[nH]cn2 62a_100015193705_100000756875 [0,0,0,0,0,0|3,0,0]=3 39 B14R2.101 c1cc(ccn1)CSc2c[nH]nn2 62a_100009819707_100015193705 [0,0,0,0,0,0|4,0,0]=4 40 B14R2.101 c1cc(ccn1)CSc2c[nH]nn2 62a_100015193705_100009819707 [0,0,0,0,0,0|4,0,0]=4 41 B14R2.101 c1cc(ccn1)CSc2cscn2 62a_100000751502_100015193705 [0,0,0,0,0,0|4,0,0]=4 42 B14R2.101 c1cc(ccn1)CSc2cscn2 62a_100015193705_100000751502 [0,0,0,0,0,0|4,0,0]=4 43 B14R2.101 c1cc(ccn1)CSc2nc[nH]n2 62a_100000761765_100015193705 [0,0,0,0,0,0|4,0,0]=4 44 B14R2.101 c1cc(ccn1)CSc2nc[nH]n2 62a_100015193705_100000761765 [0,0,0,0,0,0|4,0,0]=4 45 B14R2.101 c1cc(ccn1)OCc2c[nH]cn2 34a_100000212176_100000707719 [0,0,0,0,0,0|2,0,0]=2 46 B14R2.101 c1cc(ccn1)OCc2ccon2 34a_100000212176_100000234950 [0,0,0,0,0,0|4,0,0]=4 47 B14R2.101 c1cc(ccn1)OCc2ccsc2 34a_100000212176_100011261437 [0,0,0,0,0,0|4,0,0]=4 48 B14R2.101 c1cc(ccn1)OCc2cncs2 34a_100000212176_100015185245 [0,0,0,0,0,0|3,0,1]=4 49 B14R2.101 c1cc(ccn1)OCc2cscn2 34a_100000212176_100000205941 [0,0,0,0,0,0|3,0,0]=3 50 B14R2.101 c1cc(ccn1)OCc2ncc[nH]2 34a_100000212176_100016991755 [0,0,0,0,0,0|4,0,0]=4 51 B14R2.101 c1cc(ccn1)OCc2ncco2 34a_100000212176_103436540062 [0,0,0,0,0,0|4,0,0]=4 52 B14R2.101 c1cc(ccn1)OCc2nccs2 34a_100000212176_100015184050 [0,0,0,0,0,0|4,0,0]=4 53 B14R2.101 c1cc(ccn1)OCc2ncon2 34a_100000212176_100000233494 [0,0,0,0,0,0|4,0,0]=4 54 B14R2.101 c1cc(ccn1)OCn2cncn2 34a_100000212176_200020645497 [0,0,0,0,0,0|3,0,1]=4 55 B14R2.101 c1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000728582 [0,0,0,0,0,0|2,0,0]=2 56 B14R2.101 c1cc(ccn1)SCc2c[nH]cn2 62a_100000728582_100000707719 [0,0,0,0,0,0|2,0,0]=2 57 B14R2.101 c1cc(ccn1)SCc2ccon2 62a_100000234950_100000728582 [0,0,0,0,0,0|4,0,0]=4 58 B14R2.101 c1cc(ccn1)SCc2ccon2 62a_100000728582_100000234950 [0,0,0,0,0,0|4,0,0]=4 59 B14R2.101 c1cc(ccn1)SCc2ccsc2 62a_100000728582_100011233845 [0,0,0,0,0,0|4,0,0]=4 60 B14R2.101 c1cc(ccn1)SCc2ccsc2 62a_100011261437_100000728582 [0,0,0,0,0,0|4,0,0]=4 61 B14R2.101 c1cc(ccn1)SCc2cncs2 62a_100000728582_100015185245 [0,0,0,0,0,0|3,0,1]=4 62 B14R2.101 c1cc(ccn1)SCc2cncs2 62a_100015185245_100000728582 [0,0,0,0,0,0|3,0,1]=4 63 B14R2.101 c1cc(ccn1)SCc2cscn2 62a_100000205941_100000728582 [0,0,0,0,0,0|3,0,0]=3 64 B14R2.101 c1cc(ccn1)SCc2cscn2 62a_100000728582_100000205941 [0,0,0,0,0,0|3,0,0]=3 65 B14R2.101 c1cc(ccn1)SCc2ncc[nH]2 62a_100000728582_100016991755 [0,0,0,0,0,0|4,0,0]=4 66 B14R2.101 c1cc(ccn1)SCc2ncc[nH]2 62a_100016991755_100000728582 [0,0,0,0,0,0|4,0,0]=4 67 B14R2.101 c1cc(ccn1)SCc2ncco2 62a_100000728582_103436540062 [0,0,0,0,0,0|4,0,0]=4 68 B14R2.101 c1cc(ccn1)SCc2ncco2 62a_103436540062_100000728582 [0,0,0,0,0,0|4,0,0]=4 69 B14R2.101 c1cc(ccn1)SCc2nccs2 62a_100000728582_100015184050 [0,0,0,0,0,0|4,0,0]=4 70 B14R2.101 c1cc(ccn1)SCc2nccs2 62a_100015184050_100000728582 [0,0,0,0,0,0|4,0,0]=4 71 B14R2.101 c1cc(ccn1)SCc2ncon2 62a_100000233494_100000728582 [0,0,0,0,0,0|4,0,0]=4 72 B14R2.101 c1cc(ccn1)SCc2ncon2 62a_100000728582_100000233494 [0,0,0,0,0,0|4,0,0]=4 73 B14R2.101 c1cc(ccn1)SCn2cncn2 62a_100000728582_200020645497 [0,0,0,0,0,0|3,0,1]=4 74 B14R2.101 c1cc(ccn1)SCn2cncn2 62a_200020645497_100000728582 [0,0,0,0,0,0|3,0,1]=4 75 B14R2.101 c1cc(cnn1)OCc2c[nH]cn2 34a_100015204005_100000707719 [0,0,0,0,0,0|3,0,0]=3 76 B14R2.101 c1cc(cnn1)OCc2cscn2 34a_100015204005_100000205941 [0,0,0,0,0,0|4,0,0]=4 77 B14R2.101 c1cc(cnn1)SCc2c[nH]cn2 62a_100000707719_100000732662 [0,0,0,0,0,0|3,0,0]=3 78 B14R2.101 c1cc(cnn1)SCc2c[nH]cn2 62a_100000732662_100000707719 [0,0,0,0,0,0|3,0,0]=3 79 B14R2.101 c1cc(cnn1)SCc2cscn2 62a_100000205941_100000732662 [0,0,0,0,0,0|4,0,0]=4 80 B14R2.101 c1cc(cnn1)SCc2cscn2 62a_100000732662_100000205941 [0,0,0,0,0,0|4,0,0]=4 81 B14R2.101 c1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000703185 [0,0,0,0,0,0|2,0,0]=2 82 B14R2.101 c1cc(ncn1)NCc2c[nH]nn2 27a_100020620823_100000703185 [0,0,0,0,0,0|3,0,0]=3 83 B14R2.101 c1cc(ncn1)NCc2cc[nH]n2 27a_100000739516_100000703185 [0,0,0,0,0,0|4,0,0]=4 84 B14R2.101 c1cc(ncn1)NCc2ccoc2 27a_100015206860_100000703185 [0,0,0,0,0,0|4,0,0]=4 85 B14R2.101 c1cc(ncn1)NCc2ccon2 27a_100000688301_100000703185 [0,0,0,0,0,0|4,0,0]=4 86 B14R2.101 c1cc(ncn1)NCc2ccsc2 27a_100000186416_100000703185 [0,0,0,0,0,0|4,0,0]=4 87 B14R2.101 c1cc(ncn1)NCc2cn[nH]c2 27a_100000737208_100000703185 [0,0,0,0,0,0|4,0,0]=4 88 B14R2.101 c1cc(ncn1)NCc2cnco2 27a_100020634212_100000703185 [0,0,0,0,0,0|3,0,1]=4 89 B14R2.101 c1cc(ncn1)NCc2cncs2 27a_100016987365_100000703185 [0,0,0,0,0,0|3,0,1]=4 90 B14R2.101 c1cc(ncn1)NCc2cocn2 27a_100015188801_100000703185 [0,0,0,0,0,0|3,0,0]=3 91 B14R2.101 c1cc(ncn1)NCc2cscn2 27a_100015185402_100000703185 [0,0,0,0,0,0|3,0,0]=3 92 B14R2.101 c1cc(ncn1)NCc2ncc[nH]2 27a_100000754540_100000703185 [0,0,0,0,0,0|4,0,0]=4 93 B14R2.101 c1cc(ncn1)NCc2ncco2 27a_100016994969_100000703185 [0,0,0,0,0,0|4,0,0]=4 94 B14R2.101 c1cc(ncn1)NCc2nccs2 27a_100000740555_100000703185 [0,0,0,0,0,0|4,0,0]=4 95 B14R2.101 c1cc(ncn1)SCc2c[nH]cn2 62a_100000703185_100000707719 [0,0,0,0,0,0|3,0,0]=3 96 B14R2.101 c1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_100000703185 [0,0,0,0,0,0|3,0,0]=3 97 B14R2.101 c1cc(ncn1)SCc2cscn2 62a_100000205941_100000703185 [0,0,0,0,0,0|4,0,0]=4 98 B14R2.101 c1cc(ncn1)SCc2cscn2 62a_100000703185_100000205941 [0,0,0,0,0,0|4,0,0]=4 99 B14R2.101 c1ccc(cc1)CNc2ncns2 27a_100015324214_100000693119 [0,0,0,0,0,0|3,0,1]=4 100 B14R2.101 c1ccc(cc1)COc2ccsc2 34a_100000106738_100015291786 [0,0,0,0,0,0|4,0,0]=4 101 B14R2.101 c1ccc(cc1)COc2ccsc2 7a_100000106738_100000211182 [0,0,0,0,0,0|4,0,0]=4 102 B14R2.101 c1ccc(cc1)CSc2c[nH]cn2 62a_100000211182_100000756875 [0,0,0,0,0,0|2,0,0]=2 103 B14R2.101 c1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100015291786 [0,0,0,0,0,0|2,0,0]=2 104 B14R2.101 c1ccc(cc1)CSc2c[nH]nn2 62a_100000211182_100009819707 [0,0,0,0,0,0|3,0,0]=3 105 B14R2.101 c1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100015291786 [0,0,0,0,0,0|3,0,0]=3 106 B14R2.101 c1ccc(cc1)CSc2cc[nH]n2 62a_100000062575_100015291786 [0,0,0,0,0,0|4,0,0]=4 107 B14R2.101 c1ccc(cc1)CSc2cc[nH]n2 62a_100000211182_100000062575 [0,0,0,0,0,0|4,0,0]=4 108 B14R2.101 c1ccc(cc1)CSc2ccco2 62a_100000211182_100009814098 [0,0,0,0,0,0|4,0,0]=4 109 B14R2.101 c1ccc(cc1)CSc2ccco2 62a_100009814098_100015291786 [0,0,0,0,0,0|4,0,0]=4 110 B14R2.101 c1ccc(cc1)CSc2cccs2 62a_100000211182_100011215356 [0,0,0,0,0,0|4,0,0]=4 111 B14R2.101 c1ccc(cc1)CSc2cccs2 62a_100011215356_100015291786 [0,0,0,0,0,0|4,0,0]=4 112 B14R2.101 c1ccc(cc1)CSc2ccoc2 62a_100000211182_100011215275 [0,0,0,0,0,0|4,0,0]=4 113 B14R2.101 c1ccc(cc1)CSc2ccoc2 62a_100011215275_100015291786 [0,0,0,0,0,0|4,0,0]=4 114 B14R2.101 c1ccc(cc1)CSc2ccon2 62a_100000211182_100009818083 [0,0,0,0,0,0|4,0,0]=4 115 B14R2.101 c1ccc(cc1)CSc2ccon2 62a_100009818083_100015291786 [0,0,0,0,0,0|4,0,0]=4 116 B14R2.101 c1ccc(cc1)CSc2ccsc2 62a_100000211182_100000738268 [0,0,0,0,0,0|4,0,0]=4 117 B14R2.101 c1ccc(cc1)CSc2ccsc2 62a_100000738268_100015291786 [0,0,0,0,0,0|4,0,0]=4 118 B14R2.101 c1ccc(cc1)CSc2ccsn2 62a_100000211182_100009818082 [0,0,0,0,0,0|4,0,0]=4 119 B14R2.101 c1ccc(cc1)CSc2ccsn2 62a_100009818082_100015291786 [0,0,0,0,0,0|4,0,0]=4 120 B14R2.101 c1ccc(cc1)CSc2cn[nH]c2 62a_100000211182_100000238712 [0,0,0,0,0,0|4,0,0]=4 121 B14R2.101 c1ccc(cc1)CSc2cn[nH]c2 62a_100000238712_100015291786 [0,0,0,0,0,0|4,0,0]=4 122 B14R2.101 c1ccc(cc1)CSc2cnco2 62a_100000211182_100020591547 [0,0,0,0,0,0|3,0,1]=4 123 B14R2.101 c1ccc(cc1)CSc2cnco2 62a_100020591547_100015291786 [0,0,0,0,0,0|3,0,1]=4 124 B14R2.101 c1ccc(cc1)CSc2cncs2 62a_100000211182_100011934649 [0,0,0,0,0,0|3,0,1]=4 125 B14R2.101 c1ccc(cc1)CSc2cncs2 62a_100011934649_100015291786 [0,0,0,0,0,0|3,0,1]=4 126 B14R2.101 c1ccc(cc1)CSc2cscn2 62a_100000211182_100000751502 [0,0,0,0,0,0|3,0,0]=3 127 B14R2.101 c1ccc(cc1)CSc2cscn2 62a_100000751502_100015291786 [0,0,0,0,0,0|3,0,0]=3 128 B14R2.101 c1ccc(cc1)CSc2nc[nH]n2 62a_100000211182_100000761765 [0,0,0,0,0,0|3,0,0]=3 129 B14R2.101 c1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100015291786 [0,0,0,0,0,0|3,0,0]=3 130 B14R2.101 c1ccc(cc1)CSc2ncc[nH]2 62a_100000211182_100025796157 [0,0,0,0,0,0|4,0,0]=4 131 B14R2.101 c1ccc(cc1)CSc2ncc[nH]2 62a_100025796157_100015291786 [0,0,0,0,0,0|4,0,0]=4 132 B14R2.101 c1ccc(cc1)CSc2ncco2 62a_100000211182_100011787736 [0,0,0,0,0,0|4,0,0]=4 133 B14R2.101 c1ccc(cc1)CSc2ncco2 62a_100011787736_100015291786 [0,0,0,0,0,0|4,0,0]=4 134 B14R2.101 c1ccc(cc1)CSc2nccs2 62a_100000211182_100000211983 [0,0,0,0,0,0|4,0,0]=4 135 B14R2.101 c1ccc(cc1)CSc2nccs2 62a_100000211983_100015291786 [0,0,0,0,0,0|4,0,0]=4 136 B14R2.101 c1ccc(cc1)CSc2ncns2 62a_100000211182_100000693119 [0,0,0,0,0,0|3,0,1]=4 137 B14R2.101 c1ccc(cc1)CSc2ncns2 62a_100000693119_100015291786 [0,0,0,0,0,0|3,0,1]=4 138 B14R2.101 c1ccc(cc1)NCC2=NCCN2 34a_100000106764_100000737910 [0,0,0,0,0,0|2,0,1]=3 139 B14R2.101 c1ccc(cc1)NCc2c[nH]cn2 34a_100000106764_100000707719 [0,0,0,0,0,0|0,0,0]=0 140 B14R2.101 c1ccc(cc1)NCc2cc[nH]n2 207a_100000106764_100000738523 [0,0,0,0,0,0|2,0,0]=2 141 B14R2.101 c1ccc(cc1)NCc2ccco2 207a_100000106764_100000186105 [0,0,0,0,0,0|2,0,0]=2 142 B14R2.101 c1ccc(cc1)NCc2ccco2 270302a_100000106764_100000186105 [0,0,0,0,0,0|2,0,0]=2 143 B14R2.101 c1ccc(cc1)NCc2cccs2 207a_100000106764_100000209959 [0,0,0,0,0,0|2,0,0]=2 144 B14R2.101 c1ccc(cc1)NCc2cccs2 270302a_100000106764_100000209959 [0,0,0,0,0,0|2,0,0]=2 145 B14R2.101 c1ccc(cc1)NCc2ccn[nH]2 34a_100000106764_100000728653 [0,0,0,0,0,0|2,0,1]=3 146 B14R2.101 c1ccc(cc1)NCc2ccoc2 207a_100000106764_100011215517 [0,0,0,0,0,0|2,0,0]=2 147 B14R2.101 c1ccc(cc1)NCc2ccon2 34a_100000106764_100000234950 [0,0,0,0,0,0|2,0,0]=2 148 B14R2.101 c1ccc(cc1)NCc2ccsc2 207a_100000106764_100000188534 [0,0,0,0,0,0|2,0,0]=2 149 B14R2.101 c1ccc(cc1)NCc2ccsc2 270302a_100000106764_100000188534 [0,0,0,0,0,0|2,0,0]=2 150 B14R2.101 c1ccc(cc1)NCc2ccsc2 34a_100000106764_100011261437 [0,0,0,0,0,0|2,0,0]=2 151 B14R2.101 c1ccc(cc1)NCc2cn[nH]c2 207a_100000106764_100016992096 [0,0,0,0,0,0|2,0,0]=2 152 B14R2.101 c1ccc(cc1)NCc2cn[nH]c2 270302a_100000106764_100016992096 [0,0,0,0,0,0|2,0,0]=2 153 B14R2.101 c1ccc(cc1)NCc2cnc[nH]2 207a_100000106764_100000742939 [0,0,0,0,0,0|0,0,2]=2 154 B14R2.101 c1ccc(cc1)NCc2cncs2 207a_100000106764_100000749870 [0,0,0,0,0,0|1,0,1]=2 155 B14R2.101 c1ccc(cc1)NCc2cncs2 270302a_100000106764_100000749870 [0,0,0,0,0,0|1,0,1]=2 156 B14R2.101 c1ccc(cc1)NCc2cncs2 34a_100000106764_100015185245 [0,0,0,0,0,0|1,0,1]=2 157 B14R2.101 c1ccc(cc1)NCc2cscn2 207a_100000106764_100000743575 [0,0,0,0,0,0|1,0,0]=1 158 B14R2.101 c1ccc(cc1)NCc2cscn2 270302a_100000106764_100000743575 [0,0,0,0,0,0|1,0,0]=1 159 B14R2.101 c1ccc(cc1)NCc2cscn2 34a_100000106764_100000205941 [0,0,0,0,0,0|1,0,0]=1 160 B14R2.101 c1ccc(cc1)NCc2ncc[nH]2 207a_100000106764_100000743867 [0,0,0,0,0,0|2,0,0]=2 161 B14R2.101 c1ccc(cc1)NCc2ncc[nH]2 34a_100000106764_100016991755 [0,0,0,0,0,0|2,0,0]=2 162 B14R2.101 c1ccc(cc1)NCc2ncco2 34a_100000106764_103436540062 [0,0,0,0,0,0|2,0,0]=2 163 B14R2.101 c1ccc(cc1)NCc2nccs2 207a_100000106764_100000750902 [0,0,0,0,0,0|2,0,0]=2 164 B14R2.101 c1ccc(cc1)NCc2nccs2 270302a_100000106764_100000750902 [0,0,0,0,0,0|2,0,0]=2 165 B14R2.101 c1ccc(cc1)NCc2nccs2 34a_100000106764_100015184050 [0,0,0,0,0,0|2,0,0]=2 166 B14R2.101 c1ccc(cc1)NCc2ncon2 34a_100000106764_100000233494 [0,0,0,0,0,0|2,0,0]=2 167 B14R2.101 c1ccc(cc1)NCc2nnn[nH]2 34a_100000106764_100000765167 [0,0,0,0,0,0|2,0,1]=3 168 B14R2.101 c1ccc(cc1)NCn2cncn2 34a_100000106764_200020645497 [0,0,0,0,0,0|1,0,1]=2 169 B14R2.101 c1ccc(cc1)OCC2=NCCN2 34a_100000210340_100000737910 [0,0,0,0,0,0|3,0,1]=4 170 B14R2.101 c1ccc(cc1)OCC2=NCCN2 7a_100000210340_100000737910 [0,0,0,0,0,0|3,0,1]=4 171 B14R2.101 c1ccc(cc1)OCc2c[nH]cn2 34a_100000210340_100000707719 [0,0,0,0,0,0|1,0,0]=1 172 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 34a_100000210340_100000728653 [0,0,0,0,0,0|3,0,1]=4 173 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 7a_100000210340_100000728653 [0,0,0,0,0,0|3,0,1]=4 174 B14R2.101 c1ccc(cc1)OCc2ccon2 34a_100000210340_100000234950 [0,0,0,0,0,0|3,0,0]=3 175 B14R2.101 c1ccc(cc1)OCc2ccon2 7a_100000210340_100000234950 [0,0,0,0,0,0|3,0,0]=3 176 B14R2.101 c1ccc(cc1)OCc2ccsc2 34a_100000210340_100011261437 [0,0,0,0,0,0|3,0,0]=3 177 B14R2.101 c1ccc(cc1)OCc2ccsc2 7a_100000210340_100011261437 [0,0,0,0,0,0|3,0,0]=3 178 B14R2.101 c1ccc(cc1)OCc2cncs2 34a_100000210340_100015185245 [0,0,0,0,0,0|2,0,1]=3 179 B14R2.101 c1ccc(cc1)OCc2cncs2 7a_100000210340_100015185245 [0,0,0,0,0,0|2,0,1]=3 180 B14R2.101 c1ccc(cc1)OCc2cscn2 34a_100000210340_100000205941 [0,0,0,0,0,0|2,0,0]=2 181 B14R2.101 c1ccc(cc1)OCc2cscn2 7a_100000210340_100000205941 [0,0,0,0,0,0|2,0,0]=2 182 B14R2.101 c1ccc(cc1)OCc2ncc[nH]2 34a_100000210340_100016991755 [0,0,0,0,0,0|3,0,0]=3 183 B14R2.101 c1ccc(cc1)OCc2ncc[nH]2 7a_100000210340_100000753453 [0,0,0,0,0,0|3,0,0]=3 184 B14R2.101 c1ccc(cc1)OCc2ncco2 34a_100000210340_103436540062 [0,0,0,0,0,0|3,0,0]=3 185 B14R2.101 c1ccc(cc1)OCc2ncco2 7a_100000210340_103436540062 [0,0,0,0,0,0|3,0,0]=3 186 B14R2.101 c1ccc(cc1)OCc2nccs2 34a_100000210340_100015184050 [0,0,0,0,0,0|3,0,0]=3 187 B14R2.101 c1ccc(cc1)OCc2nccs2 7a_100000210340_100015184050 [0,0,0,0,0,0|3,0,0]=3 188 B14R2.101 c1ccc(cc1)OCc2ncon2 34a_100000210340_100000233494 [0,0,0,0,0,0|3,0,0]=3 189 B14R2.101 c1ccc(cc1)OCc2nnn[nH]2 34a_100000210340_100000765167 [0,0,0,0,0,0|3,0,1]=4 190 B14R2.101 c1ccc(cc1)OCc2nnn[nH]2 7a_100000210340_100000765167 [0,0,0,0,0,0|3,0,1]=4 191 B14R2.101 c1ccc(cc1)OCn2cncn2 34a_100000210340_200020645497 [0,0,0,0,0,0|2,0,1]=3 192 B14R2.101 c1ccc(cc1)OCn2cncn2 7a_100000210340_200020645497 [0,0,0,0,0,0|2,0,1]=3 193 B14R2.101 c1ccc(cc1)SCC2=NCCN2 62a_100000719477_100000737910 [0,0,0,0,0,0|3,0,1]=4 194 B14R2.101 c1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000041952 [0,0,0,0,0,0|3,0,1]=4 195 B14R2.101 c1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000041952 [0,0,0,0,0,0|1,0,0]=1 196 B14R2.101 c1ccc(cc1)SCc2c[nH]cn2 62a_100000719477_100000707719 [0,0,0,0,0,0|1,0,0]=1 197 B14R2.101 c1ccc(cc1)SCc2ccn[nH]2 62a_100000719477_100000728653 [0,0,0,0,0,0|3,0,1]=4 198 B14R2.101 c1ccc(cc1)SCc2ccn[nH]2 62a_100000728653_100000041952 [0,0,0,0,0,0|3,0,1]=4 199 B14R2.101 c1ccc(cc1)SCc2ccon2 62a_100000234950_100000041952 [0,0,0,0,0,0|3,0,0]=3 200 B14R2.101 c1ccc(cc1)SCc2ccon2 62a_100000719477_100000234950 [0,0,0,0,0,0|3,0,0]=3 201 B14R2.101 c1ccc(cc1)SCc2ccsc2 62a_100000719477_100011233845 [0,0,0,0,0,0|3,0,0]=3 202 B14R2.101 c1ccc(cc1)SCc2ccsc2 62a_100011261437_100000041952 [0,0,0,0,0,0|3,0,0]=3 203 B14R2.101 c1ccc(cc1)SCc2cncs2 62a_100000719477_100015185245 [0,0,0,0,0,0|2,0,1]=3 204 B14R2.101 c1ccc(cc1)SCc2cncs2 62a_100015185245_100000041952 [0,0,0,0,0,0|2,0,1]=3 205 B14R2.101 c1ccc(cc1)SCc2cscn2 62a_100000205941_100000041952 [0,0,0,0,0,0|2,0,0]=2 206 B14R2.101 c1ccc(cc1)SCc2cscn2 62a_100000719477_100000205941 [0,0,0,0,0,0|2,0,0]=2 207 B14R2.101 c1ccc(cc1)SCc2ncc[nH]2 62a_100000719477_100016991755 [0,0,0,0,0,0|3,0,0]=3 208 B14R2.101 c1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000041952 [0,0,0,0,0,0|3,0,0]=3 209 B14R2.101 c1ccc(cc1)SCc2ncco2 62a_100000719477_103436540062 [0,0,0,0,0,0|3,0,0]=3 210 B14R2.101 c1ccc(cc1)SCc2ncco2 62a_103436540062_100000041952 [0,0,0,0,0,0|3,0,0]=3 211 B14R2.101 c1ccc(cc1)SCc2nccs2 62a_100000719477_100015184050 [0,0,0,0,0,0|3,0,0]=3 212 B14R2.101 c1ccc(cc1)SCc2nccs2 62a_100015184050_100000041952 [0,0,0,0,0,0|3,0,0]=3 213 B14R2.101 c1ccc(cc1)SCc2ncon2 62a_100000233494_100000041952 [0,0,0,0,0,0|3,0,0]=3 214 B14R2.101 c1ccc(cc1)SCc2ncon2 62a_100000719477_100000233494 [0,0,0,0,0,0|3,0,0]=3 215 B14R2.101 c1ccc(cc1)SCc2nnn[nH]2 62a_100000719477_100000765167 [0,0,0,0,0,0|3,0,1]=4 216 B14R2.101 c1ccc(cc1)SCc2nnn[nH]2 62a_100000765167_100000041952 [0,0,0,0,0,0|3,0,1]=4 217 B14R2.101 c1ccc(cc1)SCn2cncn2 62a_100000719477_200020645497 [0,0,0,0,0,0|2,0,1]=3 218 B14R2.101 c1ccc(cc1)SCn2cncn2 62a_200020645497_100000041952 [0,0,0,0,0,0|2,0,1]=3 219 B14R2.101 c1ccc(nc1)CSc2c[nH]cn2 62a_100000721315_100000756875 [0,0,0,0,0,0|3,0,0]=3 220 B14R2.101 c1ccc(nc1)CSc2c[nH]cn2 62a_100000756875_100000721315 [0,0,0,0,0,0|3,0,0]=3 221 B14R2.101 c1ccc(nc1)CSc2c[nH]nn2 62a_100000721315_100009819707 [0,0,0,0,0,0|4,0,0]=4 222 B14R2.101 c1ccc(nc1)CSc2c[nH]nn2 62a_100009819707_100000721315 [0,0,0,0,0,0|4,0,0]=4 223 B14R2.101 c1ccc(nc1)CSc2cscn2 62a_100000721315_100000751502 [0,0,0,0,0,0|4,0,0]=4 224 B14R2.101 c1ccc(nc1)CSc2cscn2 62a_100000751502_100000721315 [0,0,0,0,0,0|4,0,0]=4 225 B14R2.101 c1ccc(nc1)CSc2nc[nH]n2 62a_100000721315_100000761765 [0,0,0,0,0,0|4,0,0]=4 226 B14R2.101 c1ccc(nc1)CSc2nc[nH]n2 62a_100000761765_100000721315 [0,0,0,0,0,0|4,0,0]=4 227 B14R2.101 c1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100011216584 [0,0,0,0,0,0|2,0,0]=2 228 B14R2.101 c1ccc(nc1)SCc2c[nH]cn2 62a_100011216584_100000707719 [0,0,0,0,0,0|2,0,0]=2 229 B14R2.101 c1ccc(nc1)SCc2ccon2 62a_100000234950_100011216584 [0,0,0,0,0,0|4,0,0]=4 230 B14R2.101 c1ccc(nc1)SCc2ccon2 62a_100011216584_100000234950 [0,0,0,0,0,0|4,0,0]=4 231 B14R2.101 c1ccc(nc1)SCc2ccsc2 62a_100011216584_100011233845 [0,0,0,0,0,0|4,0,0]=4 232 B14R2.101 c1ccc(nc1)SCc2ccsc2 62a_100011261437_100011216584 [0,0,0,0,0,0|4,0,0]=4 233 B14R2.101 c1ccc(nc1)SCc2cncs2 62a_100011216584_100015185245 [0,0,0,0,0,0|3,0,1]=4 234 B14R2.101 c1ccc(nc1)SCc2cncs2 62a_100015185245_100011216584 [0,0,0,0,0,0|3,0,1]=4 235 B14R2.101 c1ccc(nc1)SCc2cscn2 62a_100000205941_100011216584 [0,0,0,0,0,0|3,0,0]=3 236 B14R2.101 c1ccc(nc1)SCc2cscn2 62a_100011216584_100000205941 [0,0,0,0,0,0|3,0,0]=3 237 B14R2.101 c1ccc(nc1)SCc2ncc[nH]2 62a_100011216584_100016991755 [0,0,0,0,0,0|4,0,0]=4 238 B14R2.101 c1ccc(nc1)SCc2ncc[nH]2 62a_100016991755_100011216584 [0,0,0,0,0,0|4,0,0]=4 239 B14R2.101 c1ccc(nc1)SCc2ncco2 62a_100011216584_103436540062 [0,0,0,0,0,0|4,0,0]=4 240 B14R2.101 c1ccc(nc1)SCc2ncco2 62a_103436540062_100011216584 [0,0,0,0,0,0|4,0,0]=4 241 B14R2.101 c1ccc(nc1)SCc2nccs2 62a_100011216584_100015184050 [0,0,0,0,0,0|4,0,0]=4 242 B14R2.101 c1ccc(nc1)SCc2nccs2 62a_100015184050_100011216584 [0,0,0,0,0,0|4,0,0]=4 243 B14R2.101 c1ccc(nc1)SCc2ncon2 62a_100000233494_100011216584 [0,0,0,0,0,0|4,0,0]=4 244 B14R2.101 c1ccc(nc1)SCc2ncon2 62a_100011216584_100000233494 [0,0,0,0,0,0|4,0,0]=4 245 B14R2.101 c1ccc(nc1)SCn2cncn2 62a_100011216584_200020645497 [0,0,0,0,0,0|3,0,1]=4 246 B14R2.101 c1ccc(nc1)SCn2cncn2 62a_200020645497_100011216584 [0,0,0,0,0,0|3,0,1]=4 247 B14R2.101 c1cnc(cn1)CSc2c[nH]cn2 62a_100000756875_100016995436 [0,0,0,0,0,0|4,0,0]=4 248 B14R2.101 c1cnc(cn1)CSc2c[nH]cn2 62a_100016995436_100000756875 [0,0,0,0,0,0|4,0,0]=4 249 B14R2.101 c1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100000211759 [0,0,0,0,0,0|2,0,0]=2 250 B14R2.101 c1cnc(cn1)NCc2c[nH]nn2 27a_100020620823_100000211759 [0,0,0,0,0,0|3,0,0]=3 251 B14R2.101 c1cnc(cn1)NCc2cc[nH]n2 27a_100000739516_100000211759 [0,0,0,0,0,0|4,0,0]=4 252 B14R2.101 c1cnc(cn1)NCc2ccoc2 27a_100015206860_100000211759 [0,0,0,0,0,0|4,0,0]=4 253 B14R2.101 c1cnc(cn1)NCc2ccon2 27a_100000688301_100000211759 [0,0,0,0,0,0|4,0,0]=4 254 B14R2.101 c1cnc(cn1)NCc2ccsc2 27a_100000186416_100000211759 [0,0,0,0,0,0|4,0,0]=4 255 B14R2.101 c1cnc(cn1)NCc2cn[nH]c2 27a_100000737208_100000211759 [0,0,0,0,0,0|4,0,0]=4 256 B14R2.101 c1cnc(cn1)NCc2cnco2 27a_100020634212_100000211759 [0,0,0,0,0,0|3,0,1]=4 257 B14R2.101 c1cnc(cn1)NCc2cncs2 27a_100016987365_100000211759 [0,0,0,0,0,0|3,0,1]=4 258 B14R2.101 c1cnc(cn1)NCc2cocn2 27a_100015188801_100000211759 [0,0,0,0,0,0|3,0,0]=3 259 B14R2.101 c1cnc(cn1)NCc2cscn2 27a_100015185402_100000211759 [0,0,0,0,0,0|3,0,0]=3 260 B14R2.101 c1cnc(cn1)NCc2ncc[nH]2 27a_100000754540_100000211759 [0,0,0,0,0,0|4,0,0]=4 261 B14R2.101 c1cnc(cn1)NCc2ncco2 27a_100016994969_100000211759 [0,0,0,0,0,0|4,0,0]=4 262 B14R2.101 c1cnc(cn1)NCc2nccs2 27a_100000740555_100000211759 [0,0,0,0,0,0|4,0,0]=4 263 B14R2.101 c1cnc(cn1)SCc2c[nH]cn2 62a_100000211759_100000707719 [0,0,0,0,0,0|3,0,0]=3 264 B14R2.101 c1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100000211759 [0,0,0,0,0,0|3,0,0]=3 265 B14R2.101 c1cnc(cn1)SCc2cscn2 62a_100000205941_100000211759 [0,0,0,0,0,0|4,0,0]=4 266 B14R2.101 c1cnc(cn1)SCc2cscn2 62a_100000211759_100000205941 [0,0,0,0,0,0|4,0,0]=4 267 B14R2.101 c1cnc(nc1)CSc2c[nH]cn2 62a_100000703007_100000756875 [0,0,0,0,0,0|4,0,0]=4 268 B14R2.101 c1cnc(nc1)CSc2c[nH]cn2 62a_100000756875_100000703007 [0,0,0,0,0,0|4,0,0]=4 269 B14R2.101 c1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000211032 [0,0,0,0,0,0|2,0,0]=2 270 B14R2.101 c1cnc(nc1)NCc2c[nH]nn2 27a_100020620823_100000211032 [0,0,0,0,0,0|3,0,0]=3 271 B14R2.101 c1cnc(nc1)NCc2cc[nH]n2 27a_100000739516_100000211032 [0,0,0,0,0,0|4,0,0]=4 272 B14R2.101 c1cnc(nc1)NCc2ccco2 27a_100000185738_100000211032 [0,0,0,0,0,0|4,0,0]=4 273 B14R2.101 c1cnc(nc1)NCc2cccs2 27a_100000211653_100000211032 [0,0,0,0,0,0|4,0,0]=4 274 B14R2.101 c1cnc(nc1)NCc2ccoc2 27a_100015206860_100000211032 [0,0,0,0,0,0|4,0,0]=4 275 B14R2.101 c1cnc(nc1)NCc2ccon2 27a_100000688301_100000211032 [0,0,0,0,0,0|4,0,0]=4 276 B14R2.101 c1cnc(nc1)NCc2ccsc2 27a_100000186416_100000211032 [0,0,0,0,0,0|4,0,0]=4 277 B14R2.101 c1cnc(nc1)NCc2cn[nH]c2 27a_100000737208_100000211032 [0,0,0,0,0,0|4,0,0]=4 278 B14R2.101 c1cnc(nc1)NCc2cnco2 27a_100020634212_100000211032 [0,0,0,0,0,0|3,0,1]=4 279 B14R2.101 c1cnc(nc1)NCc2cncs2 27a_100016987365_100000211032 [0,0,0,0,0,0|3,0,1]=4 280 B14R2.101 c1cnc(nc1)NCc2cocn2 27a_100015188801_100000211032 [0,0,0,0,0,0|3,0,0]=3 281 B14R2.101 c1cnc(nc1)NCc2cscn2 27a_100015185402_100000211032 [0,0,0,0,0,0|3,0,0]=3 282 B14R2.101 c1cnc(nc1)NCc2ncc[nH]2 27a_100000754540_100000211032 [0,0,0,0,0,0|4,0,0]=4 283 B14R2.101 c1cnc(nc1)NCc2ncco2 27a_100016994969_100000211032 [0,0,0,0,0,0|4,0,0]=4 284 B14R2.101 c1cnc(nc1)NCc2nccs2 27a_100000740555_100000211032 [0,0,0,0,0,0|4,0,0]=4 285 B14R2.101 c1cnc(nc1)SCc2c[nH]cn2 62a_100000211032_100000707719 [0,0,0,0,0,0|3,0,0]=3 286 B14R2.101 c1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000211032 [0,0,0,0,0,0|3,0,0]=3 287 B14R2.101 c1cnc(nc1)SCc2cscn2 62a_100000205941_100000211032 [0,0,0,0,0,0|4,0,0]=4 288 B14R2.101 c1cnc(nc1)SCc2cscn2 62a_100000211032_100000205941 [0,0,0,0,0,0|4,0,0]=4 289 B14R2.101 c1cncc(c1)CSc2c[nH]cn2 62a_100000741622_100000756875 [0,0,0,0,0,0|3,0,0]=3 290 B14R2.101 c1cncc(c1)CSc2c[nH]cn2 62a_100000756875_100000741622 [0,0,0,0,0,0|3,0,0]=3 291 B14R2.101 c1cncc(c1)CSc2c[nH]nn2 62a_100000741622_100009819707 [0,0,0,0,0,0|4,0,0]=4 292 B14R2.101 c1cncc(c1)CSc2c[nH]nn2 62a_100009819707_100000741622 [0,0,0,0,0,0|4,0,0]=4 293 B14R2.101 c1cncc(c1)CSc2cscn2 62a_100000741622_100000751502 [0,0,0,0,0,0|4,0,0]=4 294 B14R2.101 c1cncc(c1)CSc2cscn2 62a_100000751502_100000741622 [0,0,0,0,0,0|4,0,0]=4 295 B14R2.101 c1cncc(c1)CSc2nc[nH]n2 62a_100000741622_100000761765 [0,0,0,0,0,0|4,0,0]=4 296 B14R2.101 c1cncc(c1)CSc2nc[nH]n2 62a_100000761765_100000741622 [0,0,0,0,0,0|4,0,0]=4 297 B14R2.101 c1cncc(c1)OCc2c[nH]cn2 34a_100000210849_100000707719 [0,0,0,0,0,0|2,0,0]=2 298 B14R2.101 c1cncc(c1)OCc2ccon2 34a_100000210849_100000234950 [0,0,0,0,0,0|4,0,0]=4 299 B14R2.101 c1cncc(c1)OCc2ccon2 7a_100000210849_100000234950 [0,0,0,0,0,0|4,0,0]=4 300 B14R2.101 c1cncc(c1)OCc2ccsc2 34a_100000210849_100011261437 [0,0,0,0,0,0|4,0,0]=4 301 B14R2.101 c1cncc(c1)OCc2ccsc2 7a_100000210849_100011261437 [0,0,0,0,0,0|4,0,0]=4 302 B14R2.101 c1cncc(c1)OCc2cncs2 34a_100000210849_100015185245 [0,0,0,0,0,0|3,0,1]=4 303 B14R2.101 c1cncc(c1)OCc2cncs2 7a_100000210849_100015185245 [0,0,0,0,0,0|3,0,1]=4 304 B14R2.101 c1cncc(c1)OCc2cscn2 34a_100000210849_100000205941 [0,0,0,0,0,0|3,0,0]=3 305 B14R2.101 c1cncc(c1)OCc2cscn2 7a_100000210849_100000205941 [0,0,0,0,0,0|3,0,0]=3 306 B14R2.101 c1cncc(c1)OCc2ncc[nH]2 34a_100000210849_100016991755 [0,0,0,0,0,0|4,0,0]=4 307 B14R2.101 c1cncc(c1)OCc2ncc[nH]2 7a_100000210849_100000753453 [0,0,0,0,0,0|4,0,0]=4 308 B14R2.101 c1cncc(c1)OCc2ncco2 34a_100000210849_103436540062 [0,0,0,0,0,0|4,0,0]=4 309 B14R2.101 c1cncc(c1)OCc2ncco2 7a_100000210849_103436540062 [0,0,0,0,0,0|4,0,0]=4 310 B14R2.101 c1cncc(c1)OCc2nccs2 34a_100000210849_100015184050 [0,0,0,0,0,0|4,0,0]=4 311 B14R2.101 c1cncc(c1)OCc2nccs2 7a_100000210849_100015184050 [0,0,0,0,0,0|4,0,0]=4 312 B14R2.101 c1cncc(c1)OCc2ncon2 34a_100000210849_100000233494 [0,0,0,0,0,0|4,0,0]=4 313 B14R2.101 c1cncc(c1)OCn2cncn2 34a_100000210849_200020645497 [0,0,0,0,0,0|3,0,1]=4 314 B14R2.101 c1cncc(c1)OCn2cncn2 7a_100000210849_200020645497 [0,0,0,0,0,0|3,0,1]=4 315 B14R2.101 c1cncc(c1)SCc2c[nH]cn2 62a_100000210063_100000707719 [0,0,0,0,0,0|2,0,0]=2 316 B14R2.101 c1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000210063 [0,0,0,0,0,0|2,0,0]=2 317 B14R2.101 c1cncc(c1)SCc2ccon2 62a_100000210063_100000234950 [0,0,0,0,0,0|4,0,0]=4 318 B14R2.101 c1cncc(c1)SCc2ccon2 62a_100000234950_100000210063 [0,0,0,0,0,0|4,0,0]=4 319 B14R2.101 c1cncc(c1)SCc2ccsc2 62a_100000210063_100011233845 [0,0,0,0,0,0|4,0,0]=4 320 B14R2.101 c1cncc(c1)SCc2ccsc2 62a_100011261437_100000210063 [0,0,0,0,0,0|4,0,0]=4 321 B14R2.101 c1cncc(c1)SCc2cncs2 62a_100000210063_100015185245 [0,0,0,0,0,0|3,0,1]=4 322 B14R2.101 c1cncc(c1)SCc2cncs2 62a_100015185245_100000210063 [0,0,0,0,0,0|3,0,1]=4 323 B14R2.101 c1cncc(c1)SCc2cscn2 62a_100000205941_100000210063 [0,0,0,0,0,0|3,0,0]=3 324 B14R2.101 c1cncc(c1)SCc2cscn2 62a_100000210063_100000205941 [0,0,0,0,0,0|3,0,0]=3 325 B14R2.101 c1cncc(c1)SCc2ncc[nH]2 62a_100000210063_100016991755 [0,0,0,0,0,0|4,0,0]=4 326 B14R2.101 c1cncc(c1)SCc2ncc[nH]2 62a_100016991755_100000210063 [0,0,0,0,0,0|4,0,0]=4 327 B14R2.101 c1cncc(c1)SCc2ncco2 62a_100000210063_103436540062 [0,0,0,0,0,0|4,0,0]=4 328 B14R2.101 c1cncc(c1)SCc2ncco2 62a_103436540062_100000210063 [0,0,0,0,0,0|4,0,0]=4 329 B14R2.101 c1cncc(c1)SCc2nccs2 62a_100000210063_100015184050 [0,0,0,0,0,0|4,0,0]=4 330 B14R2.101 c1cncc(c1)SCc2nccs2 62a_100015184050_100000210063 [0,0,0,0,0,0|4,0,0]=4 331 B14R2.101 c1cncc(c1)SCc2ncon2 62a_100000210063_100000233494 [0,0,0,0,0,0|4,0,0]=4 332 B14R2.101 c1cncc(c1)SCc2ncon2 62a_100000233494_100000210063 [0,0,0,0,0,0|4,0,0]=4 333 B14R2.101 c1cncc(c1)SCn2cncn2 62a_100000210063_200020645497 [0,0,0,0,0,0|3,0,1]=4 334 B14R2.101 c1cncc(c1)SCn2cncn2 62a_200020645497_100000210063 [0,0,0,0,0,0|3,0,1]=4 335 B14R2.101 c1cnnc(c1)CSc2c[nH]cn2 62a_100000756875_100016990269 [0,0,0,0,0,0|4,0,0]=4 336 B14R2.101 c1cnnc(c1)CSc2c[nH]cn2 62a_100016990269_100000756875 [0,0,0,0,0,0|4,0,0]=4 337 B14R2.101 c1cnnc(c1)NCc2c[nH]cn2 27a_100000758547_100016991348 [0,0,0,0,0,0|2,0,0]=2 338 B14R2.101 c1cnnc(c1)NCc2c[nH]nn2 27a_100020620823_100016991348 [0,0,0,0,0,0|3,0,0]=3 339 B14R2.101 c1cnnc(c1)NCc2cc[nH]n2 27a_100000739516_100016991348 [0,0,0,0,0,0|4,0,0]=4 340 B14R2.101 c1cnnc(c1)NCc2ccco2 27a_100000185738_100016991348 [0,0,0,0,0,0|4,0,0]=4 341 B14R2.101 c1cnnc(c1)NCc2cccs2 27a_100000211653_100016991348 [0,0,0,0,0,0|4,0,0]=4 342 B14R2.101 c1cnnc(c1)NCc2ccoc2 27a_100015206860_100016991348 [0,0,0,0,0,0|4,0,0]=4 343 B14R2.101 c1cnnc(c1)NCc2ccon2 27a_100000688301_100016991348 [0,0,0,0,0,0|4,0,0]=4 344 B14R2.101 c1cnnc(c1)NCc2ccsc2 27a_100000186416_100016991348 [0,0,0,0,0,0|4,0,0]=4 345 B14R2.101 c1cnnc(c1)NCc2cn[nH]c2 27a_100000737208_100016991348 [0,0,0,0,0,0|4,0,0]=4 346 B14R2.101 c1cnnc(c1)NCc2cnco2 27a_100020634212_100016991348 [0,0,0,0,0,0|3,0,1]=4 347 B14R2.101 c1cnnc(c1)NCc2cncs2 27a_100016987365_100016991348 [0,0,0,0,0,0|3,0,1]=4 348 B14R2.101 c1cnnc(c1)NCc2cocn2 27a_100015188801_100016991348 [0,0,0,0,0,0|3,0,0]=3 349 B14R2.101 c1cnnc(c1)NCc2cscn2 27a_100015185402_100016991348 [0,0,0,0,0,0|3,0,0]=3 350 B14R2.101 c1cnnc(c1)NCc2ncc[nH]2 27a_100000754540_100016991348 [0,0,0,0,0,0|4,0,0]=4 351 B14R2.101 c1cnnc(c1)NCc2ncco2 27a_100016994969_100016991348 [0,0,0,0,0,0|4,0,0]=4 352 B14R2.101 c1cnnc(c1)NCc2nccs2 27a_100000740555_100016991348 [0,0,0,0,0,0|4,0,0]=4 353 B14R2.101 c1cnnc(c1)SCc2c[nH]cn2 62a_100000707719_100016991348 [0,0,0,0,0,0|3,0,0]=3 354 B14R2.101 c1cnnc(c1)SCc2c[nH]cn2 62a_100016991348_100000707719 [0,0,0,0,0,0|3,0,0]=3 355 B14R2.101 c1cnnc(c1)SCc2cscn2 62a_100000205941_100016991348 [0,0,0,0,0,0|4,0,0]=4 356 B14R2.101 c1cnnc(c1)SCc2cscn2 62a_100016991348_100000205941 [0,0,0,0,0,0|4,0,0]=4 357 B14R2.101 c1coc(c1)CNc2ccncn2 27a_100000185738_100000703185 [0,0,0,0,0,0|4,0,0]=4 358 B14R2.101 c1coc(c1)CNc2cnccn2 27a_100000185738_100000211759 [0,0,0,0,0,0|4,0,0]=4 359 B14R2.101 c1csc(c1)CNc2ccncn2 27a_100000211653_100000703185 [0,0,0,0,0,0|4,0,0]=4 360 B14R2.101 c1csc(c1)CNc2cnccn2 27a_100000211653_100000211759 [0,0,0,0,0,0|4,0,0]=4 361 B14R2.101 c1nc(c[nH]1)CSc2cnnnc2 62a_100000707719_100009846058 [0,0,0,0,0,0|4,0,0]=4 362 B14R2.101 c1nc(c[nH]1)CSc2cnnnc2 62a_100009846058_100000707719 [0,0,0,0,0,0|4,0,0]=4 363 B14R2.101 c1ncc(cn1)CSc2c[nH]cn2 62a_100000756875_100015196519 [0,0,0,0,0,0|4,0,0]=4 364 B14R2.101 c1ncc(cn1)CSc2c[nH]cn2 62a_100015196519_100000756875 [0,0,0,0,0,0|4,0,0]=4 365 B14R2.101 c1ncc(cn1)OCc2cscn2 7a_100000754086_100000205941 [0,0,0,0,0,0|4,0,0]=4 366 B14R2.101 c1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_100011206942 [0,0,0,0,0,0|3,0,0]=3 367 B14R2.101 c1ncc(cn1)SCc2c[nH]cn2 62a_100011206942_100000707719 [0,0,0,0,0,0|3,0,0]=3 368 B14R2.101 c1ncc(cn1)SCc2cscn2 62a_100000205941_100011206942 [0,0,0,0,0,0|4,0,0]=4 369 B14R2.101 c1ncc(cn1)SCc2cscn2 62a_100011206942_100000205941 [0,0,0,0,0,0|4,0,0]=4 370 B15R2.55 Brc1ccsc1CNc2ccccc2 207a_100000106764_100000766043 [0,1,0,0,0,0|2,0,0]=3 371 B15R2.55 Brc1ccsc1CNc2ccccc2 270302a_100000106764_100000766043 [0,1,0,0,0,0|2,0,0]=3 372 B15R2.55 Brc1cn[nH]c1CNc2ccccc2 207a_100000106764_100000732679 [0,1,0,0,0,0|2,0,1]=4 373 B15R2.55 Brc1cscc1CNc2ccccc2 207a_100000106764_100000685484 [0,1,0,0,0,0|2,0,0]=3 374 B15R2.55 Brc1cscc1CNc2ccccc2 270302a_100000106764_100000685484 [0,1,0,0,0,0|2,0,0]=3 375 B15R2.55 Brc1sccc1CNc2ccccc2 207a_100000106764_100009816921 [0,1,0,0,0,0|2,0,0]=3 376 B15R2.55 Brc1sccc1CNc2ccccc2 270302a_100000106764_100009816921 [0,1,0,0,0,0|2,0,0]=3 377 B15R2.55 Brc1sccc1CNc2ccccc2 34a_100000106764_100009814289 [0,1,0,0,0,0|2,0,0]=3 378 B15R2.55 Brc1sccc1COc2ccccc2 34a_100000210340_100009814289 [0,1,0,0,0,0|3,0,0]=4 379 B15R2.55 Brc1sccc1COc2ccccc2 7a_100000210340_100009814289 [0,1,0,0,0,0|3,0,0]=4 380 B15R2.55 Brc1sccc1CSc2ccccc2 62a_100000719477_100009814289 [0,1,0,0,0,0|3,0,0]=4 381 B15R2.55 Brc1sccc1CSc2ccccc2 62a_100009814289_100000041952 [0,1,0,0,0,0|3,0,0]=4 382 B15R2.55 Cc1[nH]cnc1C#Cc2ccccc2 271570a_100000069678_100009816806 [0,1,0,0,0,0|1,0,1]=3 383 B15R2.55 Cc1[nH]cnc1C=Cc2ccccc2 271570a_100102527694_100009816806 [0,1,0,0,0,0|1,0,1]=3 384 B15R2.55 Cc1[nH]cnc1C=Cc2cccnc2 271570a_100102525586_100009816806 [0,1,0,0,0,0|2,0,1]=4 385 B15R2.55 Cc1[nH]cnc1CNc2ccccc2 207a_100000106764_100000032982 [0,1,0,0,0,0|0,0,0]=1 386 B15R2.55 Cc1[nH]cnc1CSc2ccccc2 62a_100000719477_100000751220 [0,1,0,0,0,0|1,0,0]=2 387 B15R2.55 Cc1[nH]cnc1CSc2ccccc2 62a_100000751220_100000041952 [0,1,0,0,0,0|1,0,0]=2 388 B15R2.55 Cc1[nH]cnc1CSc2ccccn2 62a_100000751220_100011216584 [0,1,0,0,0,0|2,0,0]=3 389 B15R2.55 Cc1[nH]cnc1CSc2ccccn2 62a_100011216584_100000751220 [0,1,0,0,0,0|2,0,0]=3 390 B15R2.55 Cc1[nH]cnc1CSc2cccnc2 62a_100000210063_100000751220 [0,1,0,0,0,0|2,0,0]=3 391 B15R2.55 Cc1[nH]cnc1CSc2cccnc2 62a_100000751220_100000210063 [0,1,0,0,0,0|2,0,0]=3 392 B15R2.55 Cc1[nH]cnc1CSc2cccnn2 62a_100000751220_100016991348 [0,1,0,0,0,0|3,0,0]=4 393 B15R2.55 Cc1[nH]cnc1CSc2cccnn2 62a_100016991348_100000751220 [0,1,0,0,0,0|3,0,0]=4 394 B15R2.55 Cc1[nH]cnc1CSc2ccncc2 62a_100000728582_100000751220 [0,1,0,0,0,0|2,0,0]=3 395 B15R2.55 Cc1[nH]cnc1CSc2ccncc2 62a_100000751220_100000728582 [0,1,0,0,0,0|2,0,0]=3 396 B15R2.55 Cc1[nH]cnc1CSc2ccncn2 62a_100000703185_100000751220 [0,1,0,0,0,0|3,0,0]=4 397 B15R2.55 Cc1[nH]cnc1CSc2ccncn2 62a_100000751220_100000703185 [0,1,0,0,0,0|3,0,0]=4 398 B15R2.55 Cc1[nH]cnc1CSc2ccnnc2 62a_100000732662_100000751220 [0,1,0,0,0,0|3,0,0]=4 399 B15R2.55 Cc1[nH]cnc1CSc2ccnnc2 62a_100000751220_100000732662 [0,1,0,0,0,0|3,0,0]=4 400 B15R2.55 Cc1[nH]cnc1CSc2cnccn2 62a_100000211759_100000751220 [0,1,0,0,0,0|3,0,0]=4 401 B15R2.55 Cc1[nH]cnc1CSc2cnccn2 62a_100000751220_100000211759 [0,1,0,0,0,0|3,0,0]=4 402 B15R2.55 Cc1[nH]cnc1CSc2cncnc2 62a_100000751220_100011206942 [0,1,0,0,0,0|3,0,0]=4 403 B15R2.55 Cc1[nH]cnc1CSc2cncnc2 62a_100011206942_100000751220 [0,1,0,0,0,0|3,0,0]=4 404 B15R2.55 Cc1[nH]cnc1CSc2ncccn2 62a_100000211032_100000751220 [0,1,0,0,0,0|3,0,0]=4 405 B15R2.55 Cc1[nH]cnc1CSc2ncccn2 62a_100000751220_100000211032 [0,1,0,0,0,0|3,0,0]=4 406 B15R2.55 Cc1[nH]cnc1SCc2ccccc2 62a_100000211182_100010186451 [0,1,0,0,0,0|2,0,0]=3 407 B15R2.55 Cc1[nH]cnc1SCc2ccccc2 62a_100010186451_100015291786 [0,1,0,0,0,0|2,0,0]=3 408 B15R2.55 Cc1[nH]cnc1SCc2ccccn2 62a_100000721315_100010186451 [0,1,0,0,0,0|3,0,0]=4 409 B15R2.55 Cc1[nH]cnc1SCc2ccccn2 62a_100010186451_100000721315 [0,1,0,0,0,0|3,0,0]=4 410 B15R2.55 Cc1[nH]cnc1SCc2cccnc2 62a_100000741622_100010186451 [0,1,0,0,0,0|3,0,0]=4 411 B15R2.55 Cc1[nH]cnc1SCc2cccnc2 62a_100010186451_100000741622 [0,1,0,0,0,0|3,0,0]=4 412 B15R2.55 Cc1[nH]cnc1SCc2ccncc2 62a_100010186451_100015193705 [0,1,0,0,0,0|3,0,0]=4 413 B15R2.55 Cc1[nH]cnc1SCc2ccncc2 62a_100015193705_100010186451 [0,1,0,0,0,0|3,0,0]=4 414 B15R2.55 Cc1ccoc1CNc2ccccc2 207a_100000106764_100000763527 [0,1,0,0,0,0|2,0,0]=3 415 B15R2.55 Cc1ccoc1CNc2ccccc2 270302a_100000106764_100000763527 [0,1,0,0,0,0|2,0,0]=3 416 B15R2.55 Cc1ccsc1CNc2ccccc2 207a_100000106764_100000210881 [0,1,0,0,0,0|2,0,0]=3 417 B15R2.55 Cc1ccsc1CNc2ccccc2 270302a_100000106764_100000210881 [0,1,0,0,0,0|2,0,0]=3 418 B15R2.55 Cc1cn[nH]c1CNc2ccccc2 207a_100000106764_100000708485 [0,1,0,0,0,0|2,0,1]=4 419 B15R2.55 Cc1n[nH]cc1CNc2ccccc2 207a_100000106764_100000737037 [0,1,0,0,0,0|2,0,0]=3 420 B15R2.55 Cc1n[nH]cc1CNc2ccccc2 270302a_100000106764_100000737037 [0,1,0,0,0,0|2,0,0]=3 421 B15R2.55 Cc1ncsc1CNc2ccccc2 207a_100000106764_100000764165 [0,1,0,0,0,0|1,0,1]=3 422 B15R2.55 Cc1ncsc1CNc2ccccc2 270302a_100000106764_100000764165 [0,1,0,0,0,0|1,0,1]=3 423 B15R2.55 Cc1nnsc1CNc2ccccc2 34a_100000106764_100000732739 [0,1,0,0,0,0|2,0,1]=4 424 B15R2.55 Cc1nonc1CNc2ccccc2 34a_100000106764_200000044682 [0,1,0,0,0,0|1,0,1]=3 425 B15R2.55 Cc1nonc1COc2ccccc2 34a_100000210340_200000044682 [0,1,0,0,0,0|2,0,1]=4 426 B15R2.55 Cc1nonc1COc2ccccc2 7a_100000210340_200000044682 [0,1,0,0,0,0|2,0,1]=4 427 B15R2.55 Cc1nonc1CSc2ccccc2 62a_100000719477_200000044682 [0,1,0,0,0,0|2,0,1]=4 428 B15R2.55 Cc1nonc1CSc2ccccc2 62a_200000044682_100000041952 [0,1,0,0,0,0|2,0,1]=4 429 B15R2.55 Cc1ocnc1CNc2ccccc2 34a_100000106764_200000693990 [0,1,0,0,0,0|1,0,0]=2 430 B15R2.55 Cc1ocnc1COc2ccccc2 34a_100000210340_200000693990 [0,1,0,0,0,0|2,0,0]=3 431 B15R2.55 Cc1ocnc1COc2ccccc2 7a_100000210340_200000693990 [0,1,0,0,0,0|2,0,0]=3 432 B15R2.55 Cc1ocnc1COc2cccnc2 34a_100000210849_200000693990 [0,1,0,0,0,0|3,0,0]=4 433 B15R2.55 Cc1ocnc1COc2cccnc2 7a_100000210849_200000693990 [0,1,0,0,0,0|3,0,0]=4 434 B15R2.55 Cc1ocnc1COc2ccncc2 34a_100000212176_200000693990 [0,1,0,0,0,0|3,0,0]=4 435 B15R2.55 Cc1ocnc1CSc2ccccc2 62a_100000719477_200000693990 [0,1,0,0,0,0|2,0,0]=3 436 B15R2.55 Cc1ocnc1CSc2ccccc2 62a_200000693990_100000041952 [0,1,0,0,0,0|2,0,0]=3 437 B15R2.55 Cc1ocnc1CSc2ccccn2 62a_100011216584_200000693990 [0,1,0,0,0,0|3,0,0]=4 438 B15R2.55 Cc1ocnc1CSc2ccccn2 62a_200000693990_100011216584 [0,1,0,0,0,0|3,0,0]=4 439 B15R2.55 Cc1ocnc1CSc2cccnc2 62a_100000210063_200000693990 [0,1,0,0,0,0|3,0,0]=4 440 B15R2.55 Cc1ocnc1CSc2cccnc2 62a_200000693990_100000210063 [0,1,0,0,0,0|3,0,0]=4 441 B15R2.55 Cc1ocnc1CSc2ccncc2 62a_100000728582_200000693990 [0,1,0,0,0,0|3,0,0]=4 442 B15R2.55 Cc1ocnc1CSc2ccncc2 62a_200000693990_100000728582 [0,1,0,0,0,0|3,0,0]=4 443 B15R2.55 Cc1scnc1C#Cc2ccccc2 271570a_100000069678_100000732656 [0,1,0,0,0,0|2,0,1]=4 444 B15R2.55 Cc1scnc1C=Cc2ccccc2 271570a_100102527694_100000732656 [0,1,0,0,0,0|2,0,1]=4 445 B15R2.55 Cc1scnc1SCc2ccccc2 62a_100000211182_100000732656 [0,1,0,0,0,0|3,0,0]=4 446 B15R2.55 Cc1scnc1SCc2ccccc2 62a_100000732656_100015291786 [0,1,0,0,0,0|3,0,0]=4 447 B15R2.55 Clc1c[nH]nc1CNc2ccccc2 207a_100000106764_100000040271 [0,1,0,0,0,0|2,0,0]=3 448 B15R2.55 Clc1ccsc1CNc2ccccc2 207a_100000106764_100000722334 [0,1,0,0,0,0|2,0,0]=3 449 B15R2.55 Clc1ccsc1CNc2ccccc2 270302a_100000106764_100000722334 [0,1,0,0,0,0|2,0,0]=3 450 B15R2.55 Clc1sccc1CNc2ccccc2 207a_100000106764_100000089901 [0,1,0,0,0,0|2,0,0]=3 451 B15R2.55 Clc1sccc1CNc2ccccc2 270302a_100000106764_100000089901 [0,1,0,0,0,0|2,0,0]=3 452 B15R2.55 Clc1sccc1CNc2ccccc2 34a_100000106764_100010167017 [0,1,0,0,0,0|2,0,0]=3 453 B15R2.55 Clc1sccc1COc2ccccc2 34a_100000210340_100010167017 [0,1,0,0,0,0|3,0,0]=4 454 B15R2.55 Clc1sccc1COc2ccccc2 7a_100000210340_100010167017 [0,1,0,0,0,0|3,0,0]=4 455 B15R2.55 Clc1sccc1CSc2ccccc2 62a_100000719477_100010167017 [0,1,0,0,0,0|3,0,0]=4 456 B15R2.55 Clc1sccc1CSc2ccccc2 62a_100010167017_100000041952 [0,1,0,0,0,0|3,0,0]=4 457 B15R2.55 Clc1snnc1COc2ccccc2 7a_100000210340_100000018852 [0,1,0,0,0,0|3,0,0]=4 458 B15R2.55 Clc1snnc1CSc2ccccc2 62a_100000719477_100000018852 [0,1,0,0,0,0|3,0,0]=4 459 B15R2.55 Cn1ccnc1CNc2ccccc2 207a_100000106764_100000748660 [0,1,0,0,0,0|2,0,0]=3 460 B15R2.55 Cn1ccnc1CNc2ccccc2 34a_100000106764_100000700302 [0,1,0,0,0,0|2,0,0]=3 461 B15R2.55 Cn1ccnc1COc2ccccc2 34a_100000210340_100000700302 [0,1,0,0,0,0|3,0,0]=4 462 B15R2.55 Cn1ccnc1COc2ccccc2 7a_100000210340_100000700302 [0,1,0,0,0,0|3,0,0]=4 463 B15R2.55 Cn1ccnc1CSc2ccccc2 62a_100000700302_100000041952 [0,1,0,0,0,0|3,0,0]=4 464 B15R2.55 Cn1ccnc1CSc2ccccc2 62a_100000719477_100000700302 [0,1,0,0,0,0|3,0,0]=4 465 B15R2.55 Cn1cncc1CNc2ccccc2 207a_100000106764_100000750899 [0,1,0,0,0,0|0,0,2]=3 466 B15R2.55 Cn1cncc1CNc2ccccc2 270302a_100000106764_100000750899 [0,1,0,0,0,0|0,0,2]=3 467 B15R2.55 Cn1nccc1CNc2ccccc2 207a_100000106764_100000737161 [0,1,0,0,0,0|2,0,1]=4 468 B15R2.55 Cn1nccc1CNc2ccccc2 270302a_100000106764_100000737161 [0,1,0,0,0,0|2,0,1]=4 469 B15R2.55 Cn1nccc1CNc2ccccc2 34a_100000106764_100000691648 [0,1,0,0,0,0|2,0,1]=4 470 B15R2.100 Brc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100102527914_100000756875 [0,1,0,0,0,0|1,0,1]=3 471 B15R2.100 Brc1ccc(cc1)C=Cc2cscn2 271570a_100102527914_100000751502 [0,1,0,0,0,0|2,0,1]=4 472 B15R2.100 Brc1ccc(cc1)C=Cc2nc[nH]n2 271570a_100102527914_100000761765 [0,1,0,0,0,0|2,0,1]=4 473 B15R2.100 Brc1ccc(cc1)CSc2c[nH]cn2 62a_100000189115_100000756875 [0,1,0,0,0,0|2,0,0]=3 474 B15R2.100 Brc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000189115 [0,1,0,0,0,0|2,0,0]=3 475 B15R2.100 Brc1ccc(cc1)CSc2c[nH]nn2 62a_100000189115_100009819707 [0,1,0,0,0,0|3,0,0]=4 476 B15R2.100 Brc1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100000189115 [0,1,0,0,0,0|3,0,0]=4 477 B15R2.100 Brc1ccc(cc1)CSc2cscn2 62a_100000189115_100000751502 [0,1,0,0,0,0|3,0,0]=4 478 B15R2.100 Brc1ccc(cc1)CSc2cscn2 62a_100000751502_100000189115 [0,1,0,0,0,0|3,0,0]=4 479 B15R2.100 Brc1ccc(cc1)CSc2nc[nH]n2 62a_100000189115_100000761765 [0,1,0,0,0,0|3,0,0]=4 480 B15R2.100 Brc1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100000189115 [0,1,0,0,0,0|3,0,0]=4 481 B15R2.100 Brc1ccc(cc1)NCC2=NCCN2 34a_100000210018_100000737910 [0,1,0,0,0,0|2,0,1]=4 482 B15R2.100 Brc1ccc(cc1)NCc2c[nH]cn2 2230a_100000210018_100000707719 [0,1,0,0,0,0|0,0,0]=1 483 B15R2.100 Brc1ccc(cc1)NCc2c[nH]cn2 34a_100000210018_100000707719 [0,1,0,0,0,0|0,0,0]=1 484 B15R2.100 Brc1ccc(cc1)NCc2cc[nH]n2 207a_100000210018_100000738523 [0,1,0,0,0,0|2,0,0]=3 485 B15R2.100 Brc1ccc(cc1)NCc2ccco2 207a_100000210018_100000186105 [0,1,0,0,0,0|2,0,0]=3 486 B15R2.100 Brc1ccc(cc1)NCc2ccco2 270302a_100000210018_100000186105 [0,1,0,0,0,0|2,0,0]=3 487 B15R2.100 Brc1ccc(cc1)NCc2cccs2 207a_100000210018_100000209959 [0,1,0,0,0,0|2,0,0]=3 488 B15R2.100 Brc1ccc(cc1)NCc2cccs2 270302a_100000210018_100000209959 [0,1,0,0,0,0|2,0,0]=3 489 B15R2.100 Brc1ccc(cc1)NCc2ccn[nH]2 2230a_100000210018_100000728653 [0,1,0,0,0,0|2,0,1]=4 490 B15R2.100 Brc1ccc(cc1)NCc2ccn[nH]2 34a_100000210018_100000728653 [0,1,0,0,0,0|2,0,1]=4 491 B15R2.100 Brc1ccc(cc1)NCc2ccoc2 207a_100000210018_100011215517 [0,1,0,0,0,0|2,0,0]=3 492 B15R2.100 Brc1ccc(cc1)NCc2ccon2 2230a_100000210018_100000234950 [0,1,0,0,0,0|2,0,0]=3 493 B15R2.100 Brc1ccc(cc1)NCc2ccon2 34a_100000210018_100000234950 [0,1,0,0,0,0|2,0,0]=3 494 B15R2.100 Brc1ccc(cc1)NCc2ccsc2 207a_100000210018_100000188534 [0,1,0,0,0,0|2,0,0]=3 495 B15R2.100 Brc1ccc(cc1)NCc2ccsc2 2230a_100000210018_100011261437 [0,1,0,0,0,0|2,0,0]=3 496 B15R2.100 Brc1ccc(cc1)NCc2ccsc2 270302a_100000210018_100000188534 [0,1,0,0,0,0|2,0,0]=3 497 B15R2.100 Brc1ccc(cc1)NCc2ccsc2 34a_100000210018_100011261437 [0,1,0,0,0,0|2,0,0]=3 498 B15R2.100 Brc1ccc(cc1)NCc2cn[nH]c2 207a_100000210018_100016992096 [0,1,0,0,0,0|2,0,0]=3 499 B15R2.100 Brc1ccc(cc1)NCc2cn[nH]c2 270302a_100000210018_100016992096 [0,1,0,0,0,0|2,0,0]=3 500 B15R2.100 Brc1ccc(cc1)NCc2cnc[nH]2 207a_100000210018_100000742939 [0,1,0,0,0,0|0,0,2]=3 501 B15R2.100 Brc1ccc(cc1)NCc2cncs2 207a_100000210018_100000749870 [0,1,0,0,0,0|1,0,1]=3 502 B15R2.100 Brc1ccc(cc1)NCc2cncs2 2230a_100000210018_100015185245 [0,1,0,0,0,0|1,0,1]=3 503 B15R2.100 Brc1ccc(cc1)NCc2cncs2 270302a_100000210018_100000749870 [0,1,0,0,0,0|1,0,1]=3 504 B15R2.100 Brc1ccc(cc1)NCc2cncs2 34a_100000210018_100015185245 [0,1,0,0,0,0|1,0,1]=3 505 B15R2.100 Brc1ccc(cc1)NCc2cscn2 207a_100000210018_100000743575 [0,1,0,0,0,0|1,0,0]=2 506 B15R2.100 Brc1ccc(cc1)NCc2cscn2 2230a_100000210018_100000205941 [0,1,0,0,0,0|1,0,0]=2 507 B15R2.100 Brc1ccc(cc1)NCc2cscn2 270302a_100000210018_100000743575 [0,1,0,0,0,0|1,0,0]=2 508 B15R2.100 Brc1ccc(cc1)NCc2cscn2 34a_100000210018_100000205941 [0,1,0,0,0,0|1,0,0]=2 509 B15R2.100 Brc1ccc(cc1)NCc2ncc[nH]2 207a_100000210018_100000743867 [0,1,0,0,0,0|2,0,0]=3 510 B15R2.100 Brc1ccc(cc1)NCc2ncc[nH]2 2230a_100000210018_100016991755 [0,1,0,0,0,0|2,0,0]=3 511 B15R2.100 Brc1ccc(cc1)NCc2ncc[nH]2 34a_100000210018_100016991755 [0,1,0,0,0,0|2,0,0]=3 512 B15R2.100 Brc1ccc(cc1)NCc2ncco2 2230a_100000210018_103436540062 [0,1,0,0,0,0|2,0,0]=3 513 B15R2.100 Brc1ccc(cc1)NCc2ncco2 34a_100000210018_103436540062 [0,1,0,0,0,0|2,0,0]=3 514 B15R2.100 Brc1ccc(cc1)NCc2nccs2 207a_100000210018_100000750902 [0,1,0,0,0,0|2,0,0]=3 515 B15R2.100 Brc1ccc(cc1)NCc2nccs2 2230a_100000210018_100015184050 [0,1,0,0,0,0|2,0,0]=3 516 B15R2.100 Brc1ccc(cc1)NCc2nccs2 270302a_100000210018_100000750902 [0,1,0,0,0,0|2,0,0]=3 517 B15R2.100 Brc1ccc(cc1)NCc2nccs2 34a_100000210018_100015184050 [0,1,0,0,0,0|2,0,0]=3 518 B15R2.100 Brc1ccc(cc1)NCc2ncon2 34a_100000210018_100000233494 [0,1,0,0,0,0|2,0,0]=3 519 B15R2.100 Brc1ccc(cc1)NCc2nnn[nH]2 34a_100000210018_100000765167 [0,1,0,0,0,0|2,0,1]=4 520 B15R2.100 Brc1ccc(cc1)NCn2cncn2 2230a_100000210018_200020645497 [0,1,0,0,0,0|1,0,1]=3 521 B15R2.100 Brc1ccc(cc1)NCn2cncn2 34a_100000210018_200020645497 [0,1,0,0,0,0|1,0,1]=3 522 B15R2.100 Brc1ccc(cc1)OCc2c[nH]cn2 34a_100000185759_100000707719 [0,1,0,0,0,0|1,0,0]=2 523 B15R2.100 Brc1ccc(cc1)OCc2ccon2 34a_100000185759_100000234950 [0,1,0,0,0,0|3,0,0]=4 524 B15R2.100 Brc1ccc(cc1)OCc2ccon2 7a_100000185759_100000234950 [0,1,0,0,0,0|3,0,0]=4 525 B15R2.100 Brc1ccc(cc1)OCc2ccsc2 34a_100000185759_100011261437 [0,1,0,0,0,0|3,0,0]=4 526 B15R2.100 Brc1ccc(cc1)OCc2ccsc2 7a_100000185759_100011261437 [0,1,0,0,0,0|3,0,0]=4 527 B15R2.100 Brc1ccc(cc1)OCc2cncs2 34a_100000185759_100015185245 [0,1,0,0,0,0|2,0,1]=4 528 B15R2.100 Brc1ccc(cc1)OCc2cncs2 7a_100000185759_100015185245 [0,1,0,0,0,0|2,0,1]=4 529 B15R2.100 Brc1ccc(cc1)OCc2cscn2 34a_100000185759_100000205941 [0,1,0,0,0,0|2,0,0]=3 530 B15R2.100 Brc1ccc(cc1)OCc2cscn2 7a_100000185759_100000205941 [0,1,0,0,0,0|2,0,0]=3 531 B15R2.100 Brc1ccc(cc1)OCc2ncc[nH]2 34a_100000185759_100016991755 [0,1,0,0,0,0|3,0,0]=4 532 B15R2.100 Brc1ccc(cc1)OCc2ncc[nH]2 7a_100000185759_100000753453 [0,1,0,0,0,0|3,0,0]=4 533 B15R2.100 Brc1ccc(cc1)OCc2ncco2 34a_100000185759_103436540062 [0,1,0,0,0,0|3,0,0]=4 534 B15R2.100 Brc1ccc(cc1)OCc2ncco2 7a_100000185759_103436540062 [0,1,0,0,0,0|3,0,0]=4 535 B15R2.100 Brc1ccc(cc1)OCc2nccs2 34a_100000185759_100015184050 [0,1,0,0,0,0|3,0,0]=4 536 B15R2.100 Brc1ccc(cc1)OCc2nccs2 7a_100000185759_100015184050 [0,1,0,0,0,0|3,0,0]=4 537 B15R2.100 Brc1ccc(cc1)OCc2ncon2 34a_100000185759_100000233494 [0,1,0,0,0,0|3,0,0]=4 538 B15R2.100 Brc1ccc(cc1)OCn2cncn2 34a_100000185759_200020645497 [0,1,0,0,0,0|2,0,1]=4 539 B15R2.100 Brc1ccc(cc1)OCn2cncn2 7a_100000185759_200020645497 [0,1,0,0,0,0|2,0,1]=4 540 B15R2.100 Brc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000752885 [0,1,0,0,0,0|1,0,0]=2 541 B15R2.100 Brc1ccc(cc1)SCc2c[nH]cn2 62a_100000752885_100000707719 [0,1,0,0,0,0|1,0,0]=2 542 B15R2.100 Brc1ccc(cc1)SCc2ccon2 62a_100000234950_100000752885 [0,1,0,0,0,0|3,0,0]=4 543 B15R2.100 Brc1ccc(cc1)SCc2ccon2 62a_100000752885_100000234950 [0,1,0,0,0,0|3,0,0]=4 544 B15R2.100 Brc1ccc(cc1)SCc2ccsc2 62a_100000752885_100011233845 [0,1,0,0,0,0|3,0,0]=4 545 B15R2.100 Brc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000752885 [0,1,0,0,0,0|3,0,0]=4 546 B15R2.100 Brc1ccc(cc1)SCc2cncs2 62a_100000752885_100015185245 [0,1,0,0,0,0|2,0,1]=4 547 B15R2.100 Brc1ccc(cc1)SCc2cncs2 62a_100015185245_100000752885 [0,1,0,0,0,0|2,0,1]=4 548 B15R2.100 Brc1ccc(cc1)SCc2cscn2 62a_100000205941_100000752885 [0,1,0,0,0,0|2,0,0]=3 549 B15R2.100 Brc1ccc(cc1)SCc2cscn2 62a_100000752885_100000205941 [0,1,0,0,0,0|2,0,0]=3 550 B15R2.100 Brc1ccc(cc1)SCc2ncc[nH]2 62a_100000752885_100016991755 [0,1,0,0,0,0|3,0,0]=4 551 B15R2.100 Brc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000752885 [0,1,0,0,0,0|3,0,0]=4 552 B15R2.100 Brc1ccc(cc1)SCc2ncco2 62a_100000752885_103436540062 [0,1,0,0,0,0|3,0,0]=4 553 B15R2.100 Brc1ccc(cc1)SCc2ncco2 62a_103436540062_100000752885 [0,1,0,0,0,0|3,0,0]=4 554 B15R2.100 Brc1ccc(cc1)SCc2nccs2 62a_100000752885_100015184050 [0,1,0,0,0,0|3,0,0]=4 555 B15R2.100 Brc1ccc(cc1)SCc2nccs2 62a_100015184050_100000752885 [0,1,0,0,0,0|3,0,0]=4 556 B15R2.100 Brc1ccc(cc1)SCc2ncon2 62a_100000233494_100000752885 [0,1,0,0,0,0|3,0,0]=4 557 B15R2.100 Brc1ccc(cc1)SCc2ncon2 62a_100000752885_100000233494 [0,1,0,0,0,0|3,0,0]=4 558 B15R2.100 Brc1ccc(cc1)SCn2cncn2 62a_100000752885_200020645497 [0,1,0,0,0,0|2,0,1]=4 559 B15R2.100 Brc1ccc(cc1)SCn2cncn2 62a_200020645497_100000752885 [0,1,0,0,0,0|2,0,1]=4 560 B15R2.100 Brc1ccc(cn1)CSc2c[nH]cn2 62a_100000756875_100009831999 [0,1,0,0,0,0|3,0,0]=4 561 B15R2.100 Brc1ccc(cn1)CSc2c[nH]cn2 62a_100009831999_100000756875 [0,1,0,0,0,0|3,0,0]=4 562 B15R2.100 Brc1ccc(cn1)OCc2c[nH]cn2 34a_100000685995_100000707719 [0,1,0,0,0,0|2,0,0]=3 563 B15R2.100 Brc1ccc(cn1)OCc2cscn2 34a_100000685995_100000205941 [0,1,0,0,0,0|3,0,0]=4 564 B15R2.100 Brc1ccc(cn1)OCc2cscn2 7a_100000685995_100000205941 [0,1,0,0,0,0|3,0,0]=4 565 B15R2.100 Brc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100009814638 [0,1,0,0,0,0|2,0,0]=3 566 B15R2.100 Brc1ccc(cn1)SCc2c[nH]cn2 62a_100009814638_100000707719 [0,1,0,0,0,0|2,0,0]=3 567 B15R2.100 Brc1ccc(cn1)SCc2cscn2 62a_100000205941_100009814638 [0,1,0,0,0,0|3,0,0]=4 568 B15R2.100 Brc1ccc(cn1)SCc2cscn2 62a_100009814638_100000205941 [0,1,0,0,0,0|3,0,0]=4 569 B15R2.100 Brc1ccc(nc1)CSc2c[nH]cn2 62a_100000702658_100000756875 [0,1,0,0,0,0|3,0,0]=4 570 B15R2.100 Brc1ccc(nc1)CSc2c[nH]cn2 62a_100000756875_100000702658 [0,1,0,0,0,0|3,0,0]=4 571 B15R2.100 Brc1ccc(nc1)NCc2c[nH]cn2 27a_100000758547_100000686858 [0,1,0,0,0,0|1,0,0]=2 572 B15R2.100 Brc1ccc(nc1)NCc2c[nH]nn2 27a_100020620823_100000686858 [0,1,0,0,0,0|2,0,0]=3 573 B15R2.100 Brc1ccc(nc1)NCc2cc[nH]n2 27a_100000739516_100000686858 [0,1,0,0,0,0|3,0,0]=4 574 B15R2.100 Brc1ccc(nc1)NCc2ccco2 27a_100000185738_100000686858 [0,1,0,0,0,0|3,0,0]=4 575 B15R2.100 Brc1ccc(nc1)NCc2cccs2 27a_100000211653_100000686858 [0,1,0,0,0,0|3,0,0]=4 576 B15R2.100 Brc1ccc(nc1)NCc2ccoc2 27a_100015206860_100000686858 [0,1,0,0,0,0|3,0,0]=4 577 B15R2.100 Brc1ccc(nc1)NCc2ccon2 27a_100000688301_100000686858 [0,1,0,0,0,0|3,0,0]=4 578 B15R2.100 Brc1ccc(nc1)NCc2ccsc2 27a_100000186416_100000686858 [0,1,0,0,0,0|3,0,0]=4 579 B15R2.100 Brc1ccc(nc1)NCc2cn[nH]c2 27a_100000737208_100000686858 [0,1,0,0,0,0|3,0,0]=4 580 B15R2.100 Brc1ccc(nc1)NCc2cnco2 27a_100020634212_100000686858 [0,1,0,0,0,0|2,0,1]=4 581 B15R2.100 Brc1ccc(nc1)NCc2cncs2 27a_100016987365_100000686858 [0,1,0,0,0,0|2,0,1]=4 582 B15R2.100 Brc1ccc(nc1)NCc2cocn2 27a_100015188801_100000686858 [0,1,0,0,0,0|2,0,0]=3 583 B15R2.100 Brc1ccc(nc1)NCc2cscn2 27a_100015185402_100000686858 [0,1,0,0,0,0|2,0,0]=3 584 B15R2.100 Brc1ccc(nc1)NCc2ncc[nH]2 27a_100000754540_100000686858 [0,1,0,0,0,0|3,0,0]=4 585 B15R2.100 Brc1ccc(nc1)NCc2ncco2 27a_100016994969_100000686858 [0,1,0,0,0,0|3,0,0]=4 586 B15R2.100 Brc1ccc(nc1)NCc2nccs2 27a_100000740555_100000686858 [0,1,0,0,0,0|3,0,0]=4 587 B15R2.100 Brc1ccc(nc1)SCc2c[nH]cn2 62a_100000686858_100000707719 [0,1,0,0,0,0|2,0,0]=3 588 B15R2.100 Brc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000686858 [0,1,0,0,0,0|2,0,0]=3 589 B15R2.100 Brc1ccc(nc1)SCc2cscn2 62a_100000205941_100000686858 [0,1,0,0,0,0|3,0,0]=4 590 B15R2.100 Brc1ccc(nc1)SCc2cscn2 62a_100000686858_100000205941 [0,1,0,0,0,0|3,0,0]=4 591 B15R2.100 Brc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100010187541 [0,1,0,0,0,0|2,0,0]=3 592 B15R2.100 Brc1cnc(cn1)NCc2c[nH]nn2 27a_100020620823_100010187541 [0,1,0,0,0,0|3,0,0]=4 593 B15R2.100 Brc1cnc(cn1)NCc2cocn2 27a_100015188801_100010187541 [0,1,0,0,0,0|3,0,0]=4 594 B15R2.100 Brc1cnc(cn1)NCc2cscn2 27a_100015185402_100010187541 [0,1,0,0,0,0|3,0,0]=4 595 B15R2.100 Brc1cnc(cn1)OCc2c[nH]cn2 34a_100011934580_100000707719 [0,1,0,0,0,0|3,0,0]=4 596 B15R2.100 Brc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100010187541 [0,1,0,0,0,0|3,0,0]=4 597 B15R2.100 Brc1cnc(cn1)SCc2c[nH]cn2 62a_100010187541_100000707719 [0,1,0,0,0,0|3,0,0]=4 598 B15R2.100 Brc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000690281 [0,1,0,0,0,0|2,0,0]=3 599 B15R2.100 Brc1cnc(nc1)NCc2c[nH]nn2 27a_100020620823_100000690281 [0,1,0,0,0,0|3,0,0]=4 600 B15R2.100 Brc1cnc(nc1)NCc2cocn2 27a_100015188801_100000690281 [0,1,0,0,0,0|3,0,0]=4 601 B15R2.100 Brc1cnc(nc1)NCc2cscn2 27a_100015185402_100000690281 [0,1,0,0,0,0|3,0,0]=4 602 B15R2.100 Brc1cnc(nc1)SCc2c[nH]cn2 62a_100000690281_100000707719 [0,1,0,0,0,0|3,0,0]=4 603 B15R2.100 Brc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000690281 [0,1,0,0,0,0|3,0,0]=4 604 B15R2.100 Brc1ncc(cn1)OCc2c[nH]cn2 34a_100000730009_100000707719 [0,1,0,0,0,0|3,0,0]=4 605 B15R2.100 Brc1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_200012349914 [0,1,0,0,0,0|3,0,0]=4 606 B15R2.100 Brc1ncc(cn1)SCc2c[nH]cn2 62a_200012349914_100000707719 [0,1,0,0,0,0|3,0,0]=4 607 B15R2.100 Cc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100102527916_100000756875 [0,1,0,0,0,0|1,0,1]=3 608 B15R2.100 Cc1ccc(cc1)C=Cc2cscn2 271570a_100102527916_100000751502 [0,1,0,0,0,0|2,0,1]=4 609 B15R2.100 Cc1ccc(cc1)C=Cc2nc[nH]n2 271570a_100102527916_100000761765 [0,1,0,0,0,0|2,0,1]=4 610 B15R2.100 Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000210814_100000756875 [0,1,0,0,0,0|2,0,0]=3 611 B15R2.100 Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000210814 [0,1,0,0,0,0|2,0,0]=3 612 B15R2.100 Cc1ccc(cc1)CSc2c[nH]nn2 62a_100000210814_100009819707 [0,1,0,0,0,0|3,0,0]=4 613 B15R2.100 Cc1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100000210814 [0,1,0,0,0,0|3,0,0]=4 614 B15R2.100 Cc1ccc(cc1)CSc2cscn2 62a_100000210814_100000751502 [0,1,0,0,0,0|3,0,0]=4 615 B15R2.100 Cc1ccc(cc1)CSc2cscn2 62a_100000751502_100000210814 [0,1,0,0,0,0|3,0,0]=4 616 B15R2.100 Cc1ccc(cc1)CSc2nc[nH]n2 62a_100000210814_100000761765 [0,1,0,0,0,0|3,0,0]=4 617 B15R2.100 Cc1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100000210814 [0,1,0,0,0,0|3,0,0]=4 618 B15R2.100 Cc1ccc(cc1)NCC2=NCCN2 34a_100000124888_100000737910 [0,1,0,0,0,0|2,0,1]=4 619 B15R2.100 Cc1ccc(cc1)NCc2c[nH]cn2 34a_100000124888_100000707719 [0,1,0,0,0,0|0,0,0]=1 620 B15R2.100 Cc1ccc(cc1)NCc2cc[nH]n2 207a_100000124888_100000738523 [0,1,0,0,0,0|2,0,0]=3 621 B15R2.100 Cc1ccc(cc1)NCc2ccco2 207a_100000124888_100000186105 [0,1,0,0,0,0|2,0,0]=3 622 B15R2.100 Cc1ccc(cc1)NCc2ccco2 270302a_100000124888_100000186105 [0,1,0,0,0,0|2,0,0]=3 623 B15R2.100 Cc1ccc(cc1)NCc2cccs2 207a_100000124888_100000209959 [0,1,0,0,0,0|2,0,0]=3 624 B15R2.100 Cc1ccc(cc1)NCc2cccs2 270302a_100000124888_100000209959 [0,1,0,0,0,0|2,0,0]=3 625 B15R2.100 Cc1ccc(cc1)NCc2ccn[nH]2 34a_100000124888_100000728653 [0,1,0,0,0,0|2,0,1]=4 626 B15R2.100 Cc1ccc(cc1)NCc2ccoc2 207a_100000124888_100011215517 [0,1,0,0,0,0|2,0,0]=3 627 B15R2.100 Cc1ccc(cc1)NCc2ccon2 34a_100000124888_100000234950 [0,1,0,0,0,0|2,0,0]=3 628 B15R2.100 Cc1ccc(cc1)NCc2ccsc2 207a_100000124888_100000188534 [0,1,0,0,0,0|2,0,0]=3 629 B15R2.100 Cc1ccc(cc1)NCc2ccsc2 270302a_100000124888_100000188534 [0,1,0,0,0,0|2,0,0]=3 630 B15R2.100 Cc1ccc(cc1)NCc2ccsc2 34a_100000124888_100011261437 [0,1,0,0,0,0|2,0,0]=3 631 B15R2.100 Cc1ccc(cc1)NCc2cn[nH]c2 207a_100000124888_100016992096 [0,1,0,0,0,0|2,0,0]=3 632 B15R2.100 Cc1ccc(cc1)NCc2cn[nH]c2 270302a_100000124888_100016992096 [0,1,0,0,0,0|2,0,0]=3 633 B15R2.100 Cc1ccc(cc1)NCc2cnc[nH]2 207a_100000124888_100000742939 [0,1,0,0,0,0|0,0,2]=3 634 B15R2.100 Cc1ccc(cc1)NCc2cncs2 207a_100000124888_100000749870 [0,1,0,0,0,0|1,0,1]=3 635 B15R2.100 Cc1ccc(cc1)NCc2cncs2 270302a_100000124888_100000749870 [0,1,0,0,0,0|1,0,1]=3 636 B15R2.100 Cc1ccc(cc1)NCc2cncs2 34a_100000124888_100015185245 [0,1,0,0,0,0|1,0,1]=3 637 B15R2.100 Cc1ccc(cc1)NCc2cscn2 207a_100000124888_100000743575 [0,1,0,0,0,0|1,0,0]=2 638 B15R2.100 Cc1ccc(cc1)NCc2cscn2 270302a_100000124888_100000743575 [0,1,0,0,0,0|1,0,0]=2 639 B15R2.100 Cc1ccc(cc1)NCc2cscn2 34a_100000124888_100000205941 [0,1,0,0,0,0|1,0,0]=2 640 B15R2.100 Cc1ccc(cc1)NCc2ncc[nH]2 207a_100000124888_100000743867 [0,1,0,0,0,0|2,0,0]=3 641 B15R2.100 Cc1ccc(cc1)NCc2ncc[nH]2 34a_100000124888_100016991755 [0,1,0,0,0,0|2,0,0]=3 642 B15R2.100 Cc1ccc(cc1)NCc2ncco2 34a_100000124888_103436540062 [0,1,0,0,0,0|2,0,0]=3 643 B15R2.100 Cc1ccc(cc1)NCc2nccs2 207a_100000124888_100000750902 [0,1,0,0,0,0|2,0,0]=3 644 B15R2.100 Cc1ccc(cc1)NCc2nccs2 270302a_100000124888_100000750902 [0,1,0,0,0,0|2,0,0]=3 645 B15R2.100 Cc1ccc(cc1)NCc2nccs2 34a_100000124888_100015184050 [0,1,0,0,0,0|2,0,0]=3 646 B15R2.100 Cc1ccc(cc1)NCc2ncon2 34a_100000124888_100000233494 [0,1,0,0,0,0|2,0,0]=3 647 B15R2.100 Cc1ccc(cc1)NCc2nnn[nH]2 34a_100000124888_100000765167 [0,1,0,0,0,0|2,0,1]=4 648 B15R2.100 Cc1ccc(cc1)NCn2cncn2 34a_100000124888_200020645497 [0,1,0,0,0,0|1,0,1]=3 649 B15R2.100 Cc1ccc(cc1)OCc2c[nH]cn2 34a_100000210336_100000707719 [0,1,0,0,0,0|1,0,0]=2 650 B15R2.100 Cc1ccc(cc1)OCc2ccon2 34a_100000210336_100000234950 [0,1,0,0,0,0|3,0,0]=4 651 B15R2.100 Cc1ccc(cc1)OCc2ccon2 7a_100000210336_100000234950 [0,1,0,0,0,0|3,0,0]=4 652 B15R2.100 Cc1ccc(cc1)OCc2ccsc2 34a_100000210336_100011261437 [0,1,0,0,0,0|3,0,0]=4 653 B15R2.100 Cc1ccc(cc1)OCc2ccsc2 7a_100000210336_100011261437 [0,1,0,0,0,0|3,0,0]=4 654 B15R2.100 Cc1ccc(cc1)OCc2cncs2 34a_100000210336_100015185245 [0,1,0,0,0,0|2,0,1]=4 655 B15R2.100 Cc1ccc(cc1)OCc2cncs2 7a_100000210336_100015185245 [0,1,0,0,0,0|2,0,1]=4 656 B15R2.100 Cc1ccc(cc1)OCc2cscn2 34a_100000210336_100000205941 [0,1,0,0,0,0|2,0,0]=3 657 B15R2.100 Cc1ccc(cc1)OCc2cscn2 7a_100000210336_100000205941 [0,1,0,0,0,0|2,0,0]=3 658 B15R2.100 Cc1ccc(cc1)OCc2ncc[nH]2 34a_100000210336_100016991755 [0,1,0,0,0,0|3,0,0]=4 659 B15R2.100 Cc1ccc(cc1)OCc2ncc[nH]2 7a_100000210336_100000753453 [0,1,0,0,0,0|3,0,0]=4 660 B15R2.100 Cc1ccc(cc1)OCc2ncco2 34a_100000210336_103436540062 [0,1,0,0,0,0|3,0,0]=4 661 B15R2.100 Cc1ccc(cc1)OCc2ncco2 7a_100000210336_103436540062 [0,1,0,0,0,0|3,0,0]=4 662 B15R2.100 Cc1ccc(cc1)OCc2nccs2 34a_100000210336_100015184050 [0,1,0,0,0,0|3,0,0]=4 663 B15R2.100 Cc1ccc(cc1)OCc2nccs2 7a_100000210336_100015184050 [0,1,0,0,0,0|3,0,0]=4 664 B15R2.100 Cc1ccc(cc1)OCc2ncon2 34a_100000210336_100000233494 [0,1,0,0,0,0|3,0,0]=4 665 B15R2.100 Cc1ccc(cc1)OCn2cncn2 34a_100000210336_200020645497 [0,1,0,0,0,0|2,0,1]=4 666 B15R2.100 Cc1ccc(cc1)OCn2cncn2 7a_100000210336_200020645497 [0,1,0,0,0,0|2,0,1]=4 667 B15R2.100 Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000186775_100000707719 [0,1,0,0,0,0|1,0,0]=2 668 B15R2.100 Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000186775 [0,1,0,0,0,0|1,0,0]=2 669 B15R2.100 Cc1ccc(cc1)SCc2ccon2 62a_100000186775_100000234950 [0,1,0,0,0,0|3,0,0]=4 670 B15R2.100 Cc1ccc(cc1)SCc2ccon2 62a_100000234950_100000186775 [0,1,0,0,0,0|3,0,0]=4 671 B15R2.100 Cc1ccc(cc1)SCc2ccsc2 62a_100000186775_100011233845 [0,1,0,0,0,0|3,0,0]=4 672 B15R2.100 Cc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000186775 [0,1,0,0,0,0|3,0,0]=4 673 B15R2.100 Cc1ccc(cc1)SCc2cncs2 62a_100000186775_100015185245 [0,1,0,0,0,0|2,0,1]=4 674 B15R2.100 Cc1ccc(cc1)SCc2cncs2 62a_100015185245_100000186775 [0,1,0,0,0,0|2,0,1]=4 675 B15R2.100 Cc1ccc(cc1)SCc2cscn2 62a_100000186775_100000205941 [0,1,0,0,0,0|2,0,0]=3 676 B15R2.100 Cc1ccc(cc1)SCc2cscn2 62a_100000205941_100000186775 [0,1,0,0,0,0|2,0,0]=3 677 B15R2.100 Cc1ccc(cc1)SCc2ncc[nH]2 62a_100000186775_100016991755 [0,1,0,0,0,0|3,0,0]=4 678 B15R2.100 Cc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000186775 [0,1,0,0,0,0|3,0,0]=4 679 B15R2.100 Cc1ccc(cc1)SCc2ncco2 62a_100000186775_103436540062 [0,1,0,0,0,0|3,0,0]=4 680 B15R2.100 Cc1ccc(cc1)SCc2ncco2 62a_103436540062_100000186775 [0,1,0,0,0,0|3,0,0]=4 681 B15R2.100 Cc1ccc(cc1)SCc2nccs2 62a_100000186775_100015184050 [0,1,0,0,0,0|3,0,0]=4 682 B15R2.100 Cc1ccc(cc1)SCc2nccs2 62a_100015184050_100000186775 [0,1,0,0,0,0|3,0,0]=4 683 B15R2.100 Cc1ccc(cc1)SCc2ncon2 62a_100000186775_100000233494 [0,1,0,0,0,0|3,0,0]=4 684 B15R2.100 Cc1ccc(cc1)SCc2ncon2 62a_100000233494_100000186775 [0,1,0,0,0,0|3,0,0]=4 685 B15R2.100 Cc1ccc(cc1)SCn2cncn2 62a_100000186775_200020645497 [0,1,0,0,0,0|2,0,1]=4 686 B15R2.100 Cc1ccc(cc1)SCn2cncn2 62a_200020645497_100000186775 [0,1,0,0,0,0|2,0,1]=4 687 B15R2.100 Cc1ccc(cn1)CSc2c[nH]cn2 62a_100000756875_100016987292 [0,1,0,0,0,0|3,0,0]=4 688 B15R2.100 Cc1ccc(cn1)CSc2c[nH]cn2 62a_100016987292_100000756875 [0,1,0,0,0,0|3,0,0]=4 689 B15R2.100 Cc1ccc(cn1)OCc2c[nH]cn2 34a_100000745506_100000707719 [0,1,0,0,0,0|2,0,0]=3 690 B15R2.100 Cc1ccc(cn1)OCc2cscn2 34a_100000745506_100000205941 [0,1,0,0,0,0|3,0,0]=4 691 B15R2.100 Cc1ccc(cn1)OCc2cscn2 7a_100000745506_100000205941 [0,1,0,0,0,0|3,0,0]=4 692 B15R2.100 Cc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000751577 [0,1,0,0,0,0|2,0,0]=3 693 B15R2.100 Cc1ccc(cn1)SCc2c[nH]cn2 62a_100000751577_100000707719 [0,1,0,0,0,0|2,0,0]=3 694 B15R2.100 Cc1ccc(cn1)SCc2cscn2 62a_100000205941_100000751577 [0,1,0,0,0,0|3,0,0]=4 695 B15R2.100 Cc1ccc(cn1)SCc2cscn2 62a_100000751577_100000205941 [0,1,0,0,0,0|3,0,0]=4 696 B15R2.100 Cc1ccc(nc1)CSc2c[nH]cn2 62a_100000691093_100000756875 [0,1,0,0,0,0|3,0,0]=4 697 B15R2.100 Cc1ccc(nc1)CSc2c[nH]cn2 62a_100000756875_100000691093 [0,1,0,0,0,0|3,0,0]=4 698 B15R2.100 Cc1ccc(nc1)OCc2c[nH]cn2 34a_100000759353_100000707719 [0,1,0,0,0,0|2,0,0]=3 699 B15R2.100 Cc1ccc(nc1)OCc2cscn2 34a_100000759353_100000205941 [0,1,0,0,0,0|3,0,0]=4 700 B15R2.100 Cc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000754016 [0,1,0,0,0,0|2,0,0]=3 701 B15R2.100 Cc1ccc(nc1)SCc2c[nH]cn2 62a_100011192072_100000707719 [0,1,0,0,0,0|2,0,0]=3 702 B15R2.100 Cc1ccc(nc1)SCc2cscn2 62a_100000205941_100000754016 [0,1,0,0,0,0|3,0,0]=4 703 B15R2.100 Cc1ccc(nc1)SCc2cscn2 62a_100011192072_100000205941 [0,1,0,0,0,0|3,0,0]=4 704 B15R2.100 Cc1ccc(nn1)NCc2c[nH]cn2 27a_100000758547_100000744512 [0,1,0,0,0,0|2,0,0]=3 705 B15R2.100 Cc1ccc(nn1)NCc2c[nH]nn2 27a_100020620823_100000744512 [0,1,0,0,0,0|3,0,0]=4 706 B15R2.100 Cc1ccc(nn1)NCc2cocn2 27a_100015188801_100000744512 [0,1,0,0,0,0|3,0,0]=4 707 B15R2.100 Cc1ccc(nn1)NCc2cscn2 27a_100015185402_100000744512 [0,1,0,0,0,0|3,0,0]=4 708 B15R2.100 Cc1ccc(nn1)SCc2c[nH]cn2 62a_100000707719_100000744512 [0,1,0,0,0,0|3,0,0]=4 709 B15R2.100 Cc1ccc(nn1)SCc2c[nH]cn2 62a_100000744512_100000707719 [0,1,0,0,0,0|3,0,0]=4 710 B15R2.100 Cc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100000074397 [0,1,0,0,0,0|2,0,0]=3 711 B15R2.100 Cc1cnc(cn1)NCc2c[nH]nn2 27a_100020620823_100000074397 [0,1,0,0,0,0|3,0,0]=4 712 B15R2.100 Cc1cnc(cn1)NCc2cocn2 27a_100015188801_100000074397 [0,1,0,0,0,0|3,0,0]=4 713 B15R2.100 Cc1cnc(cn1)NCc2cscn2 27a_100015185402_100000074397 [0,1,0,0,0,0|3,0,0]=4 714 B15R2.100 Cc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100011999403 [0,1,0,0,0,0|3,0,0]=4 715 B15R2.100 Cc1cnc(cn1)SCc2c[nH]cn2 62a_100011999403_100000707719 [0,1,0,0,0,0|3,0,0]=4 716 B15R2.100 Cc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000061069 [0,1,0,0,0,0|2,0,0]=3 717 B15R2.100 Cc1cnc(nc1)NCc2c[nH]nn2 27a_100020620823_100000061069 [0,1,0,0,0,0|3,0,0]=4 718 B15R2.100 Cc1cnc(nc1)NCc2cocn2 27a_100015188801_100000061069 [0,1,0,0,0,0|3,0,0]=4 719 B15R2.100 Cc1cnc(nc1)NCc2cscn2 27a_100015185402_100000061069 [0,1,0,0,0,0|3,0,0]=4 720 B15R2.100 Cc1cnc(nc1)SCc2c[nH]cn2 62a_100000061069_100000707719 [0,1,0,0,0,0|3,0,0]=4 721 B15R2.100 Cc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000061069 [0,1,0,0,0,0|3,0,0]=4 722 B15R2.100 Cc1ncc(cn1)OCc2c[nH]cn2 34a_100000062939_100000707719 [0,1,0,0,0,0|3,0,0]=4 723 B15R2.100 Cc1ncc(cn1)SCc2c[nH]cn2 62a_100000686985_100000707719 [0,1,0,0,0,0|3,0,0]=4 724 B15R2.100 Cc1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_100000686985 [0,1,0,0,0,0|3,0,0]=4 725 B15R2.100 Clc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100102527930_100000756875 [0,1,0,0,0,0|1,0,1]=3 726 B15R2.100 Clc1ccc(cc1)C=Cc2cscn2 271570a_100102527930_100000751502 [0,1,0,0,0,0|2,0,1]=4 727 B15R2.100 Clc1ccc(cc1)C=Cc2nc[nH]n2 271570a_100102527930_100000761765 [0,1,0,0,0,0|2,0,1]=4 728 B15R2.100 Clc1ccc(cc1)CSc2c[nH]cn2 62a_100000187161_100000756875 [0,1,0,0,0,0|2,0,0]=3 729 B15R2.100 Clc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000187161 [0,1,0,0,0,0|2,0,0]=3 730 B15R2.100 Clc1ccc(cc1)CSc2c[nH]nn2 62a_100000187161_100009819707 [0,1,0,0,0,0|3,0,0]=4 731 B15R2.100 Clc1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100000187161 [0,1,0,0,0,0|3,0,0]=4 732 B15R2.100 Clc1ccc(cc1)CSc2cscn2 62a_100000187161_100000751502 [0,1,0,0,0,0|3,0,0]=4 733 B15R2.100 Clc1ccc(cc1)CSc2cscn2 62a_100000751502_100000187161 [0,1,0,0,0,0|3,0,0]=4 734 B15R2.100 Clc1ccc(cc1)CSc2nc[nH]n2 62a_100000187161_100000761765 [0,1,0,0,0,0|3,0,0]=4 735 B15R2.100 Clc1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100000187161 [0,1,0,0,0,0|3,0,0]=4 736 B15R2.100 Clc1ccc(cc1)NCC2=NCCN2 34a_100000210052_100000737910 [0,1,0,0,0,0|2,0,1]=4 737 B15R2.100 Clc1ccc(cc1)NCc2c[nH]cn2 2230a_100000210052_100000707719 [0,1,0,0,0,0|0,0,0]=1 738 B15R2.100 Clc1ccc(cc1)NCc2c[nH]cn2 34a_100000210052_100000707719 [0,1,0,0,0,0|0,0,0]=1 739 B15R2.100 Clc1ccc(cc1)NCc2cc[nH]n2 207a_100000210052_100000738523 [0,1,0,0,0,0|2,0,0]=3 740 B15R2.100 Clc1ccc(cc1)NCc2ccco2 207a_100000210052_100000186105 [0,1,0,0,0,0|2,0,0]=3 741 B15R2.100 Clc1ccc(cc1)NCc2ccco2 270302a_100000210052_100000186105 [0,1,0,0,0,0|2,0,0]=3 742 B15R2.100 Clc1ccc(cc1)NCc2cccs2 207a_100000210052_100000209959 [0,1,0,0,0,0|2,0,0]=3 743 B15R2.100 Clc1ccc(cc1)NCc2cccs2 270302a_100000210052_100000209959 [0,1,0,0,0,0|2,0,0]=3 744 B15R2.100 Clc1ccc(cc1)NCc2ccn[nH]2 2230a_100000210052_100000728653 [0,1,0,0,0,0|2,0,1]=4 745 B15R2.100 Clc1ccc(cc1)NCc2ccn[nH]2 34a_100000210052_100000728653 [0,1,0,0,0,0|2,0,1]=4 746 B15R2.100 Clc1ccc(cc1)NCc2ccoc2 207a_100000210052_100011215517 [0,1,0,0,0,0|2,0,0]=3 747 B15R2.100 Clc1ccc(cc1)NCc2ccon2 2230a_100000210052_100000234950 [0,1,0,0,0,0|2,0,0]=3 748 B15R2.100 Clc1ccc(cc1)NCc2ccon2 34a_100000210052_100000234950 [0,1,0,0,0,0|2,0,0]=3 749 B15R2.100 Clc1ccc(cc1)NCc2ccsc2 207a_100000210052_100000188534 [0,1,0,0,0,0|2,0,0]=3 750 B15R2.100 Clc1ccc(cc1)NCc2ccsc2 2230a_100000210052_100011261437 [0,1,0,0,0,0|2,0,0]=3 751 B15R2.100 Clc1ccc(cc1)NCc2ccsc2 270302a_100000210052_100000188534 [0,1,0,0,0,0|2,0,0]=3 752 B15R2.100 Clc1ccc(cc1)NCc2ccsc2 34a_100000210052_100011261437 [0,1,0,0,0,0|2,0,0]=3 753 B15R2.100 Clc1ccc(cc1)NCc2cn[nH]c2 207a_100000210052_100016992096 [0,1,0,0,0,0|2,0,0]=3 754 B15R2.100 Clc1ccc(cc1)NCc2cn[nH]c2 270302a_100000210052_100016992096 [0,1,0,0,0,0|2,0,0]=3 755 B15R2.100 Clc1ccc(cc1)NCc2cnc[nH]2 207a_100000210052_100000742939 [0,1,0,0,0,0|0,0,2]=3 756 B15R2.100 Clc1ccc(cc1)NCc2cncs2 207a_100000210052_100000749870 [0,1,0,0,0,0|1,0,1]=3 757 B15R2.100 Clc1ccc(cc1)NCc2cncs2 2230a_100000210052_100015185245 [0,1,0,0,0,0|1,0,1]=3 758 B15R2.100 Clc1ccc(cc1)NCc2cncs2 270302a_100000210052_100000749870 [0,1,0,0,0,0|1,0,1]=3 759 B15R2.100 Clc1ccc(cc1)NCc2cncs2 34a_100000210052_100015185245 [0,1,0,0,0,0|1,0,1]=3 760 B15R2.100 Clc1ccc(cc1)NCc2cscn2 207a_100000210052_100000743575 [0,1,0,0,0,0|1,0,0]=2 761 B15R2.100 Clc1ccc(cc1)NCc2cscn2 2230a_100000210052_100000205941 [0,1,0,0,0,0|1,0,0]=2 762 B15R2.100 Clc1ccc(cc1)NCc2cscn2 270302a_100000210052_100000743575 [0,1,0,0,0,0|1,0,0]=2 763 B15R2.100 Clc1ccc(cc1)NCc2cscn2 34a_100000210052_100000205941 [0,1,0,0,0,0|1,0,0]=2 764 B15R2.100 Clc1ccc(cc1)NCc2ncc[nH]2 207a_100000210052_100000743867 [0,1,0,0,0,0|2,0,0]=3 765 B15R2.100 Clc1ccc(cc1)NCc2ncc[nH]2 2230a_100000210052_100016991755 [0,1,0,0,0,0|2,0,0]=3 766 B15R2.100 Clc1ccc(cc1)NCc2ncc[nH]2 34a_100000210052_100016991755 [0,1,0,0,0,0|2,0,0]=3 767 B15R2.100 Clc1ccc(cc1)NCc2ncco2 2230a_100000210052_103436540062 [0,1,0,0,0,0|2,0,0]=3 768 B15R2.100 Clc1ccc(cc1)NCc2ncco2 34a_100000210052_103436540062 [0,1,0,0,0,0|2,0,0]=3 769 B15R2.100 Clc1ccc(cc1)NCc2nccs2 207a_100000210052_100000750902 [0,1,0,0,0,0|2,0,0]=3 770 B15R2.100 Clc1ccc(cc1)NCc2nccs2 2230a_100000210052_100015184050 [0,1,0,0,0,0|2,0,0]=3 771 B15R2.100 Clc1ccc(cc1)NCc2nccs2 270302a_100000210052_100000750902 [0,1,0,0,0,0|2,0,0]=3 772 B15R2.100 Clc1ccc(cc1)NCc2nccs2 34a_100000210052_100015184050 [0,1,0,0,0,0|2,0,0]=3 773 B15R2.100 Clc1ccc(cc1)NCc2ncon2 34a_100000210052_100000233494 [0,1,0,0,0,0|2,0,0]=3 774 B15R2.100 Clc1ccc(cc1)NCc2nnn[nH]2 34a_100000210052_100000765167 [0,1,0,0,0,0|2,0,1]=4 775 B15R2.100 Clc1ccc(cc1)NCn2cncn2 2230a_100000210052_200020645497 [0,1,0,0,0,0|1,0,1]=3 776 B15R2.100 Clc1ccc(cc1)NCn2cncn2 34a_100000210052_200020645497 [0,1,0,0,0,0|1,0,1]=3 777 B15R2.100 Clc1ccc(cc1)OCc2c[nH]cn2 34a_100000210216_100000707719 [0,1,0,0,0,0|1,0,0]=2 778 B15R2.100 Clc1ccc(cc1)OCc2ccon2 34a_100000210216_100000234950 [0,1,0,0,0,0|3,0,0]=4 779 B15R2.100 Clc1ccc(cc1)OCc2ccon2 7a_100000210216_100000234950 [0,1,0,0,0,0|3,0,0]=4 780 B15R2.100 Clc1ccc(cc1)OCc2ccsc2 34a_100000210216_100011261437 [0,1,0,0,0,0|3,0,0]=4 781 B15R2.100 Clc1ccc(cc1)OCc2ccsc2 7a_100000210216_100011261437 [0,1,0,0,0,0|3,0,0]=4 782 B15R2.100 Clc1ccc(cc1)OCc2cncs2 34a_100000210216_100015185245 [0,1,0,0,0,0|2,0,1]=4 783 B15R2.100 Clc1ccc(cc1)OCc2cncs2 7a_100000210216_100015185245 [0,1,0,0,0,0|2,0,1]=4 784 B15R2.100 Clc1ccc(cc1)OCc2cscn2 34a_100000210216_100000205941 [0,1,0,0,0,0|2,0,0]=3 785 B15R2.100 Clc1ccc(cc1)OCc2cscn2 7a_100000210216_100000205941 [0,1,0,0,0,0|2,0,0]=3 786 B15R2.100 Clc1ccc(cc1)OCc2ncc[nH]2 34a_100000210216_100016991755 [0,1,0,0,0,0|3,0,0]=4 787 B15R2.100 Clc1ccc(cc1)OCc2ncc[nH]2 7a_100000210216_100000753453 [0,1,0,0,0,0|3,0,0]=4 788 B15R2.100 Clc1ccc(cc1)OCc2ncco2 34a_100000210216_103436540062 [0,1,0,0,0,0|3,0,0]=4 789 B15R2.100 Clc1ccc(cc1)OCc2ncco2 7a_100000210216_103436540062 [0,1,0,0,0,0|3,0,0]=4 790 B15R2.100 Clc1ccc(cc1)OCc2nccs2 34a_100000210216_100015184050 [0,1,0,0,0,0|3,0,0]=4 791 B15R2.100 Clc1ccc(cc1)OCc2nccs2 7a_100000210216_100015184050 [0,1,0,0,0,0|3,0,0]=4 792 B15R2.100 Clc1ccc(cc1)OCc2ncon2 34a_100000210216_100000233494 [0,1,0,0,0,0|3,0,0]=4 793 B15R2.100 Clc1ccc(cc1)OCn2cncn2 34a_100000210216_200020645497 [0,1,0,0,0,0|2,0,1]=4 794 B15R2.100 Clc1ccc(cc1)OCn2cncn2 7a_100000210216_200020645497 [0,1,0,0,0,0|2,0,1]=4 795 B15R2.100 Clc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000755918 [0,1,0,0,0,0|1,0,0]=2 796 B15R2.100 Clc1ccc(cc1)SCc2c[nH]cn2 62a_100000755918_100000707719 [0,1,0,0,0,0|1,0,0]=2 797 B15R2.100 Clc1ccc(cc1)SCc2ccon2 62a_100000234950_100000755918 [0,1,0,0,0,0|3,0,0]=4 798 B15R2.100 Clc1ccc(cc1)SCc2ccon2 62a_100000755918_100000234950 [0,1,0,0,0,0|3,0,0]=4 799 B15R2.100 Clc1ccc(cc1)SCc2ccsc2 62a_100000755918_100011233845 [0,1,0,0,0,0|3,0,0]=4 800 B15R2.100 Clc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000755918 [0,1,0,0,0,0|3,0,0]=4 801 B15R2.100 Clc1ccc(cc1)SCc2cncs2 62a_100000755918_100015185245 [0,1,0,0,0,0|2,0,1]=4 802 B15R2.100 Clc1ccc(cc1)SCc2cncs2 62a_100015185245_100000755918 [0,1,0,0,0,0|2,0,1]=4 803 B15R2.100 Clc1ccc(cc1)SCc2cscn2 62a_100000205941_100000755918 [0,1,0,0,0,0|2,0,0]=3 804 B15R2.100 Clc1ccc(cc1)SCc2cscn2 62a_100000755918_100000205941 [0,1,0,0,0,0|2,0,0]=3 805 B15R2.100 Clc1ccc(cc1)SCc2ncc[nH]2 62a_100000755918_100016991755 [0,1,0,0,0,0|3,0,0]=4 806 B15R2.100 Clc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000755918 [0,1,0,0,0,0|3,0,0]=4 807 B15R2.100 Clc1ccc(cc1)SCc2ncco2 62a_100000755918_103436540062 [0,1,0,0,0,0|3,0,0]=4 808 B15R2.100 Clc1ccc(cc1)SCc2ncco2 62a_103436540062_100000755918 [0,1,0,0,0,0|3,0,0]=4 809 B15R2.100 Clc1ccc(cc1)SCc2nccs2 62a_100000755918_100015184050 [0,1,0,0,0,0|3,0,0]=4 810 B15R2.100 Clc1ccc(cc1)SCc2nccs2 62a_100015184050_100000755918 [0,1,0,0,0,0|3,0,0]=4 811 B15R2.100 Clc1ccc(cc1)SCc2ncon2 62a_100000233494_100000755918 [0,1,0,0,0,0|3,0,0]=4 812 B15R2.100 Clc1ccc(cc1)SCc2ncon2 62a_100000755918_100000233494 [0,1,0,0,0,0|3,0,0]=4 813 B15R2.100 Clc1ccc(cc1)SCn2cncn2 62a_100000755918_200020645497 [0,1,0,0,0,0|2,0,1]=4 814 B15R2.100 Clc1ccc(cc1)SCn2cncn2 62a_200020645497_100000755918 [0,1,0,0,0,0|2,0,1]=4 815 B15R2.100 Clc1ccc(cn1)CSc2c[nH]cn2 62a_100000735431_100000756875 [0,1,0,0,0,0|3,0,0]=4 816 B15R2.100 Clc1ccc(cn1)CSc2c[nH]cn2 62a_100000756875_100000735431 [0,1,0,0,0,0|3,0,0]=4 817 B15R2.100 Clc1ccc(cn1)OCc2c[nH]cn2 34a_100000744096_100000707719 [0,1,0,0,0,0|2,0,0]=3 818 B15R2.100 Clc1ccc(cn1)OCc2cscn2 34a_100000744096_100000205941 [0,1,0,0,0,0|3,0,0]=4 819 B15R2.100 Clc1ccc(cn1)OCc2cscn2 7a_100000744096_100000205941 [0,1,0,0,0,0|3,0,0]=4 820 B15R2.100 Clc1ccc(cn1)SCc2c[nH]cn2 62a_100000034144_100000707719 [0,1,0,0,0,0|2,0,0]=3 821 B15R2.100 Clc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000034144 [0,1,0,0,0,0|2,0,0]=3 822 B15R2.100 Clc1ccc(cn1)SCc2cscn2 62a_100000034144_100000205941 [0,1,0,0,0,0|3,0,0]=4 823 B15R2.100 Clc1ccc(cn1)SCc2cscn2 62a_100000205941_100000034144 [0,1,0,0,0,0|3,0,0]=4 824 B15R2.100 Clc1ccc(nc1)CSc2c[nH]cn2 62a_100000756875_100000697101 [0,1,0,0,0,0|3,0,0]=4 825 B15R2.100 Clc1ccc(nc1)CSc2c[nH]cn2 62a_100012066911_100000756875 [0,1,0,0,0,0|3,0,0]=4 826 B15R2.100 Clc1ccc(nc1)OCc2c[nH]cn2 34a_100011215309_100000707719 [0,1,0,0,0,0|2,0,0]=3 827 B15R2.100 Clc1ccc(nc1)OCc2cscn2 34a_100011215309_100000205941 [0,1,0,0,0,0|3,0,0]=4 828 B15R2.100 Clc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100011356976 [0,1,0,0,0,0|2,0,0]=3 829 B15R2.100 Clc1ccc(nc1)SCc2c[nH]cn2 62a_100011356976_100000707719 [0,1,0,0,0,0|2,0,0]=3 830 B15R2.100 Clc1ccc(nc1)SCc2cscn2 62a_100000205941_100011356976 [0,1,0,0,0,0|3,0,0]=4 831 B15R2.100 Clc1ccc(nc1)SCc2cscn2 62a_100011356976_100000205941 [0,1,0,0,0,0|3,0,0]=4 832 B15R2.100 Clc1ccc(nn1)SCc2c[nH]cn2 62a_100000068654_100000707719 [0,1,0,0,0,0|3,0,0]=4 833 B15R2.100 Clc1ccc(nn1)SCc2c[nH]cn2 62a_100000707719_100000068654 [0,1,0,0,0,0|3,0,0]=4 834 B15R2.100 Clc1cnc(cn1)OCc2c[nH]cn2 34a_100015839800_100000707719 [0,1,0,0,0,0|3,0,0]=4 835 B15R2.100 Clc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100010214907 [0,1,0,0,0,0|3,0,0]=4 836 B15R2.100 Clc1cnc(cn1)SCc2c[nH]cn2 62a_100010214907_100000707719 [0,1,0,0,0,0|3,0,0]=4 837 B15R2.100 Clc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100011356929 [0,1,0,0,0,0|2,0,0]=3 838 B15R2.100 Clc1cnc(nc1)NCc2c[nH]nn2 27a_100020620823_100011356929 [0,1,0,0,0,0|3,0,0]=4 839 B15R2.100 Clc1cnc(nc1)NCc2cocn2 27a_100015188801_100011356929 [0,1,0,0,0,0|3,0,0]=4 840 B15R2.100 Clc1cnc(nc1)NCc2cscn2 27a_100015185402_100011356929 [0,1,0,0,0,0|3,0,0]=4 841 B15R2.100 Clc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100011356929 [0,1,0,0,0,0|3,0,0]=4 842 B15R2.100 Clc1cnc(nc1)SCc2c[nH]cn2 62a_100011356929_100000707719 [0,1,0,0,0,0|3,0,0]=4 843 B15R2.100 Clc1ncc(cn1)OCc2c[nH]cn2 34a_100000092845_100000707719 [0,1,0,0,0,0|3,0,0]=4 844 B15R2.100 Clc1ncc(cn1)SCc2c[nH]cn2 62a_100000059775_100000707719 [0,1,0,0,0,0|3,0,0]=4 845 B15R2.100 Clc1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_100000059775 [0,1,0,0,0,0|3,0,0]=4 846 B15R2.100 Fc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100102525539_100000756875 [0,1,0,0,0,0|1,0,1]=3 847 B15R2.100 Fc1ccc(cc1)C=Cc2cscn2 271570a_100102525539_100000751502 [0,1,0,0,0,0|2,0,1]=4 848 B15R2.100 Fc1ccc(cc1)C=Cc2nc[nH]n2 271570a_100102525539_100000761765 [0,1,0,0,0,0|2,0,1]=4 849 B15R2.100 Fc1ccc(cc1)CSc2c[nH]cn2 62a_100000198546_100000756875 [0,1,0,0,0,0|2,0,0]=3 850 B15R2.100 Fc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000187164 [0,1,0,0,0,0|2,0,0]=3 851 B15R2.100 Fc1ccc(cc1)CSc2c[nH]nn2 62a_100000198546_100009819707 [0,1,0,0,0,0|3,0,0]=4 852 B15R2.100 Fc1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100000187164 [0,1,0,0,0,0|3,0,0]=4 853 B15R2.100 Fc1ccc(cc1)CSc2cscn2 62a_100000198546_100000751502 [0,1,0,0,0,0|3,0,0]=4 854 B15R2.100 Fc1ccc(cc1)CSc2cscn2 62a_100000751502_100000187164 [0,1,0,0,0,0|3,0,0]=4 855 B15R2.100 Fc1ccc(cc1)CSc2nc[nH]n2 62a_100000198546_100000761765 [0,1,0,0,0,0|3,0,0]=4 856 B15R2.100 Fc1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100000187164 [0,1,0,0,0,0|3,0,0]=4 857 B15R2.100 Fc1ccc(cc1)NCC2=NCCN2 34a_100000185862_100000737910 [0,1,0,0,0,0|2,0,1]=4 858 B15R2.100 Fc1ccc(cc1)NCc2c[nH]cn2 34a_100000185862_100000707719 [0,1,0,0,0,0|0,0,0]=1 859 B15R2.100 Fc1ccc(cc1)NCc2cc[nH]n2 207a_100000185862_100000738523 [0,1,0,0,0,0|2,0,0]=3 860 B15R2.100 Fc1ccc(cc1)NCc2ccco2 207a_100000185862_100000186105 [0,1,0,0,0,0|2,0,0]=3 861 B15R2.100 Fc1ccc(cc1)NCc2ccco2 270302a_100000185862_100000186105 [0,1,0,0,0,0|2,0,0]=3 862 B15R2.100 Fc1ccc(cc1)NCc2cccs2 207a_100000185862_100000209959 [0,1,0,0,0,0|2,0,0]=3 863 B15R2.100 Fc1ccc(cc1)NCc2cccs2 270302a_100000185862_100000209959 [0,1,0,0,0,0|2,0,0]=3 864 B15R2.100 Fc1ccc(cc1)NCc2ccn[nH]2 34a_100000185862_100000728653 [0,1,0,0,0,0|2,0,1]=4 865 B15R2.100 Fc1ccc(cc1)NCc2ccoc2 207a_100000185862_100011215517 [0,1,0,0,0,0|2,0,0]=3 866 B15R2.100 Fc1ccc(cc1)NCc2ccon2 34a_100000185862_100000234950 [0,1,0,0,0,0|2,0,0]=3 867 B15R2.100 Fc1ccc(cc1)NCc2ccsc2 207a_100000185862_100000188534 [0,1,0,0,0,0|2,0,0]=3 868 B15R2.100 Fc1ccc(cc1)NCc2ccsc2 270302a_100000185862_100000188534 [0,1,0,0,0,0|2,0,0]=3 869 B15R2.100 Fc1ccc(cc1)NCc2ccsc2 34a_100000185862_100011261437 [0,1,0,0,0,0|2,0,0]=3 870 B15R2.100 Fc1ccc(cc1)NCc2cn[nH]c2 207a_100000185862_100016992096 [0,1,0,0,0,0|2,0,0]=3 871 B15R2.100 Fc1ccc(cc1)NCc2cn[nH]c2 270302a_100000185862_100016992096 [0,1,0,0,0,0|2,0,0]=3 872 B15R2.100 Fc1ccc(cc1)NCc2cnc[nH]2 207a_100000185862_100000742939 [0,1,0,0,0,0|0,0,2]=3 873 B15R2.100 Fc1ccc(cc1)NCc2cncs2 207a_100000185862_100000749870 [0,1,0,0,0,0|1,0,1]=3 874 B15R2.100 Fc1ccc(cc1)NCc2cncs2 270302a_100000185862_100000749870 [0,1,0,0,0,0|1,0,1]=3 875 B15R2.100 Fc1ccc(cc1)NCc2cncs2 34a_100000185862_100015185245 [0,1,0,0,0,0|1,0,1]=3 876 B15R2.100 Fc1ccc(cc1)NCc2cscn2 207a_100000185862_100000743575 [0,1,0,0,0,0|1,0,0]=2 877 B15R2.100 Fc1ccc(cc1)NCc2cscn2 270302a_100000185862_100000743575 [0,1,0,0,0,0|1,0,0]=2 878 B15R2.100 Fc1ccc(cc1)NCc2cscn2 34a_100000185862_100000205941 [0,1,0,0,0,0|1,0,0]=2 879 B15R2.100 Fc1ccc(cc1)NCc2ncc[nH]2 207a_100000185862_100000743867 [0,1,0,0,0,0|2,0,0]=3 880 B15R2.100 Fc1ccc(cc1)NCc2ncc[nH]2 34a_100000185862_100016991755 [0,1,0,0,0,0|2,0,0]=3 881 B15R2.100 Fc1ccc(cc1)NCc2ncco2 34a_100000185862_103436540062 [0,1,0,0,0,0|2,0,0]=3 882 B15R2.100 Fc1ccc(cc1)NCc2nccs2 207a_100000185862_100000750902 [0,1,0,0,0,0|2,0,0]=3 883 B15R2.100 Fc1ccc(cc1)NCc2nccs2 270302a_100000185862_100000750902 [0,1,0,0,0,0|2,0,0]=3 884 B15R2.100 Fc1ccc(cc1)NCc2nccs2 34a_100000185862_100015184050 [0,1,0,0,0,0|2,0,0]=3 885 B15R2.100 Fc1ccc(cc1)NCc2ncon2 34a_100000185862_100000233494 [0,1,0,0,0,0|2,0,0]=3 886 B15R2.100 Fc1ccc(cc1)NCc2nnn[nH]2 34a_100000185862_100000765167 [0,1,0,0,0,0|2,0,1]=4 887 B15R2.100 Fc1ccc(cc1)NCn2cncn2 34a_100000185862_200020645497 [0,1,0,0,0,0|1,0,1]=3 888 B15R2.100 Fc1ccc(cc1)OCc2c[nH]cn2 34a_100000210339_100000707719 [0,1,0,0,0,0|1,0,0]=2 889 B15R2.100 Fc1ccc(cc1)OCc2ccon2 34a_100000210339_100000234950 [0,1,0,0,0,0|3,0,0]=4 890 B15R2.100 Fc1ccc(cc1)OCc2ccsc2 34a_100000210339_100011261437 [0,1,0,0,0,0|3,0,0]=4 891 B15R2.100 Fc1ccc(cc1)OCc2cncs2 34a_100000210339_100015185245 [0,1,0,0,0,0|2,0,1]=4 892 B15R2.100 Fc1ccc(cc1)OCc2cscn2 34a_100000210339_100000205941 [0,1,0,0,0,0|2,0,0]=3 893 B15R2.100 Fc1ccc(cc1)OCc2ncc[nH]2 34a_100000210339_100016991755 [0,1,0,0,0,0|3,0,0]=4 894 B15R2.100 Fc1ccc(cc1)OCc2ncco2 34a_100000210339_103436540062 [0,1,0,0,0,0|3,0,0]=4 895 B15R2.100 Fc1ccc(cc1)OCc2nccs2 34a_100000210339_100015184050 [0,1,0,0,0,0|3,0,0]=4 896 B15R2.100 Fc1ccc(cc1)OCc2ncon2 34a_100000210339_100000233494 [0,1,0,0,0,0|3,0,0]=4 897 B15R2.100 Fc1ccc(cc1)OCn2cncn2 34a_100000210339_200020645497 [0,1,0,0,0,0|2,0,1]=4 898 B15R2.100 Fc1ccc(cc1)SCc2c[nH]cn2 62a_100000211213_100000707719 [0,1,0,0,0,0|1,0,0]=2 899 B15R2.100 Fc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000211213 [0,1,0,0,0,0|1,0,0]=2 900 B15R2.100 Fc1ccc(cc1)SCc2ccon2 62a_100000211213_100000234950 [0,1,0,0,0,0|3,0,0]=4 901 B15R2.100 Fc1ccc(cc1)SCc2ccon2 62a_100000234950_100000211213 [0,1,0,0,0,0|3,0,0]=4 902 B15R2.100 Fc1ccc(cc1)SCc2ccsc2 62a_100000211213_100011233845 [0,1,0,0,0,0|3,0,0]=4 903 B15R2.100 Fc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000211213 [0,1,0,0,0,0|3,0,0]=4 904 B15R2.100 Fc1ccc(cc1)SCc2cncs2 62a_100000211213_100015185245 [0,1,0,0,0,0|2,0,1]=4 905 B15R2.100 Fc1ccc(cc1)SCc2cncs2 62a_100015185245_100000211213 [0,1,0,0,0,0|2,0,1]=4 906 B15R2.100 Fc1ccc(cc1)SCc2cscn2 62a_100000205941_100000211213 [0,1,0,0,0,0|2,0,0]=3 907 B15R2.100 Fc1ccc(cc1)SCc2cscn2 62a_100000211213_100000205941 [0,1,0,0,0,0|2,0,0]=3 908 B15R2.100 Fc1ccc(cc1)SCc2ncc[nH]2 62a_100000211213_100016991755 [0,1,0,0,0,0|3,0,0]=4 909 B15R2.100 Fc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000211213 [0,1,0,0,0,0|3,0,0]=4 910 B15R2.100 Fc1ccc(cc1)SCc2ncco2 62a_100000211213_103436540062 [0,1,0,0,0,0|3,0,0]=4 911 B15R2.100 Fc1ccc(cc1)SCc2ncco2 62a_103436540062_100000211213 [0,1,0,0,0,0|3,0,0]=4 912 B15R2.100 Fc1ccc(cc1)SCc2nccs2 62a_100000211213_100015184050 [0,1,0,0,0,0|3,0,0]=4 913 B15R2.100 Fc1ccc(cc1)SCc2nccs2 62a_100015184050_100000211213 [0,1,0,0,0,0|3,0,0]=4 914 B15R2.100 Fc1ccc(cc1)SCc2ncon2 62a_100000211213_100000233494 [0,1,0,0,0,0|3,0,0]=4 915 B15R2.100 Fc1ccc(cc1)SCc2ncon2 62a_100000233494_100000211213 [0,1,0,0,0,0|3,0,0]=4 916 B15R2.100 Fc1ccc(cc1)SCn2cncn2 62a_100000211213_200020645497 [0,1,0,0,0,0|2,0,1]=4 917 B15R2.100 Fc1ccc(cc1)SCn2cncn2 62a_200020645497_100000211213 [0,1,0,0,0,0|2,0,1]=4 918 B15R2.100 Fc1ccc(cn1)CSc2c[nH]cn2 62a_100000756875_100000099788 [0,1,0,0,0,0|3,0,0]=4 919 B15R2.100 Fc1ccc(cn1)CSc2c[nH]cn2 62a_100009820150_100000756875 [0,1,0,0,0,0|3,0,0]=4 920 B15R2.100 Fc1ccc(cn1)OCc2c[nH]cn2 34a_100000688820_100000707719 [0,1,0,0,0,0|2,0,0]=3 921 B15R2.100 Fc1ccc(cn1)OCc2cscn2 34a_100000688820_100000205941 [0,1,0,0,0,0|3,0,0]=4 922 B15R2.100 Fc1ccc(cn1)OCc2cscn2 7a_100000688820_100000205941 [0,1,0,0,0,0|3,0,0]=4 923 B15R2.100 Fc1ccc(cn1)SCc2c[nH]cn2 62a_100000042367_100000707719 [0,1,0,0,0,0|2,0,0]=3 924 B15R2.100 Fc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000042367 [0,1,0,0,0,0|2,0,0]=3 925 B15R2.100 Fc1ccc(cn1)SCc2cscn2 62a_100000042367_100000205941 [0,1,0,0,0,0|3,0,0]=4 926 B15R2.100 Fc1ccc(cn1)SCc2cscn2 62a_100000205941_100000042367 [0,1,0,0,0,0|3,0,0]=4 927 B15R2.100 Fc1ccc(nc1)CSc2c[nH]cn2 62a_100000703193_100000756875 [0,1,0,0,0,0|3,0,0]=4 928 B15R2.100 Fc1ccc(nc1)CSc2c[nH]cn2 62a_100000756875_100000703193 [0,1,0,0,0,0|3,0,0]=4 929 B15R2.100 Fc1ccc(nc1)OCc2c[nH]cn2 34a_100000742473_100000707719 [0,1,0,0,0,0|2,0,0]=3 930 B15R2.100 Fc1ccc(nc1)OCc2cscn2 34a_100000742473_100000205941 [0,1,0,0,0,0|3,0,0]=4 931 B15R2.100 Fc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000744514 [0,1,0,0,0,0|2,0,0]=3 932 B15R2.100 Fc1ccc(nc1)SCc2c[nH]cn2 62a_100000744514_100000707719 [0,1,0,0,0,0|2,0,0]=3 933 B15R2.100 Fc1ccc(nc1)SCc2cscn2 62a_100000205941_100000744514 [0,1,0,0,0,0|3,0,0]=4 934 B15R2.100 Fc1ccc(nc1)SCc2cscn2 62a_100000744514_100000205941 [0,1,0,0,0,0|3,0,0]=4 935 B15R2.100 Fc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100009856528 [0,1,0,0,0,0|2,0,0]=3 936 B15R2.100 Fc1cnc(cn1)NCc2c[nH]nn2 27a_100020620823_100009856528 [0,1,0,0,0,0|3,0,0]=4 937 B15R2.100 Fc1cnc(cn1)NCc2cocn2 27a_100015188801_100009856528 [0,1,0,0,0,0|3,0,0]=4 938 B15R2.100 Fc1cnc(cn1)NCc2cscn2 27a_100015185402_100009856528 [0,1,0,0,0,0|3,0,0]=4 939 B15R2.100 Fc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100009856528 [0,1,0,0,0,0|3,0,0]=4 940 B15R2.100 Fc1cnc(cn1)SCc2c[nH]cn2 62a_100009856528_100000707719 [0,1,0,0,0,0|3,0,0]=4 941 B15R2.100 Fc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000685220 [0,1,0,0,0,0|2,0,0]=3 942 B15R2.100 Fc1cnc(nc1)NCc2c[nH]nn2 27a_100020620823_100000685220 [0,1,0,0,0,0|3,0,0]=4 943 B15R2.100 Fc1cnc(nc1)NCc2cocn2 27a_100015188801_100000685220 [0,1,0,0,0,0|3,0,0]=4 944 B15R2.100 Fc1cnc(nc1)NCc2cscn2 27a_100015185402_100000685220 [0,1,0,0,0,0|3,0,0]=4 945 B15R2.100 Fc1cnc(nc1)OCc2c[nH]cn2 34a_100011934040_100000707719 [0,1,0,0,0,0|3,0,0]=4 946 B15R2.100 Fc1cnc(nc1)SCc2c[nH]cn2 62a_100000685220_100000707719 [0,1,0,0,0,0|3,0,0]=4 947 B15R2.100 Fc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000685220 [0,1,0,0,0,0|3,0,0]=4 948 B15R2.100 Fc1ncc(cn1)OCc2c[nH]cn2 34a_200009874573_100000707719 [0,1,0,0,0,0|3,0,0]=4 949 B15R2.100 Fc1ncc(cn1)SCc2c[nH]cn2 62a_100000685262_100000707719 [0,1,0,0,0,0|3,0,0]=4 950 B15R2.100 Fc1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_100000685262 [0,1,0,0,0,0|3,0,0]=4 951 B15R2.100 Ic1ccc(cc1)CSc2c[nH]cn2 62a_100000189116_100000756875 [0,1,0,0,0,0|2,0,0]=3 952 B15R2.100 Ic1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000189116 [0,1,0,0,0,0|2,0,0]=3 953 B15R2.100 Ic1ccc(cc1)CSc2c[nH]nn2 62a_100000189116_100009819707 [0,1,0,0,0,0|3,0,0]=4 954 B15R2.100 Ic1ccc(cc1)CSc2c[nH]nn2 62a_100009819707_100000189116 [0,1,0,0,0,0|3,0,0]=4 955 B15R2.100 Ic1ccc(cc1)CSc2cscn2 62a_100000189116_100000751502 [0,1,0,0,0,0|3,0,0]=4 956 B15R2.100 Ic1ccc(cc1)CSc2cscn2 62a_100000751502_100000189116 [0,1,0,0,0,0|3,0,0]=4 957 B15R2.100 Ic1ccc(cc1)CSc2nc[nH]n2 62a_100000189116_100000761765 [0,1,0,0,0,0|3,0,0]=4 958 B15R2.100 Ic1ccc(cc1)CSc2nc[nH]n2 62a_100000761765_100000189116 [0,1,0,0,0,0|3,0,0]=4 959 B15R2.100 Ic1ccc(cc1)NCC2=NCCN2 34a_100000185761_100000737910 [0,1,0,0,0,0|2,0,1]=4 960 B15R2.100 Ic1ccc(cc1)NCc2c[nH]cn2 34a_100000185761_100000707719 [0,1,0,0,0,0|0,0,0]=1 961 B15R2.100 Ic1ccc(cc1)NCc2cc[nH]n2 207a_100000185761_100000738523 [0,1,0,0,0,0|2,0,0]=3 962 B15R2.100 Ic1ccc(cc1)NCc2ccco2 207a_100000185761_100000186105 [0,1,0,0,0,0|2,0,0]=3 963 B15R2.100 Ic1ccc(cc1)NCc2ccco2 270302a_100000185761_100000186105 [0,1,0,0,0,0|2,0,0]=3 964 B15R2.100 Ic1ccc(cc1)NCc2cccs2 207a_100000185761_100000209959 [0,1,0,0,0,0|2,0,0]=3 965 B15R2.100 Ic1ccc(cc1)NCc2cccs2 270302a_100000185761_100000209959 [0,1,0,0,0,0|2,0,0]=3 966 B15R2.100 Ic1ccc(cc1)NCc2ccn[nH]2 34a_100000185761_100000728653 [0,1,0,0,0,0|2,0,1]=4 967 B15R2.100 Ic1ccc(cc1)NCc2ccoc2 207a_100000185761_100011215517 [0,1,0,0,0,0|2,0,0]=3 968 B15R2.100 Ic1ccc(cc1)NCc2ccon2 34a_100000185761_100000234950 [0,1,0,0,0,0|2,0,0]=3 969 B15R2.100 Ic1ccc(cc1)NCc2ccsc2 207a_100000185761_100000188534 [0,1,0,0,0,0|2,0,0]=3 970 B15R2.100 Ic1ccc(cc1)NCc2ccsc2 270302a_100000185761_100000188534 [0,1,0,0,0,0|2,0,0]=3 971 B15R2.100 Ic1ccc(cc1)NCc2ccsc2 34a_100000185761_100011261437 [0,1,0,0,0,0|2,0,0]=3 972 B15R2.100 Ic1ccc(cc1)NCc2cn[nH]c2 207a_100000185761_100016992096 [0,1,0,0,0,0|2,0,0]=3 973 B15R2.100 Ic1ccc(cc1)NCc2cn[nH]c2 270302a_100000185761_100016992096 [0,1,0,0,0,0|2,0,0]=3 974 B15R2.100 Ic1ccc(cc1)NCc2cnc[nH]2 207a_100000185761_100000742939 [0,1,0,0,0,0|0,0,2]=3 975 B15R2.100 Ic1ccc(cc1)NCc2cncs2 207a_100000185761_100000749870 [0,1,0,0,0,0|1,0,1]=3 976 B15R2.100 Ic1ccc(cc1)NCc2cncs2 270302a_100000185761_100000749870 [0,1,0,0,0,0|1,0,1]=3 977 B15R2.100 Ic1ccc(cc1)NCc2cncs2 34a_100000185761_100015185245 [0,1,0,0,0,0|1,0,1]=3 978 B15R2.100 Ic1ccc(cc1)NCc2cscn2 207a_100000185761_100000743575 [0,1,0,0,0,0|1,0,0]=2 979 B15R2.100 Ic1ccc(cc1)NCc2cscn2 270302a_100000185761_100000743575 [0,1,0,0,0,0|1,0,0]=2 980 B15R2.100 Ic1ccc(cc1)NCc2cscn2 34a_100000185761_100000205941 [0,1,0,0,0,0|1,0,0]=2 981 B15R2.100 Ic1ccc(cc1)NCc2ncc[nH]2 207a_100000185761_100000743867 [0,1,0,0,0,0|2,0,0]=3 982 B15R2.100 Ic1ccc(cc1)NCc2ncc[nH]2 34a_100000185761_100016991755 [0,1,0,0,0,0|2,0,0]=3 983 B15R2.100 Ic1ccc(cc1)NCc2ncco2 34a_100000185761_103436540062 [0,1,0,0,0,0|2,0,0]=3 984 B15R2.100 Ic1ccc(cc1)NCc2nccs2 207a_100000185761_100000750902 [0,1,0,0,0,0|2,0,0]=3 985 B15R2.100 Ic1ccc(cc1)NCc2nccs2 270302a_100000185761_100000750902 [0,1,0,0,0,0|2,0,0]=3 986 B15R2.100 Ic1ccc(cc1)NCc2nccs2 34a_100000185761_100015184050 [0,1,0,0,0,0|2,0,0]=3 987 B15R2.100 Ic1ccc(cc1)NCc2ncon2 34a_100000185761_100000233494 [0,1,0,0,0,0|2,0,0]=3 988 B15R2.100 Ic1ccc(cc1)NCc2nnn[nH]2 34a_100000185761_100000765167 [0,1,0,0,0,0|2,0,1]=4 989 B15R2.100 Ic1ccc(cc1)NCn2cncn2 34a_100000185761_200020645497 [0,1,0,0,0,0|1,0,1]=3 990 B15R2.100 Ic1ccc(cc1)OCc2c[nH]cn2 34a_100000212066_100000707719 [0,1,0,0,0,0|1,0,0]=2 991 B15R2.100 Ic1ccc(cc1)OCc2ccon2 34a_100000212066_100000234950 [0,1,0,0,0,0|3,0,0]=4 992 B15R2.100 Ic1ccc(cc1)OCc2ccon2 7a_100000212066_100000234950 [0,1,0,0,0,0|3,0,0]=4 993 B15R2.100 Ic1ccc(cc1)OCc2ccsc2 34a_100000212066_100011261437 [0,1,0,0,0,0|3,0,0]=4 994 B15R2.100 Ic1ccc(cc1)OCc2ccsc2 7a_100000212066_100011261437 [0,1,0,0,0,0|3,0,0]=4 995 B15R2.100 Ic1ccc(cc1)OCc2cncs2 34a_100000212066_100015185245 [0,1,0,0,0,0|2,0,1]=4 996 B15R2.100 Ic1ccc(cc1)OCc2cncs2 7a_100000212066_100015185245 [0,1,0,0,0,0|2,0,1]=4 997 B15R2.100 Ic1ccc(cc1)OCc2cscn2 34a_100000212066_100000205941 [0,1,0,0,0,0|2,0,0]=3 998 B15R2.100 Ic1ccc(cc1)OCc2cscn2 7a_100000212066_100000205941 [0,1,0,0,0,0|2,0,0]=3 999 B15R2.100 Ic1ccc(cc1)OCc2ncc[nH]2 34a_100000212066_100016991755 [0,1,0,0,0,0|3,0,0]=4 1000 B15R2.100 Ic1ccc(cc1)OCc2ncc[nH]2 7a_100000212066_100000753453 [0,1,0,0,0,0|3,0,0]=4 1001 B15R2.100 Ic1ccc(cc1)OCc2ncco2 34a_100000212066_103436540062 [0,1,0,0,0,0|3,0,0]=4 1002 B15R2.100 Ic1ccc(cc1)OCc2ncco2 7a_100000212066_103436540062 [0,1,0,0,0,0|3,0,0]=4 1003 B15R2.100 Ic1ccc(cc1)OCc2nccs2 34a_100000212066_100015184050 [0,1,0,0,0,0|3,0,0]=4 1004 B15R2.100 Ic1ccc(cc1)OCc2nccs2 7a_100000212066_100015184050 [0,1,0,0,0,0|3,0,0]=4 1005 B15R2.100 Ic1ccc(cc1)OCc2ncon2 34a_100000212066_100000233494 [0,1,0,0,0,0|3,0,0]=4 1006 B15R2.100 Ic1ccc(cc1)OCn2cncn2 34a_100000212066_200020645497 [0,1,0,0,0,0|2,0,1]=4 1007 B15R2.100 Ic1ccc(cc1)OCn2cncn2 7a_100000212066_200020645497 [0,1,0,0,0,0|2,0,1]=4 1008 B15R2.100 Ic1ccc(cn1)OCc2c[nH]cn2 34a_100000687607_100000707719 [0,1,0,0,0,0|2,0,0]=3 1009 B15R2.100 Ic1ccc(cn1)OCc2cscn2 34a_100000687607_100000205941 [0,1,0,0,0,0|3,0,0]=4 1010 B15R2.100 Ic1ccc(cn1)OCc2cscn2 7a_100000687607_100000205941 [0,1,0,0,0,0|3,0,0]=4 1011 B15R2.100 Nc1ccc(cc1)OCc2c[nH]cn2 34a_100000185829_100000707719 [0,1,0,0,0,0|1,0,0]=2 1012 B15R2.100 Nc1ccc(cc1)OCc2ccon2 34a_100000185829_100000234950 [0,1,0,0,0,0|3,0,0]=4 1013 B15R2.100 Nc1ccc(cc1)OCc2ccsc2 34a_100000185829_100011261437 [0,1,0,0,0,0|3,0,0]=4 1014 B15R2.100 Nc1ccc(cc1)OCc2cncs2 34a_100000185829_100015185245 [0,1,0,0,0,0|2,0,1]=4 1015 B15R2.100 Nc1ccc(cc1)OCc2cscn2 34a_100000185829_100000205941 [0,1,0,0,0,0|2,0,0]=3 1016 B15R2.100 Nc1ccc(cc1)OCc2ncc[nH]2 34a_100000185829_100016991755 [0,1,0,0,0,0|3,0,0]=4 1017 B15R2.100 Nc1ccc(cc1)OCc2ncco2 34a_100000185829_103436540062 [0,1,0,0,0,0|3,0,0]=4 1018 B15R2.100 Nc1ccc(cc1)OCc2nccs2 34a_100000185829_100015184050 [0,1,0,0,0,0|3,0,0]=4 1019 B15R2.100 Nc1ccc(cc1)OCc2ncon2 34a_100000185829_100000233494 [0,1,0,0,0,0|3,0,0]=4 1020 B15R2.100 Nc1ccc(cc1)OCn2cncn2 34a_100000185829_200020645497 [0,1,0,0,0,0|2,0,1]=4 1021 B15R2.100 Nc1ccc(cc1)SCc2c[nH]cn2 62a_100000185761_100000707719 [0,1,0,0,0,0|1,0,0]=2 1022 B15R2.100 Nc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000185761 [0,1,0,0,0,0|1,0,0]=2 1023 B15R2.100 Nc1ccc(cc1)SCc2ccon2 62a_100000185761_100000234950 [0,1,0,0,0,0|3,0,0]=4 1024 B15R2.100 Nc1ccc(cc1)SCc2ccon2 62a_100000234950_100000185761 [0,1,0,0,0,0|3,0,0]=4 1025 B15R2.100 Nc1ccc(cc1)SCc2ccsc2 62a_100000185761_100011233845 [0,1,0,0,0,0|3,0,0]=4 1026 B15R2.100 Nc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000185761 [0,1,0,0,0,0|3,0,0]=4 1027 B15R2.100 Nc1ccc(cc1)SCc2cncs2 62a_100000185761_100015185245 [0,1,0,0,0,0|2,0,1]=4 1028 B15R2.100 Nc1ccc(cc1)SCc2cncs2 62a_100015185245_100000185761 [0,1,0,0,0,0|2,0,1]=4 1029 B15R2.100 Nc1ccc(cc1)SCc2cscn2 62a_100000185761_100000205941 [0,1,0,0,0,0|2,0,0]=3 1030 B15R2.100 Nc1ccc(cc1)SCc2cscn2 62a_100000205941_100000185761 [0,1,0,0,0,0|2,0,0]=3 1031 B15R2.100 Nc1ccc(cc1)SCc2ncc[nH]2 62a_100000185761_100016991755 [0,1,0,0,0,0|3,0,0]=4 1032 B15R2.100 Nc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000185761 [0,1,0,0,0,0|3,0,0]=4 1033 B15R2.100 Nc1ccc(cc1)SCc2ncco2 62a_100000185761_103436540062 [0,1,0,0,0,0|3,0,0]=4 1034 B15R2.100 Nc1ccc(cc1)SCc2ncco2 62a_103436540062_100000185761 [0,1,0,0,0,0|3,0,0]=4 1035 B15R2.100 Nc1ccc(cc1)SCc2nccs2 62a_100000185761_100015184050 [0,1,0,0,0,0|3,0,0]=4 1036 B15R2.100 Nc1ccc(cc1)SCc2nccs2 62a_100015184050_100000185761 [0,1,0,0,0,0|3,0,0]=4 1037 B15R2.100 Nc1ccc(cc1)SCc2ncon2 62a_100000185761_100000233494 [0,1,0,0,0,0|3,0,0]=4 1038 B15R2.100 Nc1ccc(cc1)SCc2ncon2 62a_100000233494_100000185761 [0,1,0,0,0,0|3,0,0]=4 1039 B15R2.100 Nc1ccc(cc1)SCn2cncn2 62a_100000185761_200020645497 [0,1,0,0,0,0|2,0,1]=4 1040 B15R2.100 Nc1ccc(cc1)SCn2cncn2 62a_200020645497_100000185761 [0,1,0,0,0,0|2,0,1]=4 1041 B15R2.100 Nc1ccc(cn1)OCc2c[nH]cn2 34a_100015188713_100000707719 [0,1,0,0,0,0|2,0,0]=3 1042 B15R2.100 Nc1ccc(cn1)OCc2cscn2 34a_100015188713_100000205941 [0,1,0,0,0,0|3,0,0]=4 1043 B15R2.100 Nc1ccc(cn1)OCc2cscn2 7a_100015188713_100000205941 [0,1,0,0,0,0|3,0,0]=4 1044 B15R2.100 Nc1ccc(cn1)SCc2c[nH]cn2 62a_100000187370_100000707719 [0,1,0,0,0,0|2,0,0]=3 1045 B15R2.100 Nc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000187370 [0,1,0,0,0,0|2,0,0]=3 1046 B15R2.100 Nc1ccc(cn1)SCc2cscn2 62a_100000187370_100000205941 [0,1,0,0,0,0|3,0,0]=4 1047 B15R2.100 Nc1ccc(cn1)SCc2cscn2 62a_100000205941_100000187370 [0,1,0,0,0,0|3,0,0]=4 1048 B15R2.100 Nc1ccc(nc1)OCc2c[nH]cn2 34a_100000729260_100000707719 [0,1,0,0,0,0|2,0,0]=3 1049 B15R2.100 Nc1ccc(nc1)OCc2cscn2 34a_100000729260_100000205941 [0,1,0,0,0,0|3,0,0]=4 1050 B15R2.100 Nc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000737798 [0,1,0,0,0,0|2,0,0]=3 1051 B15R2.100 Nc1ccc(nc1)SCc2c[nH]cn2 62a_100000737798_100000707719 [0,1,0,0,0,0|2,0,0]=3 1052 B15R2.100 Nc1ccc(nc1)SCc2cscn2 62a_100000205941_100000737798 [0,1,0,0,0,0|3,0,0]=4 1053 B15R2.100 Nc1ccc(nc1)SCc2cscn2 62a_100000737798_100000205941 [0,1,0,0,0,0|3,0,0]=4 1054 B15R2.100 Nc1ccc(nn1)SCc2c[nH]cn2 62a_100000707719_100010219413 [0,1,0,0,0,0|3,0,0]=4 1055 B15R2.100 Nc1ccc(nn1)SCc2c[nH]cn2 62a_100010219413_100000707719 [0,1,0,0,0,0|3,0,0]=4 1056 B15R2.100 Nc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100000744751 [0,1,0,0,0,0|3,0,0]=4 1057 B15R2.100 Nc1cnc(cn1)SCc2c[nH]cn2 62a_100000744751_100000707719 [0,1,0,0,0,0|3,0,0]=4 1058 B15R2.100 Nc1cnc(nc1)SCc2c[nH]cn2 62a_100000068403_100000707719 [0,1,0,0,0,0|3,0,0]=4 1059 B15R2.100 Nc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000068403 [0,1,0,0,0,0|3,0,0]=4 1060 B15R2.100 Nc1ncc(cn1)OCc2c[nH]cn2 34a_100000087137_100000707719 [0,1,0,0,0,0|3,0,0]=4 1061 B15R2.100 Nc1ncc(cn1)SCc2c[nH]cn2 62a_100000707719_100000766020 [0,1,0,0,0,0|3,0,0]=4 1062 B15R2.100 Nc1ncc(cn1)SCc2c[nH]cn2 62a_100000766020_100000707719 [0,1,0,0,0,0|3,0,0]=4 1063 B15R2.100 Nc1ncc(nn1)NCc2c[nH]cn2 27a_100000758547_100000691435 [0,1,0,0,0,0|3,0,0]=4 1064 B15R2.100 O=c1ccc(c[nH]1)OCc2c[nH]cn2 34a_100000075641_100000707719 [0,1,0,0,0,0|2,0,0]=3 1065 B15R2.100 O=c1ccc(c[nH]1)OCc2cscn2 34a_100000075641_100000205941 [0,1,0,0,0,0|3,0,0]=4 1066 B15R2.100 O=c1ccc(c[nH]1)SCc2c[nH]cn2 62a_100000212171_100000707719 [0,1,0,0,0,0|2,0,0]=3 1067 B15R2.100 O=c1ccc(c[nH]1)SCc2c[nH]cn2 62a_100000707719_100000212171 [0,1,0,0,0,0|2,0,0]=3 1068 B15R2.100 O=c1ccc(c[nH]1)SCc2cscn2 62a_100000205941_100000212171 [0,1,0,0,0,0|3,0,0]=4 1069 B15R2.100 O=c1ccc(c[nH]1)SCc2cscn2 62a_100000212171_100000205941 [0,1,0,0,0,0|3,0,0]=4 1070 B15R2.100 O=c1ccc(n[nH]1)SCc2c[nH]cn2 62a_100000707719_100009820020 [0,1,0,0,0,0|3,0,0]=4 1071 B15R2.100 O=c1ccc(n[nH]1)SCc2c[nH]cn2 62a_100009820020_100000707719 [0,1,0,0,0,0|3,0,0]=4 1072 B15R2.100 O=c1ncc(c[nH]1)SCc2c[nH]cn2 62a_100000707719_102495366499 [0,1,0,0,0,0|3,0,0]=4 1073 B15R2.100 O=c1ncc(c[nH]1)SCc2c[nH]cn2 62a_102495366499_100000707719 [0,1,0,0,0,0|3,0,0]=4 1074 B15R2.100 Oc1ccc(cc1)NCC2=NCCN2 34a_100000185829_100000737910 [0,1,0,0,0,0|2,0,1]=4 1075 B15R2.100 Oc1ccc(cc1)NCc2c[nH]cn2 34a_100000185829_100000707719 [0,1,0,0,0,0|0,0,0]=1 1076 B15R2.100 Oc1ccc(cc1)NCc2ccco2 270302a_100000185829_100000186105 [0,1,0,0,0,0|2,0,0]=3 1077 B15R2.100 Oc1ccc(cc1)NCc2cccs2 270302a_100000185829_100000209959 [0,1,0,0,0,0|2,0,0]=3 1078 B15R2.100 Oc1ccc(cc1)NCc2cccs2 271570a_203496583355_100000188760 [0,1,0,0,0,0|2,0,0]=3 1079 B15R2.100 Oc1ccc(cc1)NCc2ccn[nH]2 34a_100000185829_100000728653 [0,1,0,0,0,0|2,0,1]=4 1080 B15R2.100 Oc1ccc(cc1)NCc2ccon2 34a_100000185829_100000234950 [0,1,0,0,0,0|2,0,0]=3 1081 B15R2.100 Oc1ccc(cc1)NCc2ccsc2 270302a_100000185829_100000188534 [0,1,0,0,0,0|2,0,0]=3 1082 B15R2.100 Oc1ccc(cc1)NCc2ccsc2 34a_100000185829_100011261437 [0,1,0,0,0,0|2,0,0]=3 1083 B15R2.100 Oc1ccc(cc1)NCc2cn[nH]c2 270302a_100000185829_100016992096 [0,1,0,0,0,0|2,0,0]=3 1084 B15R2.100 Oc1ccc(cc1)NCc2cncs2 270302a_100000185829_100000749870 [0,1,0,0,0,0|1,0,1]=3 1085 B15R2.100 Oc1ccc(cc1)NCc2cncs2 34a_100000185829_100015185245 [0,1,0,0,0,0|1,0,1]=3 1086 B15R2.100 Oc1ccc(cc1)NCc2cscn2 270302a_100000185829_100000743575 [0,1,0,0,0,0|1,0,0]=2 1087 B15R2.100 Oc1ccc(cc1)NCc2cscn2 34a_100000185829_100000205941 [0,1,0,0,0,0|1,0,0]=2 1088 B15R2.100 Oc1ccc(cc1)NCc2ncc[nH]2 34a_100000185829_100016991755 [0,1,0,0,0,0|2,0,0]=3 1089 B15R2.100 Oc1ccc(cc1)NCc2ncco2 34a_100000185829_103436540062 [0,1,0,0,0,0|2,0,0]=3 1090 B15R2.100 Oc1ccc(cc1)NCc2nccs2 270302a_100000185829_100000750902 [0,1,0,0,0,0|2,0,0]=3 1091 B15R2.100 Oc1ccc(cc1)NCc2nccs2 34a_100000185829_100015184050 [0,1,0,0,0,0|2,0,0]=3 1092 B15R2.100 Oc1ccc(cc1)NCc2ncon2 34a_100000185829_100000233494 [0,1,0,0,0,0|2,0,0]=3 1093 B15R2.100 Oc1ccc(cc1)NCc2nnn[nH]2 34a_100000185829_100000765167 [0,1,0,0,0,0|2,0,1]=4 1094 B15R2.100 Oc1ccc(cc1)NCn2cncn2 34a_100000185829_200020645497 [0,1,0,0,0,0|1,0,1]=3 1095 B15R2.100 Oc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000185759 [0,1,0,0,0,0|1,0,0]=2 1096 B15R2.100 Oc1ccc(cc1)SCc2ccon2 62a_100000234950_100000185759 [0,1,0,0,0,0|3,0,0]=4 1097 B15R2.100 Oc1ccc(cc1)SCc2ccsc2 62a_100011261437_100000185759 [0,1,0,0,0,0|3,0,0]=4 1098 B15R2.100 Oc1ccc(cc1)SCc2cncs2 62a_100015185245_100000185759 [0,1,0,0,0,0|2,0,1]=4 1099 B15R2.100 Oc1ccc(cc1)SCc2cscn2 62a_100000205941_100000185759 [0,1,0,0,0,0|2,0,0]=3 1100 B15R2.100 Oc1ccc(cc1)SCc2ncc[nH]2 62a_100016991755_100000185759 [0,1,0,0,0,0|3,0,0]=4 1101 B15R2.100 Oc1ccc(cc1)SCc2ncco2 62a_103436540062_100000185759 [0,1,0,0,0,0|3,0,0]=4 1102 B15R2.100 Oc1ccc(cc1)SCc2nccs2 62a_100015184050_100000185759 [0,1,0,0,0,0|3,0,0]=4 1103 B15R2.100 Oc1ccc(cc1)SCc2ncon2 62a_100000233494_100000185759 [0,1,0,0,0,0|3,0,0]=4 1104 B15R2.100 Oc1ccc(cc1)SCn2cncn2 62a_200020645497_100000185759 [0,1,0,0,0,0|2,0,1]=4 1105 B15R2.100 Oc1ccc(nc1)SCc2c[nH]cn2 62a_100000685995_100000707719 [0,1,0,0,0,0|2,0,0]=3 1106 B15R2.100 Oc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000744096 [0,1,0,0,0,0|2,0,0]=3 1107 B15R2.100 Oc1ccc(nc1)SCc2cscn2 62a_100000205941_100000744096 [0,1,0,0,0,0|3,0,0]=4 1108 B15R2.100 Oc1ccc(nc1)SCc2cscn2 62a_100000685995_100000205941 [0,1,0,0,0,0|3,0,0]=4 1109 B15R2.100 Oc1cnc(cn1)SCc2c[nH]cn2 62a_100000707719_100015839800 [0,1,0,0,0,0|3,0,0]=4 1110 B15R2.100 Oc1cnc(cn1)SCc2c[nH]cn2 62a_100011934580_100000707719 [0,1,0,0,0,0|3,0,0]=4 1111 B15R2.100 Oc1cnc(nc1)SCc2c[nH]cn2 62a_100000707719_100000092845 [0,1,0,0,0,0|3,0,0]=4 1112 B15R2.100 Oc1cnc(nc1)SCc2c[nH]cn2 62a_100000730009_100000707719 [0,1,0,0,0,0|3,0,0]=4 1113 B15R2.100 [O-][n+]1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000039755 [0,1,0,0,0,0|2,0,0]=3 1114 B15R2.100 [O-][n+]1ccc(cc1)SCc2cscn2 62a_100000205941_100000039755 [0,1,0,0,0,0|3,0,0]=4 1115 B15R2.283 Brc1cc(cs1)CNc2ccccc2 207a_100000106764_100000737087 [0,1,0,0,0,0|2,0,0]=3 1116 B15R2.283 Brc1cc(cs1)CNc2ccccc2 270302a_100000106764_100000737087 [0,1,0,0,0,0|2,0,0]=3 1117 B15R2.283 Brc1cc(on1)CNc2ccccc2 270302a_100000106764_100009819588 [0,1,0,0,0,0|2,0,1]=4 1118 B15R2.283 Brc1ccc(o1)CNc2ccccc2 207a_100000106764_100000185145 [0,1,0,0,0,0|2,0,0]=3 1119 B15R2.283 Brc1ccc(s1)CNc2ccccc2 207a_100000106764_100000179771 [0,1,0,0,0,0|2,0,0]=3 1120 B15R2.283 Brc1ccc(s1)CNc2ccccc2 270302a_100000106764_100000179771 [0,1,0,0,0,0|2,0,0]=3 1121 B15R2.283 Brc1ccc(s1)CNc2ccccc2 34a_100000106764_100000708592 [0,1,0,0,0,0|2,0,0]=3 1122 B15R2.283 Brc1ccc(s1)COc2ccccc2 34a_100000210340_100000708592 [0,1,0,0,0,0|3,0,0]=4 1123 B15R2.283 Brc1ccc(s1)COc2ccccc2 7a_100000210340_100000708592 [0,1,0,0,0,0|3,0,0]=4 1124 B15R2.283 Brc1ccc(s1)CSc2ccccc2 62a_100000708592_100000041952 [0,1,0,0,0,0|3,0,0]=4 1125 B15R2.283 Brc1ccc(s1)CSc2ccccc2 62a_100000719477_100000708592 [0,1,0,0,0,0|3,0,0]=4 1126 B15R2.283 Brc1cnc(s1)CNc2ccccc2 270302a_100000106764_100000699580 [0,1,0,0,0,0|2,0,0]=3 1127 B15R2.283 Brc1coc(c1)CNc2ccccc2 270302a_100000106764_100000747035 [0,1,0,0,0,0|2,0,0]=3 1128 B15R2.283 Brc1csc(c1)CNc2ccccc2 207a_100000106764_100000211722 [0,1,0,0,0,0|2,0,0]=3 1129 B15R2.283 Brc1csc(c1)CNc2ccccc2 270302a_100000106764_100000211722 [0,1,0,0,0,0|2,0,0]=3 1130 B15R2.283 Brc1csc(c1)CNc2ccccc2 34a_100000106764_100000746031 [0,1,0,0,0,0|2,0,0]=3 1131 B15R2.283 Brc1csc(c1)COc2ccccc2 34a_100000210340_100000746031 [0,1,0,0,0,0|3,0,0]=4 1132 B15R2.283 Brc1csc(c1)COc2ccccc2 7a_100000210340_100000746031 [0,1,0,0,0,0|3,0,0]=4 1133 B15R2.283 Brc1csc(c1)CSc2ccccc2 62a_100000719477_100000746031 [0,1,0,0,0,0|3,0,0]=4 1134 B15R2.283 Brc1csc(c1)CSc2ccccc2 62a_100000746031_100000041952 [0,1,0,0,0,0|3,0,0]=4 1135 B15R2.283 Brc1ncc(s1)CNc2ccccc2 34a_100000106764_100000717027 [0,1,0,0,0,0|1,0,1]=3 1136 B15R2.283 Brc1ncc(s1)COc2ccccc2 34a_100000210340_100000717027 [0,1,0,0,0,0|2,0,1]=4 1137 B15R2.283 Brc1ncc(s1)COc2ccccc2 7a_100000210340_100000717027 [0,1,0,0,0,0|2,0,1]=4 1138 B15R2.283 Brc1ncc(s1)CSc2ccccc2 62a_100000717027_100000041952 [0,1,0,0,0,0|2,0,1]=4 1139 B15R2.283 Brc1ncc(s1)CSc2ccccc2 62a_100000719477_100000717027 [0,1,0,0,0,0|2,0,1]=4 1140 B15R2.283 Cc1c[nH]c(n1)CNc2ccccc2 207a_100000106764_100000082322 [0,1,0,0,0,0|2,0,0]=3 1141 B15R2.283 Cc1cc([nH]n1)CNc2ccccc2 207a_100000106764_100000028150 [0,1,0,0,0,0|2,0,1]=4 1142 B15R2.283 Cc1cc([nH]n1)CNc2ccccc2 270302a_100000106764_100000028150 [0,1,0,0,0,0|2,0,1]=4 1143 B15R2.283 Cc1cc(cs1)CNc2ccccc2 207a_100000106764_100011998532 [0,1,0,0,0,0|2,0,0]=3 1144 B15R2.283 Cc1cc(cs1)CNc2ccccc2 270302a_100000106764_100011998532 [0,1,0,0,0,0|2,0,0]=3 1145 B15R2.283 Cc1cc(no1)CNc2ccccc2 207a_100000106764_100011217994 [0,1,0,0,0,0|2,0,0]=3 1146 B15R2.283 Cc1cc(no1)CNc2ccccc2 34a_100000106764_100000199038 [0,1,0,0,0,0|2,0,0]=3 1147 B15R2.283 Cc1cc(no1)COc2ccccc2 34a_100000210340_100000199038 [0,1,0,0,0,0|3,0,0]=4 1148 B15R2.283 Cc1cc(no1)COc2ccccc2 7a_100000210340_100000199038 [0,1,0,0,0,0|3,0,0]=4 1149 B15R2.283 Cc1cc(no1)CSc2ccccc2 62a_100000199038_100000041952 [0,1,0,0,0,0|3,0,0]=4 1150 B15R2.283 Cc1cc(no1)CSc2ccccc2 62a_100000719477_100000199038 [0,1,0,0,0,0|3,0,0]=4 1151 B15R2.283 Cc1cc(ns1)CNc2ccccc2 207a_100000106764_200000100279 [0,1,0,0,0,0|2,0,0]=3 1152 B15R2.283 Cc1cc(ns1)CNc2ccccc2 270302a_100000106764_200000100279 [0,1,0,0,0,0|2,0,0]=3 1153 B15R2.283 Cc1cc(on1)CNc2ccccc2 207a_100000106764_100011794430 [0,1,0,0,0,0|2,0,1]=4 1154 B15R2.283 Cc1cc(on1)CNc2ccccc2 270302a_100000106764_100011794430 [0,1,0,0,0,0|2,0,1]=4 1155 B15R2.283 Cc1cc(on1)CNc2ccccc2 34a_100000106764_100000707947 [0,1,0,0,0,0|2,0,1]=4 1156 B15R2.283 Cc1ccc(o1)CNc2ccccc2 207a_100000106764_100000183696 [0,1,0,0,0,0|2,0,0]=3 1157 B15R2.283 Cc1ccc(o1)CNc2ccccc2 270302a_100000106764_100000183696 [0,1,0,0,0,0|2,0,0]=3 1158 B15R2.283 Cc1ccc(s1)CNc2ccccc2 207a_100000106764_100000211121 [0,1,0,0,0,0|2,0,0]=3 1159 B15R2.283 Cc1ccc(s1)CNc2ccccc2 270302a_100000106764_100000211121 [0,1,0,0,0,0|2,0,0]=3 1160 B15R2.283 Cc1cnc(s1)CNc2ccccc2 207a_100000106764_100011361622 [0,1,0,0,0,0|2,0,0]=3 1161 B15R2.283 Cc1cnc(s1)CNc2ccccc2 270302a_100000106764_100011361622 [0,1,0,0,0,0|2,0,0]=3 1162 B15R2.283 Cc1csc(c1)CNc2ccccc2 207a_100000106764_100102525248 [0,1,0,0,0,0|2,0,0]=3 1163 B15R2.283 Cc1csc(c1)CNc2ccccc2 270302a_100000106764_100102525248 [0,1,0,0,0,0|2,0,0]=3 1164 B15R2.283 Cc1csc(n1)CNc2ccccc2 207a_100000106764_100000756994 [0,1,0,0,0,0|2,0,0]=3 1165 B15R2.283 Cc1nc(c[nH]1)C#Cc2ccccc2 271570a_100000069678_100009814057 [0,1,0,0,0,0|1,0,1]=3 1166 B15R2.283 Cc1nc(c[nH]1)C=Cc2ccccc2 271570a_100102527694_100009814057 [0,1,0,0,0,0|1,0,1]=3 1167 B15R2.283 Cc1nc(c[nH]1)C=Cc2cccnc2 271570a_100102525586_100009814057 [0,1,0,0,0,0|2,0,1]=4 1168 B15R2.283 Cc1nc(c[nH]1)CNc2ccccc2 207a_100000106764_100011219055 [0,1,0,0,0,0|0,0,0]=1 1169 B15R2.283 Cc1nc(c[nH]1)SCc2ccccc2 62a_100000211182_100009814057 [0,1,0,0,0,0|2,0,0]=3 1170 B15R2.283 Cc1nc(c[nH]1)SCc2ccccc2 62a_100009814057_100015291786 [0,1,0,0,0,0|2,0,0]=3 1171 B15R2.283 Cc1nc(c[nH]1)SCc2ccccn2 62a_100000721315_100009814057 [0,1,0,0,0,0|3,0,0]=4 1172 B15R2.283 Cc1nc(c[nH]1)SCc2ccccn2 62a_100009814057_100000721315 [0,1,0,0,0,0|3,0,0]=4 1173 B15R2.283 Cc1nc(c[nH]1)SCc2cccnc2 62a_100000741622_100009814057 [0,1,0,0,0,0|3,0,0]=4 1174 B15R2.283 Cc1nc(c[nH]1)SCc2cccnc2 62a_100009814057_100000741622 [0,1,0,0,0,0|3,0,0]=4 1175 B15R2.283 Cc1nc(c[nH]1)SCc2ccncc2 62a_100009814057_100015193705 [0,1,0,0,0,0|3,0,0]=4 1176 B15R2.283 Cc1nc(c[nH]1)SCc2ccncc2 62a_100015193705_100009814057 [0,1,0,0,0,0|3,0,0]=4 1177 B15R2.283 Cc1nc(co1)CNc2ccccc2 207a_100000106764_100011361629 [0,1,0,0,0,0|1,0,0]=2 1178 B15R2.283 Cc1nc(cs1)C#Cc2ccccc2 271570a_100000069678_100011934587 [0,1,0,0,0,0|2,0,1]=4 1179 B15R2.283 Cc1nc(cs1)C=Cc2ccccc2 271570a_100102527694_100011934587 [0,1,0,0,0,0|2,0,1]=4 1180 B15R2.283 Cc1nc(cs1)CNc2ccccc2 207a_100000106764_100000203724 [0,1,0,0,0,0|1,0,0]=2 1181 B15R2.283 Cc1nc(cs1)CNc2ccccc2 270302a_100000106764_100000203724 [0,1,0,0,0,0|1,0,0]=2 1182 B15R2.283 Cc1nc(cs1)CNc2ccccc2 34a_100000106764_100015186478 [0,1,0,0,0,0|1,0,0]=2 1183 B15R2.283 Cc1nc(cs1)CNc2cccnn2 27a_100000707933_100016991348 [0,1,0,0,0,0|3,0,0]=4 1184 B15R2.283 Cc1nc(cs1)CNc2ccncn2 27a_100000707933_100000703185 [0,1,0,0,0,0|3,0,0]=4 1185 B15R2.283 Cc1nc(cs1)CNc2cnccn2 27a_100000707933_100000211759 [0,1,0,0,0,0|3,0,0]=4 1186 B15R2.283 Cc1nc(cs1)CNc2ncccn2 27a_100000707933_100000211032 [0,1,0,0,0,0|3,0,0]=4 1187 B15R2.283 Cc1nc(cs1)COc2ccccc2 34a_100000210340_100015186478 [0,1,0,0,0,0|2,0,0]=3 1188 B15R2.283 Cc1nc(cs1)COc2ccccc2 7a_100000210340_100015186478 [0,1,0,0,0,0|2,0,0]=3 1189 B15R2.283 Cc1nc(cs1)COc2cccnc2 34a_100000210849_100015186478 [0,1,0,0,0,0|3,0,0]=4 1190 B15R2.283 Cc1nc(cs1)COc2cccnc2 7a_100000210849_100015186478 [0,1,0,0,0,0|3,0,0]=4 1191 B15R2.283 Cc1nc(cs1)COc2ccncc2 34a_100000212176_100015186478 [0,1,0,0,0,0|3,0,0]=4 1192 B15R2.283 Cc1nc(cs1)CSc2ccccc2 62a_100000719477_100015186478 [0,1,0,0,0,0|2,0,0]=3 1193 B15R2.283 Cc1nc(cs1)CSc2ccccc2 62a_100015186478_100000041952 [0,1,0,0,0,0|2,0,0]=3 1194 B15R2.283 Cc1nc(cs1)CSc2ccccn2 62a_100011216584_100015186478 [0,1,0,0,0,0|3,0,0]=4 1195 B15R2.283 Cc1nc(cs1)CSc2ccccn2 62a_100015186478_100011216584 [0,1,0,0,0,0|3,0,0]=4 1196 B15R2.283 Cc1nc(cs1)CSc2cccnc2 62a_100000210063_100015186478 [0,1,0,0,0,0|3,0,0]=4 1197 B15R2.283 Cc1nc(cs1)CSc2cccnc2 62a_100015186478_100000210063 [0,1,0,0,0,0|3,0,0]=4 1198 B15R2.283 Cc1nc(cs1)CSc2ccncc2 62a_100000728582_100015186478 [0,1,0,0,0,0|3,0,0]=4 1199 B15R2.283 Cc1nc(cs1)CSc2ccncc2 62a_100015186478_100000728582 [0,1,0,0,0,0|3,0,0]=4 1200 B15R2.283 Cc1nc(cs1)SCc2ccccc2 62a_100000211182_100011934587 [0,1,0,0,0,0|3,0,0]=4 1201 B15R2.283 Cc1nc(cs1)SCc2ccccc2 62a_100011934587_100015291786 [0,1,0,0,0,0|3,0,0]=4 1202 B15R2.283 Cc1nc(n[nH]1)C#Cc2ccccc2 271570a_100000069678_100000732540 [0,1,0,0,0,0|2,0,1]=4 1203 B15R2.283 Cc1nc(n[nH]1)C=Cc2ccccc2 271570a_100102527694_100000732540 [0,1,0,0,0,0|2,0,1]=4 1204 B15R2.283 Cc1nc(n[nH]1)CNc2cccnn2 27a_100000752542_100016991348 [0,1,0,0,0,0|3,0,0]=4 1205 B15R2.283 Cc1nc(n[nH]1)CNc2ccncn2 27a_100000752542_100000703185 [0,1,0,0,0,0|3,0,0]=4 1206 B15R2.283 Cc1nc(n[nH]1)CNc2cnccn2 27a_100000752542_100000211759 [0,1,0,0,0,0|3,0,0]=4 1207 B15R2.283 Cc1nc(n[nH]1)CNc2ncccn2 27a_100000752542_100000211032 [0,1,0,0,0,0|3,0,0]=4 1208 B15R2.283 Cc1nc(n[nH]1)SCc2ccccc2 62a_100000211182_100000732540 [0,1,0,0,0,0|3,0,0]=4 1209 B15R2.283 Cc1nc(n[nH]1)SCc2ccccc2 62a_100000732540_100015291786 [0,1,0,0,0,0|3,0,0]=4 1210 B15R2.283 Cc1nc(no1)CCc2ccccc2 270196a_100000212256_100000070787 [0,1,0,0,0,0|3,0,0]=4 1211 B15R2.283 Cc1nc(no1)CNc2ccccc2 34a_100000106764_100000231061 [0,1,0,0,0,0|2,0,0]=3 1212 B15R2.283 Cc1nc(no1)COc2ccccc2 270196a_100000169432_100000070787 [0,1,0,0,0,0|3,0,0]=4 1213 B15R2.283 Cc1nc(no1)COc2ccccc2 34a_100000210340_100000231061 [0,1,0,0,0,0|3,0,0]=4 1214 B15R2.283 Cc1nc(no1)COc2ccccc2 7a_100000210340_100000231061 [0,1,0,0,0,0|3,0,0]=4 1215 B15R2.283 Cc1nc(no1)CSc2ccccc2 270196a_100000150715_100000070787 [0,1,0,0,0,0|3,0,0]=4 1216 B15R2.283 Cc1nc(no1)CSc2ccccc2 62a_100000231061_100000041952 [0,1,0,0,0,0|3,0,0]=4 1217 B15R2.283 Cc1nc(no1)CSc2ccccc2 62a_100000719477_100000231061 [0,1,0,0,0,0|3,0,0]=4 1218 B15R2.283 Cc1ncc(o1)CNc2ccccc2 207a_100000106764_100000084308 [0,1,0,0,0,0|1,0,1]=3 1219 B15R2.283 Cc1ncc(o1)CNc2ccccc2 270302a_100000106764_100000084308 [0,1,0,0,0,0|1,0,1]=3 1220 B15R2.283 Cc1ncc(s1)CNc2ccccc2 207a_100000106764_100000740557 [0,1,0,0,0,0|1,0,1]=3 1221 B15R2.283 Cc1ncc(s1)CNc2ccccc2 34a_100000106764_100020635045 [0,1,0,0,0,0|1,0,1]=3 1222 B15R2.283 Cc1ncc(s1)COc2ccccc2 34a_100000210340_100020635045 [0,1,0,0,0,0|2,0,1]=4 1223 B15R2.283 Cc1ncc(s1)COc2ccccc2 7a_100000210340_100020635045 [0,1,0,0,0,0|2,0,1]=4 1224 B15R2.283 Cc1ncc(s1)CSc2ccccc2 62a_100000719477_100020635045 [0,1,0,0,0,0|2,0,1]=4 1225 B15R2.283 Cc1ncc(s1)CSc2ccccc2 62a_100020635045_100000041952 [0,1,0,0,0,0|2,0,1]=4 1226 B15R2.283 Cc1nnc(s1)CNc2ccccc2 34a_100000106764_100000688753 [0,1,0,0,0,0|2,0,1]=4 1227 B15R2.283 Cc1noc(n1)CCc2ccccc2 270196a_100000212224_100000185753 [0,1,0,0,0,0|2,0,1]=4 1228 B15R2.283 Cc1noc(n1)CNc2ccccc2 34a_100000106764_100000735555 [0,1,0,0,0,0|1,0,1]=3 1229 B15R2.283 Cc1noc(n1)COc2ccccc2 270196a_100000212224_100000186222 [0,1,0,0,0,0|2,0,1]=4 1230 B15R2.283 Cc1noc(n1)COc2ccccc2 34a_100000210340_100000735555 [0,1,0,0,0,0|2,0,1]=4 1231 B15R2.283 Cc1noc(n1)COc2ccccc2 7a_100000210340_100000735555 [0,1,0,0,0,0|2,0,1]=4 1232 B15R2.283 Cc1noc(n1)CSc2ccccc2 270196a_100000212224_100000211596 [0,1,0,0,0,0|2,0,1]=4 1233 B15R2.283 Cc1noc(n1)CSc2ccccc2 62a_100000719477_100000735555 [0,1,0,0,0,0|2,0,1]=4 1234 B15R2.283 Cc1noc(n1)CSc2ccccc2 62a_100000735555_100000041952 [0,1,0,0,0,0|2,0,1]=4 1235 B15R2.283 Clc1cc(cs1)CNc2ccccc2 207a_100000106764_100009844934 [0,1,0,0,0,0|2,0,0]=3 1236 B15R2.283 Clc1cc(cs1)CNc2ccccc2 270302a_100000106764_100009844934 [0,1,0,0,0,0|2,0,0]=3 1237 B15R2.283 Clc1ccc(o1)CNc2ccccc2 207a_100000106764_100000188459 [0,1,0,0,0,0|2,0,0]=3 1238 B15R2.283 Clc1ccc(s1)CNc2ccccc2 207a_100000106764_100000242774 [0,1,0,0,0,0|2,0,0]=3 1239 B15R2.283 Clc1ccc(s1)CNc2ccccc2 270302a_100000106764_100000242774 [0,1,0,0,0,0|2,0,0]=3 1240 B15R2.283 Clc1ccc(s1)CNc2ccccc2 34a_100000106764_100000185097 [0,1,0,0,0,0|2,0,0]=3 1241 B15R2.283 Clc1ccc(s1)COc2ccccc2 34a_100000210340_100000185097 [0,1,0,0,0,0|3,0,0]=4 1242 B15R2.283 Clc1ccc(s1)COc2ccccc2 7a_100000210340_100000185097 [0,1,0,0,0,0|3,0,0]=4 1243 B15R2.283 Clc1ccc(s1)CSc2ccccc2 62a_100000185097_100000041952 [0,1,0,0,0,0|3,0,0]=4 1244 B15R2.283 Clc1ccc(s1)CSc2ccccc2 62a_100000719477_100000185097 [0,1,0,0,0,0|3,0,0]=4 1245 B15R2.283 Clc1cnc(s1)CNc2ccccc2 270302a_100000106764_100000699884 [0,1,0,0,0,0|2,0,0]=3 1246 B15R2.283 Clc1csc(c1)CNc2ccccc2 207a_100000106764_100000102487 [0,1,0,0,0,0|2,0,0]=3 1247 B15R2.283 Clc1csc(c1)CNc2ccccc2 270302a_100000106764_100000102487 [0,1,0,0,0,0|2,0,0]=3 1248 B15R2.283 Clc1nc(cs1)CNc2ccccc2 34a_100000106764_100000024076 [0,1,0,0,0,0|1,0,0]=2 1249 B15R2.283 Clc1nc(cs1)COc2ccccc2 34a_100000210340_100000024076 [0,1,0,0,0,0|2,0,0]=3 1250 B15R2.283 Clc1nc(cs1)COc2ccccc2 7a_100000210340_100000024076 [0,1,0,0,0,0|2,0,0]=3 1251 B15R2.283 Clc1nc(cs1)COc2cccnc2 34a_100000210849_100000024076 [0,1,0,0,0,0|3,0,0]=4 1252 B15R2.283 Clc1nc(cs1)COc2cccnc2 7a_100000210849_100000024076 [0,1,0,0,0,0|3,0,0]=4 1253 B15R2.283 Clc1nc(cs1)COc2ccncc2 34a_100000212176_100000024076 [0,1,0,0,0,0|3,0,0]=4 1254 B15R2.283 Clc1nc(cs1)CSc2ccccc2 62a_100000024076_100000041952 [0,1,0,0,0,0|2,0,0]=3 1255 B15R2.283 Clc1nc(cs1)CSc2ccccc2 62a_100000719477_100000024076 [0,1,0,0,0,0|2,0,0]=3 1256 B15R2.283 Clc1nc(cs1)CSc2ccccn2 62a_100000024076_100011216584 [0,1,0,0,0,0|3,0,0]=4 1257 B15R2.283 Clc1nc(cs1)CSc2ccccn2 62a_100011216584_100000024076 [0,1,0,0,0,0|3,0,0]=4 1258 B15R2.283 Clc1nc(cs1)CSc2cccnc2 62a_100000024076_100000210063 [0,1,0,0,0,0|3,0,0]=4 1259 B15R2.283 Clc1nc(cs1)CSc2cccnc2 62a_100000210063_100000024076 [0,1,0,0,0,0|3,0,0]=4 1260 B15R2.283 Clc1nc(cs1)CSc2ccncc2 62a_100000024076_100000728582 [0,1,0,0,0,0|3,0,0]=4 1261 B15R2.283 Clc1nc(cs1)CSc2ccncc2 62a_100000728582_100000024076 [0,1,0,0,0,0|3,0,0]=4 1262 B15R2.283 Clc1nc(ns1)CNc2ccccc2 34a_100000106764_100000043760 [0,1,0,0,0,0|2,0,0]=3 1263 B15R2.283 Clc1nc(ns1)COc2ccccc2 34a_100000210340_100000043760 [0,1,0,0,0,0|3,0,0]=4 1264 B15R2.283 Clc1nc(ns1)CSc2ccccc2 62a_100000043760_100000041952 [0,1,0,0,0,0|3,0,0]=4 1265 B15R2.283 Clc1nc(ns1)CSc2ccccc2 62a_100000719477_100000043760 [0,1,0,0,0,0|3,0,0]=4 1266 B15R2.283 Clc1ncc(s1)CNc2ccccc2 34a_100000106764_100000058068 [0,1,0,0,0,0|1,0,1]=3 1267 B15R2.283 Clc1ncc(s1)COc2ccccc2 34a_100000210340_100000058068 [0,1,0,0,0,0|2,0,1]=4 1268 B15R2.283 Clc1ncc(s1)COc2ccccc2 7a_100000210340_100000058068 [0,1,0,0,0,0|2,0,1]=4 1269 B15R2.283 Clc1ncc(s1)CSc2ccccc2 62a_100000058068_100000041952 [0,1,0,0,0,0|2,0,1]=4 1270 B15R2.283 Clc1ncc(s1)CSc2ccccc2 62a_100000719477_100000058068 [0,1,0,0,0,0|2,0,1]=4 1271 B15R2.283 Cn1cc(cn1)CNc2ccccc2 207a_100000106764_100000206001 [0,1,0,0,0,0|2,0,0]=3 1272 B15R2.283 Cn1cc(cn1)CNc2ccccc2 270302a_100000106764_100000206001 [0,1,0,0,0,0|2,0,0]=3 1273 B15R2.283 Cn1cc(cn1)CNc2ccccc2 34a_100000106764_100000744441 [0,1,0,0,0,0|2,0,0]=3 1274 B15R2.283 Cn1cc(cn1)COc2ccccc2 34a_100000210340_100000744441 [0,1,0,0,0,0|3,0,0]=4 1275 B15R2.283 Cn1cc(cn1)COc2ccccc2 7a_100000210340_100000744441 [0,1,0,0,0,0|3,0,0]=4 1276 B15R2.283 Cn1cc(cn1)CSc2ccccc2 62a_100000719477_100000744441 [0,1,0,0,0,0|3,0,0]=4 1277 B15R2.283 Cn1cc(cn1)CSc2ccccc2 62a_100000744441_100000041952 [0,1,0,0,0,0|3,0,0]=4 1278 B15R2.283 Cn1cc(nn1)C#Cc2ccccc2 271570a_100000069678_100000760339 [0,1,0,0,0,0|2,0,1]=4 1279 B15R2.283 Cn1cc(nn1)C=Cc2ccccc2 271570a_100102527694_100000760339 [0,1,0,0,0,0|2,0,1]=4 1280 B15R2.283 Cn1cc(nn1)CCc2ccccc2 274090a_200000210301_100000035266 [0,1,0,0,0,0|2,0,0]=3 1281 B15R2.283 Cn1cc(nn1)CNc2ccccc2 207a_100000106764_100000749909 [0,1,0,0,0,0|1,0,0]=2 1282 B15R2.283 Cn1cc(nn1)COc2ccccc2 274090a_200000210301_100000172638 [0,1,0,0,0,0|2,0,0]=3 1283 B15R2.283 Cn1cc(nn1)COc2cccnc2 274090a_200000210301_200012001738 [0,1,0,0,0,0|3,0,0]=4 1284 B15R2.283 Cn1cc(nn1)CSc2ccccc2 274090a_200000210301_200000172648 [0,1,0,0,0,0|2,0,0]=3 1285 B15R2.283 Cn1cc(nn1)SCc2ccccc2 62a_100000211182_100000760339 [0,1,0,0,0,0|3,0,0]=4 1286 B15R2.283 Cn1cc(nn1)SCc2ccccc2 62a_100000760339_100015291786 [0,1,0,0,0,0|3,0,0]=4 1287 B15R2.283 Cn1ccc(n1)CNc2ccccc2 207a_100000106764_100000750880 [0,1,0,0,0,0|2,0,0]=3 1288 B15R2.283 Cn1ccc(n1)CNc2ccccc2 270302a_100000106764_100000750880 [0,1,0,0,0,0|2,0,0]=3 1289 B15R2.283 Cn1ccc(n1)CNc2ccccc2 34a_100000106764_100000726502 [0,1,0,0,0,0|2,0,0]=3 1290 B15R2.283 Cn1ccc(n1)COc2ccccc2 34a_100000210340_100000726502 [0,1,0,0,0,0|3,0,0]=4 1291 B15R2.283 Cn1ccc(n1)COc2ccccc2 7a_100000210340_100000726502 [0,1,0,0,0,0|3,0,0]=4 1292 B15R2.283 Cn1ccc(n1)CSc2ccccc2 62a_100000719477_100000726502 [0,1,0,0,0,0|3,0,0]=4 1293 B15R2.283 Cn1ccc(n1)CSc2ccccc2 62a_100000726502_100000041952 [0,1,0,0,0,0|3,0,0]=4 1294 B15R2.283 Cn1cnc(c1)C#Cc2ccccc2 271570a_100000069678_100000040308 [0,1,0,0,0,0|1,0,1]=3 1295 B15R2.283 Cn1cnc(c1)C=Cc2ccccc2 271570a_100102527694_100000040308 [0,1,0,0,0,0|1,0,1]=3 1296 B15R2.283 Cn1cnc(c1)C=Cc2cccnc2 271570a_100102525586_100000040308 [0,1,0,0,0,0|2,0,1]=4 1297 B15R2.283 Cn1cnc(c1)CNc2ccccc2 207a_100000106764_100000684808 [0,1,0,0,0,0|0,0,0]=1 1298 B15R2.283 Cn1cnc(c1)CNc2ccccc2 34a_100000106764_100000717665 [0,1,0,0,0,0|0,0,0]=1 1299 B15R2.283 Cn1cnc(c1)CNc2cccnn2 27a_100011834058_100016991348 [0,1,0,0,0,0|2,0,0]=3 1300 B15R2.283 Cn1cnc(c1)CNc2ccncn2 27a_100011834058_100000703185 [0,1,0,0,0,0|2,0,0]=3 1301 B15R2.283 Cn1cnc(c1)CNc2cnccn2 27a_100011834058_100000211759 [0,1,0,0,0,0|2,0,0]=3 1302 B15R2.283 Cn1cnc(c1)CNc2ncccn2 27a_100011834058_100000211032 [0,1,0,0,0,0|2,0,0]=3 1303 B15R2.283 Cn1cnc(c1)COc2ccccc2 34a_100000210340_100000717665 [0,1,0,0,0,0|1,0,0]=2 1304 B15R2.283 Cn1cnc(c1)COc2ccccc2 7a_100000210340_100000717665 [0,1,0,0,0,0|1,0,0]=2 1305 B15R2.283 Cn1cnc(c1)COc2cccnc2 34a_100000210849_100000717665 [0,1,0,0,0,0|2,0,0]=3 1306 B15R2.283 Cn1cnc(c1)COc2cccnc2 7a_100000210849_100000717665 [0,1,0,0,0,0|2,0,0]=3 1307 B15R2.283 Cn1cnc(c1)COc2ccncc2 34a_100000212176_100000717665 [0,1,0,0,0,0|2,0,0]=3 1308 B15R2.283 Cn1cnc(c1)COc2ccnnc2 34a_100015204005_100000717665 [0,1,0,0,0,0|3,0,0]=4 1309 B15R2.283 Cn1cnc(c1)COc2cncnc2 7a_100000754086_100000717665 [0,1,0,0,0,0|3,0,0]=4 1310 B15R2.283 Cn1cnc(c1)CSc2ccccc2 62a_100000717665_100000041952 [0,1,0,0,0,0|1,0,0]=2 1311 B15R2.283 Cn1cnc(c1)CSc2ccccc2 62a_100000719477_100000717665 [0,1,0,0,0,0|1,0,0]=2 1312 B15R2.283 Cn1cnc(c1)CSc2ccccn2 62a_100000717665_100011216584 [0,1,0,0,0,0|2,0,0]=3 1313 B15R2.283 Cn1cnc(c1)CSc2ccccn2 62a_100011216584_100000717665 [0,1,0,0,0,0|2,0,0]=3 1314 B15R2.283 Cn1cnc(c1)CSc2cccnc2 62a_100000210063_100000717665 [0,1,0,0,0,0|2,0,0]=3 1315 B15R2.283 Cn1cnc(c1)CSc2cccnc2 62a_100000717665_100000210063 [0,1,0,0,0,0|2,0,0]=3 1316 B15R2.283 Cn1cnc(c1)CSc2cccnn2 62a_100000717665_100016991348 [0,1,0,0,0,0|3,0,0]=4 1317 B15R2.283 Cn1cnc(c1)CSc2cccnn2 62a_100016991348_100000717665 [0,1,0,0,0,0|3,0,0]=4 1318 B15R2.283 Cn1cnc(c1)CSc2ccncc2 62a_100000717665_100000728582 [0,1,0,0,0,0|2,0,0]=3 1319 B15R2.283 Cn1cnc(c1)CSc2ccncc2 62a_100000728582_100000717665 [0,1,0,0,0,0|2,0,0]=3 1320 B15R2.283 Cn1cnc(c1)CSc2ccncn2 62a_100000703185_100000717665 [0,1,0,0,0,0|3,0,0]=4 1321 B15R2.283 Cn1cnc(c1)CSc2ccncn2 62a_100000717665_100000703185 [0,1,0,0,0,0|3,0,0]=4 1322 B15R2.283 Cn1cnc(c1)CSc2ccnnc2 62a_100000717665_100000732662 [0,1,0,0,0,0|3,0,0]=4 1323 B15R2.283 Cn1cnc(c1)CSc2ccnnc2 62a_100000732662_100000717665 [0,1,0,0,0,0|3,0,0]=4 1324 B15R2.283 Cn1cnc(c1)CSc2cnccn2 62a_100000211759_100000717665 [0,1,0,0,0,0|3,0,0]=4 1325 B15R2.283 Cn1cnc(c1)CSc2cnccn2 62a_100000717665_100000211759 [0,1,0,0,0,0|3,0,0]=4 1326 B15R2.283 Cn1cnc(c1)CSc2cncnc2 62a_100000717665_100011206942 [0,1,0,0,0,0|3,0,0]=4 1327 B15R2.283 Cn1cnc(c1)CSc2cncnc2 62a_100011206942_100000717665 [0,1,0,0,0,0|3,0,0]=4 1328 B15R2.283 Cn1cnc(c1)CSc2ncccn2 62a_100000211032_100000717665 [0,1,0,0,0,0|3,0,0]=4 1329 B15R2.283 Cn1cnc(c1)CSc2ncccn2 62a_100000717665_100000211032 [0,1,0,0,0,0|3,0,0]=4 1330 B15R2.283 Cn1cnc(c1)SCc2ccccc2 62a_100000040308_100015291786 [0,1,0,0,0,0|2,0,0]=3 1331 B15R2.283 Cn1cnc(c1)SCc2ccccc2 62a_100000211182_100000040308 [0,1,0,0,0,0|2,0,0]=3 1332 B15R2.283 Cn1cnc(c1)SCc2ccccn2 62a_100000040308_100000721315 [0,1,0,0,0,0|3,0,0]=4 1333 B15R2.283 Cn1cnc(c1)SCc2ccccn2 62a_100000721315_100000040308 [0,1,0,0,0,0|3,0,0]=4 1334 B15R2.283 Cn1cnc(c1)SCc2cccnc2 62a_100000040308_100000741622 [0,1,0,0,0,0|3,0,0]=4 1335 B15R2.283 Cn1cnc(c1)SCc2cccnc2 62a_100000741622_100000040308 [0,1,0,0,0,0|3,0,0]=4 1336 B15R2.283 Cn1cnc(c1)SCc2ccncc2 62a_100000040308_100015193705 [0,1,0,0,0,0|3,0,0]=4 1337 B15R2.283 Cn1cnc(c1)SCc2ccncc2 62a_100015193705_100000040308 [0,1,0,0,0,0|3,0,0]=4 1338 B15R2.283 Cn1cnc(n1)C#Cc2ccccc2 271570a_100000069678_100009819955 [0,1,0,0,0,0|2,0,1]=4 1339 B15R2.283 Cn1cnc(n1)C=Cc2ccccc2 271570a_100102527694_100009819955 [0,1,0,0,0,0|2,0,1]=4 1340 B15R2.283 Cn1cnc(n1)CNc2ccccc2 207a_100000106764_100010630104 [0,1,0,0,0,0|1,0,0]=2 1341 B15R2.283 Cn1cnc(n1)CNc2ccccc2 34a_100000106764_100016995526 [0,1,0,0,0,0|1,0,0]=2 1342 B15R2.283 Cn1cnc(n1)CNc2cccnn2 27a_100000695864_100016991348 [0,1,0,0,0,0|3,0,0]=4 1343 B15R2.283 Cn1cnc(n1)CNc2ccncn2 27a_100000695864_100000703185 [0,1,0,0,0,0|3,0,0]=4 1344 B15R2.283 Cn1cnc(n1)CNc2cnccn2 27a_100000695864_100000211759 [0,1,0,0,0,0|3,0,0]=4 1345 B15R2.283 Cn1cnc(n1)CNc2ncccn2 27a_100000695864_100000211032 [0,1,0,0,0,0|3,0,0]=4 1346 B15R2.283 Cn1cnc(n1)COc2ccccc2 34a_100000210340_100016995526 [0,1,0,0,0,0|2,0,0]=3 1347 B15R2.283 Cn1cnc(n1)COc2ccccc2 7a_100000210340_100016995526 [0,1,0,0,0,0|2,0,0]=3 1348 B15R2.283 Cn1cnc(n1)COc2cccnc2 34a_100000210849_100016995526 [0,1,0,0,0,0|3,0,0]=4 1349 B15R2.283 Cn1cnc(n1)COc2cccnc2 7a_100000210849_100016995526 [0,1,0,0,0,0|3,0,0]=4 1350 B15R2.283 Cn1cnc(n1)COc2ccncc2 34a_100000212176_100016995526 [0,1,0,0,0,0|3,0,0]=4 1351 B15R2.283 Cn1cnc(n1)CSc2ccccc2 62a_100000719477_100016995526 [0,1,0,0,0,0|2,0,0]=3 1352 B15R2.283 Cn1cnc(n1)CSc2ccccc2 62a_100016995526_100000041952 [0,1,0,0,0,0|2,0,0]=3 1353 B15R2.283 Cn1cnc(n1)CSc2ccccn2 62a_100011216584_100016995526 [0,1,0,0,0,0|3,0,0]=4 1354 B15R2.283 Cn1cnc(n1)CSc2ccccn2 62a_100016995526_100011216584 [0,1,0,0,0,0|3,0,0]=4 1355 B15R2.283 Cn1cnc(n1)CSc2cccnc2 62a_100000210063_100016995526 [0,1,0,0,0,0|3,0,0]=4 1356 B15R2.283 Cn1cnc(n1)CSc2cccnc2 62a_100016995526_100000210063 [0,1,0,0,0,0|3,0,0]=4 1357 B15R2.283 Cn1cnc(n1)CSc2ccncc2 62a_100000728582_100016995526 [0,1,0,0,0,0|3,0,0]=4 1358 B15R2.283 Cn1cnc(n1)CSc2ccncc2 62a_100016995526_100000728582 [0,1,0,0,0,0|3,0,0]=4 1359 B15R2.283 Cn1cnc(n1)SCc2ccccc2 62a_100000211182_100009819955 [0,1,0,0,0,0|3,0,0]=4 1360 B15R2.283 Cn1cnc(n1)SCc2ccccc2 62a_100009819955_100015291786 [0,1,0,0,0,0|3,0,0]=4 1361 B15R2.283 Ic1ccc(o1)CNc2ccccc2 207a_100000106764_100000186757 [0,1,0,0,0,0|2,0,0]=3 1362 B15R2.283 Ic1csc(c1)CNc2ccccc2 207a_100000106764_100010179861 [0,1,0,0,0,0|2,0,0]=3 1363 B15R2.283 Ic1csc(c1)CNc2ccccc2 270302a_100000106764_100010179861 [0,1,0,0,0,0|2,0,0]=3 1364 B15R2.283 Nc1nc(cs1)C#Cc2ccccc2 271570a_100000069678_100011998049 [0,1,0,0,0,0|2,0,1]=4 1365 B15R2.283 Nc1nc(cs1)C=Cc2ccccc2 271570a_100102527694_100011998049 [0,1,0,0,0,0|2,0,1]=4 1366 B15R2.283 Nc1nc(cs1)SCc2ccccc2 62a_100000211182_100011998049 [0,1,0,0,0,0|3,0,0]=4 1367 B15R2.283 Nc1nc(cs1)SCc2ccccc2 62a_100011998049_100015291786 [0,1,0,0,0,0|3,0,0]=4 1368 B15R2.283 Nc1nc(n[nH]1)C#Cc2ccccc2 271570a_100000069678_100015184587 [0,1,0,0,0,0|2,0,1]=4 1369 B15R2.283 Nc1nc(n[nH]1)C=Cc2ccccc2 271570a_100102527694_100015184587 [0,1,0,0,0,0|2,0,1]=4 1370 B15R2.283 Nc1nc(n[nH]1)SCc2ccccc2 62a_100000211182_100015184587 [0,1,0,0,0,0|3,0,0]=4 1371 B15R2.283 Nc1nc(n[nH]1)SCc2ccccc2 62a_100015184587_100015291786 [0,1,0,0,0,0|3,0,0]=4 1372 B15R2.283 O=C1C=C(CO1)CNc2ccccc2 34a_100000106764_100000716558 [0,1,0,0,0,0|2,0,1]=4 1373 B15R2.283 O=C1NCC(O1)CNc2ccccc2 34a_100000106764_100000181169 [0,1,0,0,0,0|1,0,2]=4 1374 B15R2.283 O=c1[nH]nc([nH]1)COc2ccccc2 7a_100000210340_100000754189 [0,1,0,0,0,0|2,0,1]=4 1375 B15R2.283 O=c1[nH]nc([nH]1)CSc2ccccc2 62a_100000719477_100000754189 [0,1,0,0,0,0|2,0,1]=4 1376 B15R2.283 Oc1nc(no1)CCc2ccccc2 270196a_100000212256_100015183105 [0,1,0,0,0,0|3,0,0]=4 1377 B15R2.283 Oc1nc(no1)COc2ccccc2 270196a_100000169432_100015183105 [0,1,0,0,0,0|3,0,0]=4 1378 B15R2.283 Oc1nc(no1)CSc2ccccc2 270196a_100000150715_100015183105 [0,1,0,0,0,0|3,0,0]=4 1379 B15R2.283 [13CH3]n1cc(nn1)CCc2ccccc2 274090a_200025704644_100000035266 [0,1,0,0,0,0|2,0,0]=3 1380 B15R2.283 [13CH3]n1cc(nn1)COc2ccccc2 274090a_200025704644_100000172638 [0,1,0,0,0,0|2,0,0]=3 1381 B15R2.283 [13CH3]n1cc(nn1)COc2cccnc2 274090a_200025704644_200012001738 [0,1,0,0,0,0|3,0,0]=4 1382 B15R2.283 [13CH3]n1cc(nn1)CSc2ccccc2 274090a_200025704644_200000172648 [0,1,0,0,0,0|2,0,0]=3 1383 B15R2.562 Brc1ccccc1CSc2c[nH]cn2 62a_100000184730_100000756875 [0,1,0,0,0,0|2,0,0]=3 1384 B15R2.562 Brc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000184730 [0,1,0,0,0,0|2,0,0]=3 1385 B15R2.562 Brc1ccccc1CSc2c[nH]nn2 62a_100000184730_100009819707 [0,1,0,0,0,0|3,0,0]=4 1386 B15R2.562 Brc1ccccc1CSc2c[nH]nn2 62a_100009819707_100000184730 [0,1,0,0,0,0|3,0,0]=4 1387 B15R2.562 Brc1ccccc1CSc2cscn2 62a_100000184730_100000751502 [0,1,0,0,0,0|3,0,0]=4 1388 B15R2.562 Brc1ccccc1CSc2cscn2 62a_100000751502_100000184730 [0,1,0,0,0,0|3,0,0]=4 1389 B15R2.562 Brc1ccccc1CSc2nc[nH]n2 62a_100000184730_100000761765 [0,1,0,0,0,0|3,0,0]=4 1390 B15R2.562 Brc1ccccc1CSc2nc[nH]n2 62a_100000761765_100000184730 [0,1,0,0,0,0|3,0,0]=4 1391 B15R2.562 Brc1ccccc1NCC2=NCCN2 34a_100000210017_100000737910 [0,1,0,0,0,0|2,0,1]=4 1392 B15R2.562 Brc1ccccc1NCc2c[nH]cn2 34a_100000210017_100000707719 [0,1,0,0,0,0|0,0,0]=1 1393 B15R2.562 Brc1ccccc1NCc2cc[nH]n2 207a_100000210017_100000738523 [0,1,0,0,0,0|2,0,0]=3 1394 B15R2.562 Brc1ccccc1NCc2ccco2 207a_100000210017_100000186105 [0,1,0,0,0,0|2,0,0]=3 1395 B15R2.562 Brc1ccccc1NCc2cccs2 207a_100000210017_100000209959 [0,1,0,0,0,0|2,0,0]=3 1396 B15R2.562 Brc1ccccc1NCc2ccn[nH]2 34a_100000210017_100000728653 [0,1,0,0,0,0|2,0,1]=4 1397 B15R2.562 Brc1ccccc1NCc2ccoc2 207a_100000210017_100011215517 [0,1,0,0,0,0|2,0,0]=3 1398 B15R2.562 Brc1ccccc1NCc2ccon2 34a_100000210017_100000234950 [0,1,0,0,0,0|2,0,0]=3 1399 B15R2.562 Brc1ccccc1NCc2ccsc2 207a_100000210017_100000188534 [0,1,0,0,0,0|2,0,0]=3 1400 B15R2.562 Brc1ccccc1NCc2ccsc2 34a_100000210017_100011261437 [0,1,0,0,0,0|2,0,0]=3 1401 B15R2.562 Brc1ccccc1NCc2cn[nH]c2 207a_100000210017_100016992096 [0,1,0,0,0,0|2,0,0]=3 1402 B15R2.562 Brc1ccccc1NCc2cnc[nH]2 207a_100000210017_100000742939 [0,1,0,0,0,0|0,0,2]=3 1403 B15R2.562 Brc1ccccc1NCc2cncs2 207a_100000210017_100000749870 [0,1,0,0,0,0|1,0,1]=3 1404 B15R2.562 Brc1ccccc1NCc2cncs2 34a_100000210017_100015185245 [0,1,0,0,0,0|1,0,1]=3 1405 B15R2.562 Brc1ccccc1NCc2cscn2 207a_100000210017_100000743575 [0,1,0,0,0,0|1,0,0]=2 1406 B15R2.562 Brc1ccccc1NCc2cscn2 34a_100000210017_100000205941 [0,1,0,0,0,0|1,0,0]=2 1407 B15R2.562 Brc1ccccc1NCc2ncc[nH]2 207a_100000210017_100000743867 [0,1,0,0,0,0|2,0,0]=3 1408 B15R2.562 Brc1ccccc1NCc2ncc[nH]2 34a_100000210017_100016991755 [0,1,0,0,0,0|2,0,0]=3 1409 B15R2.562 Brc1ccccc1NCc2ncco2 34a_100000210017_103436540062 [0,1,0,0,0,0|2,0,0]=3 1410 B15R2.562 Brc1ccccc1NCc2nccs2 207a_100000210017_100000750902 [0,1,0,0,0,0|2,0,0]=3 1411 B15R2.562 Brc1ccccc1NCc2nccs2 34a_100000210017_100015184050 [0,1,0,0,0,0|2,0,0]=3 1412 B15R2.562 Brc1ccccc1NCc2ncon2 34a_100000210017_100000233494 [0,1,0,0,0,0|2,0,0]=3 1413 B15R2.562 Brc1ccccc1NCc2nnn[nH]2 34a_100000210017_100000765167 [0,1,0,0,0,0|2,0,1]=4 1414 B15R2.562 Brc1ccccc1NCn2cncn2 34a_100000210017_200020645497 [0,1,0,0,0,0|1,0,1]=3 1415 B15R2.562 Brc1ccccc1OCc2c[nH]cn2 34a_100000181306_100000707719 [0,1,0,0,0,0|1,0,0]=2 1416 B15R2.562 Brc1ccccc1OCc2ccon2 34a_100000181306_100000234950 [0,1,0,0,0,0|3,0,0]=4 1417 B15R2.562 Brc1ccccc1OCc2ccon2 7a_100000181306_100000234950 [0,1,0,0,0,0|3,0,0]=4 1418 B15R2.562 Brc1ccccc1OCc2ccsc2 34a_100000181306_100011261437 [0,1,0,0,0,0|3,0,0]=4 1419 B15R2.562 Brc1ccccc1OCc2ccsc2 7a_100000181306_100011261437 [0,1,0,0,0,0|3,0,0]=4 1420 B15R2.562 Brc1ccccc1OCc2cncs2 34a_100000181306_100015185245 [0,1,0,0,0,0|2,0,1]=4 1421 B15R2.562 Brc1ccccc1OCc2cncs2 7a_100000181306_100015185245 [0,1,0,0,0,0|2,0,1]=4 1422 B15R2.562 Brc1ccccc1OCc2cscn2 34a_100000181306_100000205941 [0,1,0,0,0,0|2,0,0]=3 1423 B15R2.562 Brc1ccccc1OCc2cscn2 7a_100000181306_100000205941 [0,1,0,0,0,0|2,0,0]=3 1424 B15R2.562 Brc1ccccc1OCc2ncc[nH]2 34a_100000181306_100016991755 [0,1,0,0,0,0|3,0,0]=4 1425 B15R2.562 Brc1ccccc1OCc2ncc[nH]2 7a_100000181306_100000753453 [0,1,0,0,0,0|3,0,0]=4 1426 B15R2.562 Brc1ccccc1OCc2ncco2 34a_100000181306_103436540062 [0,1,0,0,0,0|3,0,0]=4 1427 B15R2.562 Brc1ccccc1OCc2ncco2 7a_100000181306_103436540062 [0,1,0,0,0,0|3,0,0]=4 1428 B15R2.562 Brc1ccccc1OCc2nccs2 34a_100000181306_100015184050 [0,1,0,0,0,0|3,0,0]=4 1429 B15R2.562 Brc1ccccc1OCc2nccs2 7a_100000181306_100015184050 [0,1,0,0,0,0|3,0,0]=4 1430 B15R2.562 Brc1ccccc1OCc2ncon2 34a_100000181306_100000233494 [0,1,0,0,0,0|3,0,0]=4 1431 B15R2.562 Brc1ccccc1OCn2cncn2 34a_100000181306_200020645497 [0,1,0,0,0,0|2,0,1]=4 1432 B15R2.562 Brc1ccccc1OCn2cncn2 7a_100000181306_200020645497 [0,1,0,0,0,0|2,0,1]=4 1433 B15R2.562 Brc1ccccc1SCc2c[nH]cn2 62a_100000695589_100000707719 [0,1,0,0,0,0|1,0,0]=2 1434 B15R2.562 Brc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000695589 [0,1,0,0,0,0|1,0,0]=2 1435 B15R2.562 Brc1ccccc1SCc2ccon2 62a_100000234950_100000695589 [0,1,0,0,0,0|3,0,0]=4 1436 B15R2.562 Brc1ccccc1SCc2ccon2 62a_100000695589_100000234950 [0,1,0,0,0,0|3,0,0]=4 1437 B15R2.562 Brc1ccccc1SCc2ccsc2 62a_100000695589_100011233845 [0,1,0,0,0,0|3,0,0]=4 1438 B15R2.562 Brc1ccccc1SCc2ccsc2 62a_100011261437_100000695589 [0,1,0,0,0,0|3,0,0]=4 1439 B15R2.562 Brc1ccccc1SCc2cncs2 62a_100000695589_100015185245 [0,1,0,0,0,0|2,0,1]=4 1440 B15R2.562 Brc1ccccc1SCc2cncs2 62a_100015185245_100000695589 [0,1,0,0,0,0|2,0,1]=4 1441 B15R2.562 Brc1ccccc1SCc2cscn2 62a_100000205941_100000695589 [0,1,0,0,0,0|2,0,0]=3 1442 B15R2.562 Brc1ccccc1SCc2cscn2 62a_100000695589_100000205941 [0,1,0,0,0,0|2,0,0]=3 1443 B15R2.562 Brc1ccccc1SCc2ncc[nH]2 62a_100000695589_100016991755 [0,1,0,0,0,0|3,0,0]=4 1444 B15R2.562 Brc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000695589 [0,1,0,0,0,0|3,0,0]=4 1445 B15R2.562 Brc1ccccc1SCc2ncco2 62a_100000695589_103436540062 [0,1,0,0,0,0|3,0,0]=4 1446 B15R2.562 Brc1ccccc1SCc2ncco2 62a_103436540062_100000695589 [0,1,0,0,0,0|3,0,0]=4 1447 B15R2.562 Brc1ccccc1SCc2nccs2 62a_100000695589_100015184050 [0,1,0,0,0,0|3,0,0]=4 1448 B15R2.562 Brc1ccccc1SCc2nccs2 62a_100015184050_100000695589 [0,1,0,0,0,0|3,0,0]=4 1449 B15R2.562 Brc1ccccc1SCc2ncon2 62a_100000233494_100000695589 [0,1,0,0,0,0|3,0,0]=4 1450 B15R2.562 Brc1ccccc1SCc2ncon2 62a_100000695589_100000233494 [0,1,0,0,0,0|3,0,0]=4 1451 B15R2.562 Brc1ccccc1SCn2cncn2 62a_100000695589_200020645497 [0,1,0,0,0,0|2,0,1]=4 1452 B15R2.562 Brc1ccccc1SCn2cncn2 62a_200020645497_100000695589 [0,1,0,0,0,0|2,0,1]=4 1453 B15R2.562 Brc1cccnc1CSc2c[nH]cn2 62a_100000756875_100025702911 [0,1,0,0,0,0|3,0,0]=4 1454 B15R2.562 Brc1cccnc1CSc2c[nH]cn2 62a_100025702911_100000756875 [0,1,0,0,0,0|3,0,0]=4 1455 B15R2.562 Brc1cccnc1NCc2c[nH]cn2 27a_100000758547_100000696092 [0,1,0,0,0,0|1,0,0]=2 1456 B15R2.562 Brc1cccnc1NCc2c[nH]nn2 27a_100020620823_100000696092 [0,1,0,0,0,0|2,0,0]=3 1457 B15R2.562 Brc1cccnc1NCc2cc[nH]n2 27a_100000739516_100000696092 [0,1,0,0,0,0|3,0,0]=4 1458 B15R2.562 Brc1cccnc1NCc2ccco2 27a_100000185738_100000696092 [0,1,0,0,0,0|3,0,0]=4 1459 B15R2.562 Brc1cccnc1NCc2cccs2 27a_100000211653_100000696092 [0,1,0,0,0,0|3,0,0]=4 1460 B15R2.562 Brc1cccnc1NCc2ccoc2 27a_100015206860_100000696092 [0,1,0,0,0,0|3,0,0]=4 1461 B15R2.562 Brc1cccnc1NCc2ccon2 27a_100000688301_100000696092 [0,1,0,0,0,0|3,0,0]=4 1462 B15R2.562 Brc1cccnc1NCc2ccsc2 27a_100000186416_100000696092 [0,1,0,0,0,0|3,0,0]=4 1463 B15R2.562 Brc1cccnc1NCc2cn[nH]c2 27a_100000737208_100000696092 [0,1,0,0,0,0|3,0,0]=4 1464 B15R2.562 Brc1cccnc1NCc2cnco2 27a_100020634212_100000696092 [0,1,0,0,0,0|2,0,1]=4 1465 B15R2.562 Brc1cccnc1NCc2cncs2 27a_100016987365_100000696092 [0,1,0,0,0,0|2,0,1]=4 1466 B15R2.562 Brc1cccnc1NCc2cocn2 27a_100015188801_100000696092 [0,1,0,0,0,0|2,0,0]=3 1467 B15R2.562 Brc1cccnc1NCc2cscn2 27a_100015185402_100000696092 [0,1,0,0,0,0|2,0,0]=3 1468 B15R2.562 Brc1cccnc1NCc2ncc[nH]2 27a_100000754540_100000696092 [0,1,0,0,0,0|3,0,0]=4 1469 B15R2.562 Brc1cccnc1NCc2ncco2 27a_100016994969_100000696092 [0,1,0,0,0,0|3,0,0]=4 1470 B15R2.562 Brc1cccnc1NCc2nccs2 27a_100000740555_100000696092 [0,1,0,0,0,0|3,0,0]=4 1471 B15R2.562 Brc1cccnc1SCc2c[nH]cn2 62a_100000696092_100000707719 [0,1,0,0,0,0|2,0,0]=3 1472 B15R2.562 Brc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000696092 [0,1,0,0,0,0|2,0,0]=3 1473 B15R2.562 Brc1cccnc1SCc2cscn2 62a_100000205941_100000696092 [0,1,0,0,0,0|3,0,0]=4 1474 B15R2.562 Brc1cccnc1SCc2cscn2 62a_100000696092_100000205941 [0,1,0,0,0,0|3,0,0]=4 1475 B15R2.562 Brc1ccncc1SCc2c[nH]cn2 62a_100000707719_100010138639 [0,1,0,0,0,0|2,0,0]=3 1476 B15R2.562 Brc1ccncc1SCc2c[nH]cn2 62a_100010138639_100000707719 [0,1,0,0,0,0|2,0,0]=3 1477 B15R2.562 Brc1ccncc1SCc2cscn2 62a_100000205941_100010138639 [0,1,0,0,0,0|3,0,0]=4 1478 B15R2.562 Brc1ccncc1SCc2cscn2 62a_100010138639_100000205941 [0,1,0,0,0,0|3,0,0]=4 1479 B15R2.562 Brc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000726257 [0,1,0,0,0,0|1,0,0]=2 1480 B15R2.562 Brc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000726257 [0,1,0,0,0,0|2,0,0]=3 1481 B15R2.562 Brc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000726257 [0,1,0,0,0,0|3,0,0]=4 1482 B15R2.562 Brc1cnccc1NCc2ccco2 27a_100000185738_100000726257 [0,1,0,0,0,0|3,0,0]=4 1483 B15R2.562 Brc1cnccc1NCc2cccs2 27a_100000211653_100000726257 [0,1,0,0,0,0|3,0,0]=4 1484 B15R2.562 Brc1cnccc1NCc2ccoc2 27a_100015206860_100000726257 [0,1,0,0,0,0|3,0,0]=4 1485 B15R2.562 Brc1cnccc1NCc2ccon2 27a_100000688301_100000726257 [0,1,0,0,0,0|3,0,0]=4 1486 B15R2.562 Brc1cnccc1NCc2ccsc2 27a_100000186416_100000726257 [0,1,0,0,0,0|3,0,0]=4 1487 B15R2.562 Brc1cnccc1NCc2cn[nH]c2 27a_100000737208_100000726257 [0,1,0,0,0,0|3,0,0]=4 1488 B15R2.562 Brc1cnccc1NCc2cnco2 27a_100020634212_100000726257 [0,1,0,0,0,0|2,0,1]=4 1489 B15R2.562 Brc1cnccc1NCc2cncs2 27a_100016987365_100000726257 [0,1,0,0,0,0|2,0,1]=4 1490 B15R2.562 Brc1cnccc1NCc2cocn2 27a_100015188801_100000726257 [0,1,0,0,0,0|2,0,0]=3 1491 B15R2.562 Brc1cnccc1NCc2cscn2 27a_100015185402_100000726257 [0,1,0,0,0,0|2,0,0]=3 1492 B15R2.562 Brc1cnccc1NCc2ncc[nH]2 27a_100000754540_100000726257 [0,1,0,0,0,0|3,0,0]=4 1493 B15R2.562 Brc1cnccc1NCc2ncco2 27a_100016994969_100000726257 [0,1,0,0,0,0|3,0,0]=4 1494 B15R2.562 Brc1cnccc1NCc2nccs2 27a_100000740555_100000726257 [0,1,0,0,0,0|3,0,0]=4 1495 B15R2.562 Brc1cnccc1OCc2c[nH]cn2 34a_100011996408_100000707719 [0,1,0,0,0,0|2,0,0]=3 1496 B15R2.562 Brc1cnccc1OCc2cscn2 34a_100011996408_100000205941 [0,1,0,0,0,0|3,0,0]=4 1497 B15R2.562 Brc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000726257 [0,1,0,0,0,0|2,0,0]=3 1498 B15R2.562 Brc1cnccc1SCc2c[nH]cn2 62a_100000726257_100000707719 [0,1,0,0,0,0|2,0,0]=3 1499 B15R2.562 Brc1cnccc1SCc2cscn2 62a_100000205941_100000726257 [0,1,0,0,0,0|3,0,0]=4 1500 B15R2.562 Brc1cnccc1SCc2cscn2 62a_100000726257_100000205941 [0,1,0,0,0,0|3,0,0]=4 1501 B15R2.562 Brc1ncccc1CSc2c[nH]cn2 62a_100000756875_100010140945 [0,1,0,0,0,0|3,0,0]=4 1502 B15R2.562 Brc1ncccc1CSc2c[nH]cn2 62a_100010140945_100000756875 [0,1,0,0,0,0|3,0,0]=4 1503 B15R2.562 Brc1ncccc1OCc2c[nH]cn2 34a_100000744436_100000707719 [0,1,0,0,0,0|2,0,0]=3 1504 B15R2.562 Brc1ncccc1OCc2cscn2 34a_100000744436_100000205941 [0,1,0,0,0,0|3,0,0]=4 1505 B15R2.562 Brc1ncccc1OCc2cscn2 7a_100000744436_100000205941 [0,1,0,0,0,0|3,0,0]=4 1506 B15R2.562 Brc1ncccc1SCc2c[nH]cn2 62a_100000707719_100010202626 [0,1,0,0,0,0|2,0,0]=3 1507 B15R2.562 Brc1ncccc1SCc2c[nH]cn2 62a_100010202626_100000707719 [0,1,0,0,0,0|2,0,0]=3 1508 B15R2.562 Brc1ncccc1SCc2cscn2 62a_100000205941_100010202626 [0,1,0,0,0,0|3,0,0]=4 1509 B15R2.562 Brc1ncccc1SCc2cscn2 62a_100010202626_100000205941 [0,1,0,0,0,0|3,0,0]=4 1510 B15R2.562 Brc1ncncc1SCc2c[nH]cn2 62a_100000707719_200012461658 [0,1,0,0,0,0|3,0,0]=4 1511 B15R2.562 Brc1ncncc1SCc2c[nH]cn2 62a_200012461658_100000707719 [0,1,0,0,0,0|3,0,0]=4 1512 B15R2.562 C[n+]1ccccc1SCc2c[nH]cn2 62a_100000707719_100000212160 [0,1,0,0,0,0|2,0,0]=3 1513 B15R2.562 C[n+]1ccccc1SCc2cscn2 62a_100000205941_100000212160 [0,1,0,0,0,0|3,0,0]=4 1514 B15R2.562 Cc1ccccc1CSc2c[nH]cn2 62a_100000211839_100000756875 [0,1,0,0,0,0|2,0,0]=3 1515 B15R2.562 Cc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000211839 [0,1,0,0,0,0|2,0,0]=3 1516 B15R2.562 Cc1ccccc1CSc2c[nH]nn2 62a_100000211839_100009819707 [0,1,0,0,0,0|3,0,0]=4 1517 B15R2.562 Cc1ccccc1CSc2c[nH]nn2 62a_100009819707_100000211839 [0,1,0,0,0,0|3,0,0]=4 1518 B15R2.562 Cc1ccccc1CSc2cscn2 62a_100000211839_100000751502 [0,1,0,0,0,0|3,0,0]=4 1519 B15R2.562 Cc1ccccc1CSc2cscn2 62a_100000751502_100000211839 [0,1,0,0,0,0|3,0,0]=4 1520 B15R2.562 Cc1ccccc1CSc2nc[nH]n2 62a_100000211839_100000761765 [0,1,0,0,0,0|3,0,0]=4 1521 B15R2.562 Cc1ccccc1CSc2nc[nH]n2 62a_100000761765_100000211839 [0,1,0,0,0,0|3,0,0]=4 1522 B15R2.562 Cc1ccccc1NCC2=NCCN2 34a_100015192222_100000737910 [0,1,0,0,0,0|2,0,1]=4 1523 B15R2.562 Cc1ccccc1NCc2c[nH]cn2 34a_100015192222_100000707719 [0,1,0,0,0,0|0,0,0]=1 1524 B15R2.562 Cc1ccccc1NCc2cc[nH]n2 207a_100015192222_100000738523 [0,1,0,0,0,0|2,0,0]=3 1525 B15R2.562 Cc1ccccc1NCc2ccco2 207a_100015192222_100000186105 [0,1,0,0,0,0|2,0,0]=3 1526 B15R2.562 Cc1ccccc1NCc2ccco2 270302a_100015192222_100000186105 [0,1,0,0,0,0|2,0,0]=3 1527 B15R2.562 Cc1ccccc1NCc2cccs2 207a_100015192222_100000209959 [0,1,0,0,0,0|2,0,0]=3 1528 B15R2.562 Cc1ccccc1NCc2cccs2 270302a_100015192222_100000209959 [0,1,0,0,0,0|2,0,0]=3 1529 B15R2.562 Cc1ccccc1NCc2ccn[nH]2 34a_100015192222_100000728653 [0,1,0,0,0,0|2,0,1]=4 1530 B15R2.562 Cc1ccccc1NCc2ccoc2 207a_100015192222_100011215517 [0,1,0,0,0,0|2,0,0]=3 1531 B15R2.562 Cc1ccccc1NCc2ccon2 34a_100015192222_100000234950 [0,1,0,0,0,0|2,0,0]=3 1532 B15R2.562 Cc1ccccc1NCc2ccsc2 207a_100015192222_100000188534 [0,1,0,0,0,0|2,0,0]=3 1533 B15R2.562 Cc1ccccc1NCc2ccsc2 270302a_100015192222_100000188534 [0,1,0,0,0,0|2,0,0]=3 1534 B15R2.562 Cc1ccccc1NCc2ccsc2 34a_100015192222_100011261437 [0,1,0,0,0,0|2,0,0]=3 1535 B15R2.562 Cc1ccccc1NCc2cn[nH]c2 207a_100015192222_100016992096 [0,1,0,0,0,0|2,0,0]=3 1536 B15R2.562 Cc1ccccc1NCc2cn[nH]c2 270302a_100015192222_100016992096 [0,1,0,0,0,0|2,0,0]=3 1537 B15R2.562 Cc1ccccc1NCc2cnc[nH]2 207a_100015192222_100000742939 [0,1,0,0,0,0|0,0,2]=3 1538 B15R2.562 Cc1ccccc1NCc2cncs2 207a_100015192222_100000749870 [0,1,0,0,0,0|1,0,1]=3 1539 B15R2.562 Cc1ccccc1NCc2cncs2 270302a_100015192222_100000749870 [0,1,0,0,0,0|1,0,1]=3 1540 B15R2.562 Cc1ccccc1NCc2cncs2 34a_100015192222_100015185245 [0,1,0,0,0,0|1,0,1]=3 1541 B15R2.562 Cc1ccccc1NCc2cscn2 207a_100015192222_100000743575 [0,1,0,0,0,0|1,0,0]=2 1542 B15R2.562 Cc1ccccc1NCc2cscn2 270302a_100015192222_100000743575 [0,1,0,0,0,0|1,0,0]=2 1543 B15R2.562 Cc1ccccc1NCc2cscn2 34a_100015192222_100000205941 [0,1,0,0,0,0|1,0,0]=2 1544 B15R2.562 Cc1ccccc1NCc2ncc[nH]2 207a_100015192222_100000743867 [0,1,0,0,0,0|2,0,0]=3 1545 B15R2.562 Cc1ccccc1NCc2ncc[nH]2 34a_100015192222_100016991755 [0,1,0,0,0,0|2,0,0]=3 1546 B15R2.562 Cc1ccccc1NCc2ncco2 34a_100015192222_103436540062 [0,1,0,0,0,0|2,0,0]=3 1547 B15R2.562 Cc1ccccc1NCc2nccs2 207a_100015192222_100000750902 [0,1,0,0,0,0|2,0,0]=3 1548 B15R2.562 Cc1ccccc1NCc2nccs2 270302a_100015192222_100000750902 [0,1,0,0,0,0|2,0,0]=3 1549 B15R2.562 Cc1ccccc1NCc2nccs2 34a_100015192222_100015184050 [0,1,0,0,0,0|2,0,0]=3 1550 B15R2.562 Cc1ccccc1NCc2ncon2 34a_100015192222_100000233494 [0,1,0,0,0,0|2,0,0]=3 1551 B15R2.562 Cc1ccccc1NCc2nnn[nH]2 34a_100015192222_100000765167 [0,1,0,0,0,0|2,0,1]=4 1552 B15R2.562 Cc1ccccc1NCn2cncn2 34a_100015192222_200020645497 [0,1,0,0,0,0|1,0,1]=3 1553 B15R2.562 Cc1ccccc1OCc2c[nH]cn2 34a_100000210338_100000707719 [0,1,0,0,0,0|1,0,0]=2 1554 B15R2.562 Cc1ccccc1OCc2ccon2 34a_100000210338_100000234950 [0,1,0,0,0,0|3,0,0]=4 1555 B15R2.562 Cc1ccccc1OCc2ccon2 7a_100000210338_100000234950 [0,1,0,0,0,0|3,0,0]=4 1556 B15R2.562 Cc1ccccc1OCc2ccsc2 34a_100000210338_100011261437 [0,1,0,0,0,0|3,0,0]=4 1557 B15R2.562 Cc1ccccc1OCc2ccsc2 7a_100000210338_100011261437 [0,1,0,0,0,0|3,0,0]=4 1558 B15R2.562 Cc1ccccc1OCc2cncs2 34a_100000210338_100015185245 [0,1,0,0,0,0|2,0,1]=4 1559 B15R2.562 Cc1ccccc1OCc2cncs2 7a_100000210338_100015185245 [0,1,0,0,0,0|2,0,1]=4 1560 B15R2.562 Cc1ccccc1OCc2cscn2 34a_100000210338_100000205941 [0,1,0,0,0,0|2,0,0]=3 1561 B15R2.562 Cc1ccccc1OCc2cscn2 7a_100000210338_100000205941 [0,1,0,0,0,0|2,0,0]=3 1562 B15R2.562 Cc1ccccc1OCc2ncc[nH]2 34a_100000210338_100016991755 [0,1,0,0,0,0|3,0,0]=4 1563 B15R2.562 Cc1ccccc1OCc2ncc[nH]2 7a_100000210338_100000753453 [0,1,0,0,0,0|3,0,0]=4 1564 B15R2.562 Cc1ccccc1OCc2ncco2 34a_100000210338_103436540062 [0,1,0,0,0,0|3,0,0]=4 1565 B15R2.562 Cc1ccccc1OCc2ncco2 7a_100000210338_103436540062 [0,1,0,0,0,0|3,0,0]=4 1566 B15R2.562 Cc1ccccc1OCc2nccs2 34a_100000210338_100015184050 [0,1,0,0,0,0|3,0,0]=4 1567 B15R2.562 Cc1ccccc1OCc2nccs2 7a_100000210338_100015184050 [0,1,0,0,0,0|3,0,0]=4 1568 B15R2.562 Cc1ccccc1OCc2ncon2 34a_100000210338_100000233494 [0,1,0,0,0,0|3,0,0]=4 1569 B15R2.562 Cc1ccccc1OCn2cncn2 34a_100000210338_200020645497 [0,1,0,0,0,0|2,0,1]=4 1570 B15R2.562 Cc1ccccc1OCn2cncn2 7a_100000210338_200020645497 [0,1,0,0,0,0|2,0,1]=4 1571 B15R2.562 Cc1ccccc1SCc2c[nH]cn2 62a_100000210755_100000707719 [0,1,0,0,0,0|1,0,0]=2 1572 B15R2.562 Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210755 [0,1,0,0,0,0|1,0,0]=2 1573 B15R2.562 Cc1ccccc1SCc2ccon2 62a_100000210755_100000234950 [0,1,0,0,0,0|3,0,0]=4 1574 B15R2.562 Cc1ccccc1SCc2ccon2 62a_100000234950_100000210755 [0,1,0,0,0,0|3,0,0]=4 1575 B15R2.562 Cc1ccccc1SCc2ccsc2 62a_100000210755_100011233845 [0,1,0,0,0,0|3,0,0]=4 1576 B15R2.562 Cc1ccccc1SCc2ccsc2 62a_100011261437_100000210755 [0,1,0,0,0,0|3,0,0]=4 1577 B15R2.562 Cc1ccccc1SCc2cncs2 62a_100000210755_100015185245 [0,1,0,0,0,0|2,0,1]=4 1578 B15R2.562 Cc1ccccc1SCc2cncs2 62a_100015185245_100000210755 [0,1,0,0,0,0|2,0,1]=4 1579 B15R2.562 Cc1ccccc1SCc2cscn2 62a_100000205941_100000210755 [0,1,0,0,0,0|2,0,0]=3 1580 B15R2.562 Cc1ccccc1SCc2cscn2 62a_100000210755_100000205941 [0,1,0,0,0,0|2,0,0]=3 1581 B15R2.562 Cc1ccccc1SCc2ncc[nH]2 62a_100000210755_100016991755 [0,1,0,0,0,0|3,0,0]=4 1582 B15R2.562 Cc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000210755 [0,1,0,0,0,0|3,0,0]=4 1583 B15R2.562 Cc1ccccc1SCc2ncco2 62a_100000210755_103436540062 [0,1,0,0,0,0|3,0,0]=4 1584 B15R2.562 Cc1ccccc1SCc2ncco2 62a_103436540062_100000210755 [0,1,0,0,0,0|3,0,0]=4 1585 B15R2.562 Cc1ccccc1SCc2nccs2 62a_100000210755_100015184050 [0,1,0,0,0,0|3,0,0]=4 1586 B15R2.562 Cc1ccccc1SCc2nccs2 62a_100015184050_100000210755 [0,1,0,0,0,0|3,0,0]=4 1587 B15R2.562 Cc1ccccc1SCc2ncon2 62a_100000210755_100000233494 [0,1,0,0,0,0|3,0,0]=4 1588 B15R2.562 Cc1ccccc1SCc2ncon2 62a_100000233494_100000210755 [0,1,0,0,0,0|3,0,0]=4 1589 B15R2.562 Cc1ccccc1SCn2cncn2 62a_100000210755_200020645497 [0,1,0,0,0,0|2,0,1]=4 1590 B15R2.562 Cc1ccccc1SCn2cncn2 62a_200020645497_100000210755 [0,1,0,0,0,0|2,0,1]=4 1591 B15R2.562 Cc1cccnc1CSc2c[nH]cn2 62a_100000696600_100000756875 [0,1,0,0,0,0|3,0,0]=4 1592 B15R2.562 Cc1cccnc1CSc2c[nH]cn2 62a_100000756875_100000696600 [0,1,0,0,0,0|3,0,0]=4 1593 B15R2.562 Cc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000751373 [0,1,0,0,0,0|2,0,0]=3 1594 B15R2.562 Cc1cccnc1SCc2c[nH]cn2 62a_100000751373_100000707719 [0,1,0,0,0,0|2,0,0]=3 1595 B15R2.562 Cc1cccnc1SCc2cscn2 62a_100000205941_100000751373 [0,1,0,0,0,0|3,0,0]=4 1596 B15R2.562 Cc1cccnc1SCc2cscn2 62a_100000751373_100000205941 [0,1,0,0,0,0|3,0,0]=4 1597 B15R2.562 Cc1ccncc1CSc2c[nH]cn2 62a_100000690890_100000756875 [0,1,0,0,0,0|3,0,0]=4 1598 B15R2.562 Cc1ccncc1CSc2c[nH]cn2 62a_100000756875_100000690890 [0,1,0,0,0,0|3,0,0]=4 1599 B15R2.562 Cc1ccncc1OCc2c[nH]cn2 34a_100011997053_100000707719 [0,1,0,0,0,0|2,0,0]=3 1600 B15R2.562 Cc1ccncc1OCc2cscn2 34a_100011997053_100000205941 [0,1,0,0,0,0|3,0,0]=4 1601 B15R2.562 Cc1ccncc1OCc2cscn2 7a_100011997053_100000205941 [0,1,0,0,0,0|3,0,0]=4 1602 B15R2.562 Cc1ccncc1SCc2c[nH]cn2 62a_100000707719_100000761580 [0,1,0,0,0,0|2,0,0]=3 1603 B15R2.562 Cc1ccncc1SCc2c[nH]cn2 62a_100000761580_100000707719 [0,1,0,0,0,0|2,0,0]=3 1604 B15R2.562 Cc1ccncc1SCc2cscn2 62a_100000205941_100000761580 [0,1,0,0,0,0|3,0,0]=4 1605 B15R2.562 Cc1ccncc1SCc2cscn2 62a_100000761580_100000205941 [0,1,0,0,0,0|3,0,0]=4 1606 B15R2.562 Cc1ccnnc1NCc2c[nH]cn2 27a_100000758547_100000089043 [0,1,0,0,0,0|2,0,0]=3 1607 B15R2.562 Cc1ccnnc1NCc2c[nH]nn2 27a_100020620823_100000089043 [0,1,0,0,0,0|3,0,0]=4 1608 B15R2.562 Cc1ccnnc1NCc2cocn2 27a_100015188801_100000089043 [0,1,0,0,0,0|3,0,0]=4 1609 B15R2.562 Cc1ccnnc1NCc2cscn2 27a_100015185402_100000089043 [0,1,0,0,0,0|3,0,0]=4 1610 B15R2.562 Cc1ccnnc1SCc2c[nH]cn2 62a_100000707719_100000089043 [0,1,0,0,0,0|3,0,0]=4 1611 B15R2.562 Cc1cnccc1CSc2c[nH]cn2 62a_100000756875_100020672808 [0,1,0,0,0,0|3,0,0]=4 1612 B15R2.562 Cc1cnccc1CSc2c[nH]cn2 62a_100020672808_100000756875 [0,1,0,0,0,0|3,0,0]=4 1613 B15R2.562 Cc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000765111 [0,1,0,0,0,0|1,0,0]=2 1614 B15R2.562 Cc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000765111 [0,1,0,0,0,0|2,0,0]=3 1615 B15R2.562 Cc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000765111 [0,1,0,0,0,0|3,0,0]=4 1616 B15R2.562 Cc1cnccc1NCc2ccco2 27a_100000185738_100000765111 [0,1,0,0,0,0|3,0,0]=4 1617 B15R2.562 Cc1cnccc1NCc2cccs2 27a_100000211653_100000765111 [0,1,0,0,0,0|3,0,0]=4 1618 B15R2.562 Cc1cnccc1NCc2ccoc2 27a_100015206860_100000765111 [0,1,0,0,0,0|3,0,0]=4 1619 B15R2.562 Cc1cnccc1NCc2ccon2 27a_100000688301_100000765111 [0,1,0,0,0,0|3,0,0]=4 1620 B15R2.562 Cc1cnccc1NCc2ccsc2 27a_100000186416_100000765111 [0,1,0,0,0,0|3,0,0]=4 1621 B15R2.562 Cc1cnccc1NCc2cn[nH]c2 27a_100000737208_100000765111 [0,1,0,0,0,0|3,0,0]=4 1622 B15R2.562 Cc1cnccc1NCc2cnco2 27a_100020634212_100000765111 [0,1,0,0,0,0|2,0,1]=4 1623 B15R2.562 Cc1cnccc1NCc2cncs2 27a_100016987365_100000765111 [0,1,0,0,0,0|2,0,1]=4 1624 B15R2.562 Cc1cnccc1NCc2cocn2 27a_100015188801_100000765111 [0,1,0,0,0,0|2,0,0]=3 1625 B15R2.562 Cc1cnccc1NCc2cscn2 27a_100015185402_100000765111 [0,1,0,0,0,0|2,0,0]=3 1626 B15R2.562 Cc1cnccc1NCc2ncc[nH]2 27a_100000754540_100000765111 [0,1,0,0,0,0|3,0,0]=4 1627 B15R2.562 Cc1cnccc1NCc2ncco2 27a_100016994969_100000765111 [0,1,0,0,0,0|3,0,0]=4 1628 B15R2.562 Cc1cnccc1NCc2nccs2 27a_100000740555_100000765111 [0,1,0,0,0,0|3,0,0]=4 1629 B15R2.562 Cc1cnccc1OCc2c[nH]cn2 34a_100000694293_100000707719 [0,1,0,0,0,0|2,0,0]=3 1630 B15R2.562 Cc1cnccc1OCc2cscn2 34a_100000694293_100000205941 [0,1,0,0,0,0|3,0,0]=4 1631 B15R2.562 Cc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000765111 [0,1,0,0,0,0|2,0,0]=3 1632 B15R2.562 Cc1cnccc1SCc2c[nH]cn2 62a_100000765111_100000707719 [0,1,0,0,0,0|2,0,0]=3 1633 B15R2.562 Cc1cnccc1SCc2cscn2 62a_100000205941_100000765111 [0,1,0,0,0,0|3,0,0]=4 1634 B15R2.562 Cc1cnccc1SCc2cscn2 62a_100000765111_100000205941 [0,1,0,0,0,0|3,0,0]=4 1635 B15R2.562 Cc1cncnc1NCc2c[nH]cn2 27a_100000758547_100011998708 [0,1,0,0,0,0|2,0,0]=3 1636 B15R2.562 Cc1cncnc1NCc2c[nH]nn2 27a_100020620823_100011998708 [0,1,0,0,0,0|3,0,0]=4 1637 B15R2.562 Cc1cncnc1NCc2cocn2 27a_100015188801_100011998708 [0,1,0,0,0,0|3,0,0]=4 1638 B15R2.562 Cc1cncnc1NCc2cscn2 27a_100015185402_100011998708 [0,1,0,0,0,0|3,0,0]=4 1639 B15R2.562 Cc1cncnc1SCc2c[nH]cn2 62a_100000707719_100011998708 [0,1,0,0,0,0|3,0,0]=4 1640 B15R2.562 Cc1cncnc1SCc2c[nH]cn2 62a_100011998708_100000707719 [0,1,0,0,0,0|3,0,0]=4 1641 B15R2.562 Cc1ncccc1CSc2c[nH]cn2 62a_100000732876_100000756875 [0,1,0,0,0,0|3,0,0]=4 1642 B15R2.562 Cc1ncccc1CSc2c[nH]cn2 62a_100000756875_100000732876 [0,1,0,0,0,0|3,0,0]=4 1643 B15R2.562 Cc1ncccc1OCc2c[nH]cn2 34a_100000745507_100000707719 [0,1,0,0,0,0|2,0,0]=3 1644 B15R2.562 Cc1ncccc1OCc2cscn2 34a_100000745507_100000205941 [0,1,0,0,0,0|3,0,0]=4 1645 B15R2.562 Cc1ncccc1OCc2cscn2 7a_100000745507_100000205941 [0,1,0,0,0,0|3,0,0]=4 1646 B15R2.562 Cc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000751574 [0,1,0,0,0,0|2,0,0]=3 1647 B15R2.562 Cc1ncccc1SCc2c[nH]cn2 62a_100000751574_100000707719 [0,1,0,0,0,0|2,0,0]=3 1648 B15R2.562 Cc1ncccc1SCc2cscn2 62a_100000205941_100000751574 [0,1,0,0,0,0|3,0,0]=4 1649 B15R2.562 Cc1ncccc1SCc2cscn2 62a_100000751574_100000205941 [0,1,0,0,0,0|3,0,0]=4 1650 B15R2.562 Cc1nccnc1NCc2c[nH]cn2 27a_100000758547_100011999405 [0,1,0,0,0,0|2,0,0]=3 1651 B15R2.562 Cc1nccnc1NCc2c[nH]nn2 27a_100020620823_100011999405 [0,1,0,0,0,0|3,0,0]=4 1652 B15R2.562 Cc1nccnc1NCc2cocn2 27a_100015188801_100011999405 [0,1,0,0,0,0|3,0,0]=4 1653 B15R2.562 Cc1nccnc1NCc2cscn2 27a_100015185402_100011999405 [0,1,0,0,0,0|3,0,0]=4 1654 B15R2.562 Cc1nccnc1OCc2c[nH]cn2 34a_100000766352_100000707719 [0,1,0,0,0,0|3,0,0]=4 1655 B15R2.562 Cc1nccnc1SCc2c[nH]cn2 62a_100000707719_100011999405 [0,1,0,0,0,0|3,0,0]=4 1656 B15R2.562 Cc1nccnc1SCc2c[nH]cn2 62a_100011999405_100000707719 [0,1,0,0,0,0|3,0,0]=4 1657 B15R2.562 Cc1ncncc1SCc2c[nH]cn2 62a_100000707719_100009819671 [0,1,0,0,0,0|3,0,0]=4 1658 B15R2.562 Cc1ncncc1SCc2c[nH]cn2 62a_100009819671_100000707719 [0,1,0,0,0,0|3,0,0]=4 1659 B15R2.562 Clc1ccccc1CSc2c[nH]cn2 62a_100000187162_100000756875 [0,1,0,0,0,0|2,0,0]=3 1660 B15R2.562 Clc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000187162 [0,1,0,0,0,0|2,0,0]=3 1661 B15R2.562 Clc1ccccc1CSc2c[nH]nn2 62a_100000187162_100009819707 [0,1,0,0,0,0|3,0,0]=4 1662 B15R2.562 Clc1ccccc1CSc2c[nH]nn2 62a_100009819707_100000187162 [0,1,0,0,0,0|3,0,0]=4 1663 B15R2.562 Clc1ccccc1CSc2cscn2 62a_100000187162_100000751502 [0,1,0,0,0,0|3,0,0]=4 1664 B15R2.562 Clc1ccccc1CSc2cscn2 62a_100000751502_100000187162 [0,1,0,0,0,0|3,0,0]=4 1665 B15R2.562 Clc1ccccc1CSc2nc[nH]n2 62a_100000187162_100000761765 [0,1,0,0,0,0|3,0,0]=4 1666 B15R2.562 Clc1ccccc1CSc2nc[nH]n2 62a_100000761765_100000187162 [0,1,0,0,0,0|3,0,0]=4 1667 B15R2.562 Clc1ccccc1NCC2=NCCN2 34a_100000185783_100000737910 [0,1,0,0,0,0|2,0,1]=4 1668 B15R2.562 Clc1ccccc1NCc2c[nH]cn2 34a_100000185783_100000707719 [0,1,0,0,0,0|0,0,0]=1 1669 B15R2.562 Clc1ccccc1NCc2cc[nH]n2 207a_100000185783_100000738523 [0,1,0,0,0,0|2,0,0]=3 1670 B15R2.562 Clc1ccccc1NCc2ccco2 207a_100000185783_100000186105 [0,1,0,0,0,0|2,0,0]=3 1671 B15R2.562 Clc1ccccc1NCc2cccs2 207a_100000185783_100000209959 [0,1,0,0,0,0|2,0,0]=3 1672 B15R2.562 Clc1ccccc1NCc2ccn[nH]2 34a_100000185783_100000728653 [0,1,0,0,0,0|2,0,1]=4 1673 B15R2.562 Clc1ccccc1NCc2ccoc2 207a_100000185783_100011215517 [0,1,0,0,0,0|2,0,0]=3 1674 B15R2.562 Clc1ccccc1NCc2ccon2 34a_100000185783_100000234950 [0,1,0,0,0,0|2,0,0]=3 1675 B15R2.562 Clc1ccccc1NCc2ccsc2 207a_100000185783_100000188534 [0,1,0,0,0,0|2,0,0]=3 1676 B15R2.562 Clc1ccccc1NCc2ccsc2 34a_100000185783_100011261437 [0,1,0,0,0,0|2,0,0]=3 1677 B15R2.562 Clc1ccccc1NCc2cn[nH]c2 207a_100000185783_100016992096 [0,1,0,0,0,0|2,0,0]=3 1678 B15R2.562 Clc1ccccc1NCc2cnc[nH]2 207a_100000185783_100000742939 [0,1,0,0,0,0|0,0,2]=3 1679 B15R2.562 Clc1ccccc1NCc2cncs2 207a_100000185783_100000749870 [0,1,0,0,0,0|1,0,1]=3 1680 B15R2.562 Clc1ccccc1NCc2cncs2 34a_100000185783_100015185245 [0,1,0,0,0,0|1,0,1]=3 1681 B15R2.562 Clc1ccccc1NCc2cscn2 207a_100000185783_100000743575 [0,1,0,0,0,0|1,0,0]=2 1682 B15R2.562 Clc1ccccc1NCc2cscn2 34a_100000185783_100000205941 [0,1,0,0,0,0|1,0,0]=2 1683 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 207a_100000185783_100000743867 [0,1,0,0,0,0|2,0,0]=3 1684 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 34a_100000185783_100016991755 [0,1,0,0,0,0|2,0,0]=3 1685 B15R2.562 Clc1ccccc1NCc2ncco2 34a_100000185783_103436540062 [0,1,0,0,0,0|2,0,0]=3 1686 B15R2.562 Clc1ccccc1NCc2nccs2 207a_100000185783_100000750902 [0,1,0,0,0,0|2,0,0]=3 1687 B15R2.562 Clc1ccccc1NCc2nccs2 34a_100000185783_100015184050 [0,1,0,0,0,0|2,0,0]=3 1688 B15R2.562 Clc1ccccc1NCc2ncon2 34a_100000185783_100000233494 [0,1,0,0,0,0|2,0,0]=3 1689 B15R2.562 Clc1ccccc1NCc2nnn[nH]2 34a_100000185783_100000765167 [0,1,0,0,0,0|2,0,1]=4 1690 B15R2.562 Clc1ccccc1NCn2cncn2 34a_100000185783_200020645497 [0,1,0,0,0,0|1,0,1]=3 1691 B15R2.562 Clc1ccccc1OCc2c[nH]cn2 34a_100000210172_100000707719 [0,1,0,0,0,0|1,0,0]=2 1692 B15R2.562 Clc1ccccc1OCc2ccon2 34a_100000210172_100000234950 [0,1,0,0,0,0|3,0,0]=4 1693 B15R2.562 Clc1ccccc1OCc2ccon2 7a_100000210172_100000234950 [0,1,0,0,0,0|3,0,0]=4 1694 B15R2.562 Clc1ccccc1OCc2ccsc2 34a_100000210172_100011261437 [0,1,0,0,0,0|3,0,0]=4 1695 B15R2.562 Clc1ccccc1OCc2ccsc2 7a_100000210172_100011261437 [0,1,0,0,0,0|3,0,0]=4 1696 B15R2.562 Clc1ccccc1OCc2cncs2 34a_100000210172_100015185245 [0,1,0,0,0,0|2,0,1]=4 1697 B15R2.562 Clc1ccccc1OCc2cncs2 7a_100000210172_100015185245 [0,1,0,0,0,0|2,0,1]=4 1698 B15R2.562 Clc1ccccc1OCc2cscn2 34a_100000210172_100000205941 [0,1,0,0,0,0|2,0,0]=3 1699 B15R2.562 Clc1ccccc1OCc2cscn2 7a_100000210172_100000205941 [0,1,0,0,0,0|2,0,0]=3 1700 B15R2.562 Clc1ccccc1OCc2ncc[nH]2 34a_100000210172_100016991755 [0,1,0,0,0,0|3,0,0]=4 1701 B15R2.562 Clc1ccccc1OCc2ncc[nH]2 7a_100000210172_100000753453 [0,1,0,0,0,0|3,0,0]=4 1702 B15R2.562 Clc1ccccc1OCc2ncco2 34a_100000210172_103436540062 [0,1,0,0,0,0|3,0,0]=4 1703 B15R2.562 Clc1ccccc1OCc2ncco2 7a_100000210172_103436540062 [0,1,0,0,0,0|3,0,0]=4 1704 B15R2.562 Clc1ccccc1OCc2nccs2 34a_100000210172_100015184050 [0,1,0,0,0,0|3,0,0]=4 1705 B15R2.562 Clc1ccccc1OCc2nccs2 7a_100000210172_100015184050 [0,1,0,0,0,0|3,0,0]=4 1706 B15R2.562 Clc1ccccc1OCc2ncon2 34a_100000210172_100000233494 [0,1,0,0,0,0|3,0,0]=4 1707 B15R2.562 Clc1ccccc1OCn2cncn2 34a_100000210172_200020645497 [0,1,0,0,0,0|2,0,1]=4 1708 B15R2.562 Clc1ccccc1OCn2cncn2 7a_100000210172_200020645497 [0,1,0,0,0,0|2,0,1]=4 1709 B15R2.562 Clc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000764095 [0,1,0,0,0,0|1,0,0]=2 1710 B15R2.562 Clc1ccccc1SCc2c[nH]cn2 62a_100000764095_100000707719 [0,1,0,0,0,0|1,0,0]=2 1711 B15R2.562 Clc1ccccc1SCc2ccon2 62a_100000234950_100000764095 [0,1,0,0,0,0|3,0,0]=4 1712 B15R2.562 Clc1ccccc1SCc2ccon2 62a_100000764095_100000234950 [0,1,0,0,0,0|3,0,0]=4 1713 B15R2.562 Clc1ccccc1SCc2ccsc2 62a_100000764095_100011233845 [0,1,0,0,0,0|3,0,0]=4 1714 B15R2.562 Clc1ccccc1SCc2ccsc2 62a_100011261437_100000764095 [0,1,0,0,0,0|3,0,0]=4 1715 B15R2.562 Clc1ccccc1SCc2cncs2 62a_100000764095_100015185245 [0,1,0,0,0,0|2,0,1]=4 1716 B15R2.562 Clc1ccccc1SCc2cncs2 62a_100015185245_100000764095 [0,1,0,0,0,0|2,0,1]=4 1717 B15R2.562 Clc1ccccc1SCc2cscn2 62a_100000205941_100000764095 [0,1,0,0,0,0|2,0,0]=3 1718 B15R2.562 Clc1ccccc1SCc2cscn2 62a_100000764095_100000205941 [0,1,0,0,0,0|2,0,0]=3 1719 B15R2.562 Clc1ccccc1SCc2ncc[nH]2 62a_100000764095_100016991755 [0,1,0,0,0,0|3,0,0]=4 1720 B15R2.562 Clc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000764095 [0,1,0,0,0,0|3,0,0]=4 1721 B15R2.562 Clc1ccccc1SCc2ncco2 62a_100000764095_103436540062 [0,1,0,0,0,0|3,0,0]=4 1722 B15R2.562 Clc1ccccc1SCc2ncco2 62a_103436540062_100000764095 [0,1,0,0,0,0|3,0,0]=4 1723 B15R2.562 Clc1ccccc1SCc2nccs2 62a_100000764095_100015184050 [0,1,0,0,0,0|3,0,0]=4 1724 B15R2.562 Clc1ccccc1SCc2nccs2 62a_100015184050_100000764095 [0,1,0,0,0,0|3,0,0]=4 1725 B15R2.562 Clc1ccccc1SCc2ncon2 62a_100000233494_100000764095 [0,1,0,0,0,0|3,0,0]=4 1726 B15R2.562 Clc1ccccc1SCc2ncon2 62a_100000764095_100000233494 [0,1,0,0,0,0|3,0,0]=4 1727 B15R2.562 Clc1ccccc1SCn2cncn2 62a_100000764095_200020645497 [0,1,0,0,0,0|2,0,1]=4 1728 B15R2.562 Clc1ccccc1SCn2cncn2 62a_200020645497_100000764095 [0,1,0,0,0,0|2,0,1]=4 1729 B15R2.562 Clc1cccnc1CSc2c[nH]cn2 62a_100000099807_100000756875 [0,1,0,0,0,0|3,0,0]=4 1730 B15R2.562 Clc1cccnc1CSc2c[nH]cn2 62a_100000756875_100000099807 [0,1,0,0,0,0|3,0,0]=4 1731 B15R2.562 Clc1cccnc1OCc2c[nH]cn2 34a_100011290957_100000707719 [0,1,0,0,0,0|2,0,0]=3 1732 B15R2.562 Clc1cccnc1OCc2cscn2 34a_100011290957_100000205941 [0,1,0,0,0,0|3,0,0]=4 1733 B15R2.562 Clc1cccnc1SCc2c[nH]cn2 62a_100000707719_100011356963 [0,1,0,0,0,0|2,0,0]=3 1734 B15R2.562 Clc1cccnc1SCc2c[nH]cn2 62a_100011356963_100000707719 [0,1,0,0,0,0|2,0,0]=3 1735 B15R2.562 Clc1cccnc1SCc2cscn2 62a_100000205941_100011356963 [0,1,0,0,0,0|3,0,0]=4 1736 B15R2.562 Clc1cccnc1SCc2cscn2 62a_100011356963_100000205941 [0,1,0,0,0,0|3,0,0]=4 1737 B15R2.562 Clc1ccncc1OCc2c[nH]cn2 34a_100011996695_100000707719 [0,1,0,0,0,0|2,0,0]=3 1738 B15R2.562 Clc1ccncc1OCc2cscn2 34a_100011996695_100000205941 [0,1,0,0,0,0|3,0,0]=4 1739 B15R2.562 Clc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009995489 [0,1,0,0,0,0|2,0,0]=3 1740 B15R2.562 Clc1ccncc1SCc2c[nH]cn2 62a_100009995489_100000707719 [0,1,0,0,0,0|2,0,0]=3 1741 B15R2.562 Clc1ccncc1SCc2cscn2 62a_100000205941_100009995489 [0,1,0,0,0,0|3,0,0]=4 1742 B15R2.562 Clc1ccncc1SCc2cscn2 62a_100009995489_100000205941 [0,1,0,0,0,0|3,0,0]=4 1743 B15R2.562 Clc1cnccc1CSc2c[nH]cn2 62a_100000756875_100000763264 [0,1,0,0,0,0|3,0,0]=4 1744 B15R2.562 Clc1cnccc1CSc2c[nH]cn2 62a_100000763264_100000756875 [0,1,0,0,0,0|3,0,0]=4 1745 B15R2.562 Clc1cnccc1OCc2c[nH]cn2 34a_100011997054_100000707719 [0,1,0,0,0,0|2,0,0]=3 1746 B15R2.562 Clc1cnccc1OCc2cscn2 34a_100011997054_100000205941 [0,1,0,0,0,0|3,0,0]=4 1747 B15R2.562 Clc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000708259 [0,1,0,0,0,0|2,0,0]=3 1748 B15R2.562 Clc1cnccc1SCc2c[nH]cn2 62a_100000708259_100000707719 [0,1,0,0,0,0|2,0,0]=3 1749 B15R2.562 Clc1cnccc1SCc2cscn2 62a_100000205941_100000708259 [0,1,0,0,0,0|3,0,0]=4 1750 B15R2.562 Clc1cnccc1SCc2cscn2 62a_100000708259_100000205941 [0,1,0,0,0,0|3,0,0]=4 1751 B15R2.562 Clc1ncccc1CSc2c[nH]cn2 62a_100000045678_100000756875 [0,1,0,0,0,0|3,0,0]=4 1752 B15R2.562 Clc1ncccc1CSc2c[nH]cn2 62a_100000756875_100000045678 [0,1,0,0,0,0|3,0,0]=4 1753 B15R2.562 Clc1ncccc1OCc2c[nH]cn2 34a_100000757616_100000707719 [0,1,0,0,0,0|2,0,0]=3 1754 B15R2.562 Clc1ncccc1OCc2cscn2 34a_100000757616_100000205941 [0,1,0,0,0,0|3,0,0]=4 1755 B15R2.562 Clc1ncccc1OCc2cscn2 7a_100000757616_100000205941 [0,1,0,0,0,0|3,0,0]=4 1756 B15R2.562 Clc1ncccc1SCc2c[nH]cn2 62a_100000036424_100000707719 [0,1,0,0,0,0|2,0,0]=3 1757 B15R2.562 Clc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000036424 [0,1,0,0,0,0|2,0,0]=3 1758 B15R2.562 Clc1ncccc1SCc2cscn2 62a_100000036424_100000205941 [0,1,0,0,0,0|3,0,0]=4 1759 B15R2.562 Clc1ncccc1SCc2cscn2 62a_100000205941_100000036424 [0,1,0,0,0,0|3,0,0]=4 1760 B15R2.562 Clc1nccnc1SCc2c[nH]cn2 62a_100000707719_100010886584 [0,1,0,0,0,0|3,0,0]=4 1761 B15R2.562 Clc1nccnc1SCc2c[nH]cn2 62a_100010886584_100000707719 [0,1,0,0,0,0|3,0,0]=4 1762 B15R2.562 Clc1ncncc1SCc2c[nH]cn2 62a_100000707719_100000758962 [0,1,0,0,0,0|3,0,0]=4 1763 B15R2.562 Clc1ncncc1SCc2c[nH]cn2 62a_100000758962_100000707719 [0,1,0,0,0,0|3,0,0]=4 1764 B15R2.562 Fc1ccccc1C=Cc2c[nH]cn2 271570a_200102527919_100000756875 [0,1,0,0,0,0|1,0,1]=3 1765 B15R2.562 Fc1ccccc1C=Cc2cscn2 271570a_200102527919_100000751502 [0,1,0,0,0,0|2,0,1]=4 1766 B15R2.562 Fc1ccccc1C=Cc2nc[nH]n2 271570a_200102527919_100000761765 [0,1,0,0,0,0|2,0,1]=4 1767 B15R2.562 Fc1ccccc1CSc2c[nH]cn2 62a_100000211605_100000756875 [0,1,0,0,0,0|2,0,0]=3 1768 B15R2.562 Fc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000211605 [0,1,0,0,0,0|2,0,0]=3 1769 B15R2.562 Fc1ccccc1CSc2c[nH]nn2 62a_100000211605_100009819707 [0,1,0,0,0,0|3,0,0]=4 1770 B15R2.562 Fc1ccccc1CSc2c[nH]nn2 62a_100009819707_100000211605 [0,1,0,0,0,0|3,0,0]=4 1771 B15R2.562 Fc1ccccc1CSc2cscn2 62a_100000211605_100000751502 [0,1,0,0,0,0|3,0,0]=4 1772 B15R2.562 Fc1ccccc1CSc2cscn2 62a_100000751502_100000211605 [0,1,0,0,0,0|3,0,0]=4 1773 B15R2.562 Fc1ccccc1CSc2nc[nH]n2 62a_100000211605_100000761765 [0,1,0,0,0,0|3,0,0]=4 1774 B15R2.562 Fc1ccccc1CSc2nc[nH]n2 62a_100000761765_100000211605 [0,1,0,0,0,0|3,0,0]=4 1775 B15R2.562 Fc1ccccc1NCC2=NCCN2 34a_100000210422_100000737910 [0,1,0,0,0,0|2,0,1]=4 1776 B15R2.562 Fc1ccccc1NCc2c[nH]cn2 34a_100000210422_100000707719 [0,1,0,0,0,0|0,0,0]=1 1777 B15R2.562 Fc1ccccc1NCc2cc[nH]n2 207a_100000210422_100000738523 [0,1,0,0,0,0|2,0,0]=3 1778 B15R2.562 Fc1ccccc1NCc2ccco2 207a_100000210422_100000186105 [0,1,0,0,0,0|2,0,0]=3 1779 B15R2.562 Fc1ccccc1NCc2cccs2 207a_100000210422_100000209959 [0,1,0,0,0,0|2,0,0]=3 1780 B15R2.562 Fc1ccccc1NCc2ccn[nH]2 34a_100000210422_100000728653 [0,1,0,0,0,0|2,0,1]=4 1781 B15R2.562 Fc1ccccc1NCc2ccoc2 207a_100000210422_100011215517 [0,1,0,0,0,0|2,0,0]=3 1782 B15R2.562 Fc1ccccc1NCc2ccon2 34a_100000210422_100000234950 [0,1,0,0,0,0|2,0,0]=3 1783 B15R2.562 Fc1ccccc1NCc2ccsc2 207a_100000210422_100000188534 [0,1,0,0,0,0|2,0,0]=3 1784 B15R2.562 Fc1ccccc1NCc2ccsc2 34a_100000210422_100011261437 [0,1,0,0,0,0|2,0,0]=3 1785 B15R2.562 Fc1ccccc1NCc2cn[nH]c2 207a_100000210422_100016992096 [0,1,0,0,0,0|2,0,0]=3 1786 B15R2.562 Fc1ccccc1NCc2cnc[nH]2 207a_100000210422_100000742939 [0,1,0,0,0,0|0,0,2]=3 1787 B15R2.562 Fc1ccccc1NCc2cncs2 207a_100000210422_100000749870 [0,1,0,0,0,0|1,0,1]=3 1788 B15R2.562 Fc1ccccc1NCc2cncs2 34a_100000210422_100015185245 [0,1,0,0,0,0|1,0,1]=3 1789 B15R2.562 Fc1ccccc1NCc2cscn2 207a_100000210422_100000743575 [0,1,0,0,0,0|1,0,0]=2 1790 B15R2.562 Fc1ccccc1NCc2cscn2 34a_100000210422_100000205941 [0,1,0,0,0,0|1,0,0]=2 1791 B15R2.562 Fc1ccccc1NCc2ncc[nH]2 207a_100000210422_100000743867 [0,1,0,0,0,0|2,0,0]=3 1792 B15R2.562 Fc1ccccc1NCc2ncc[nH]2 34a_100000210422_100016991755 [0,1,0,0,0,0|2,0,0]=3 1793 B15R2.562 Fc1ccccc1NCc2ncco2 34a_100000210422_103436540062 [0,1,0,0,0,0|2,0,0]=3 1794 B15R2.562 Fc1ccccc1NCc2nccs2 207a_100000210422_100000750902 [0,1,0,0,0,0|2,0,0]=3 1795 B15R2.562 Fc1ccccc1NCc2nccs2 34a_100000210422_100015184050 [0,1,0,0,0,0|2,0,0]=3 1796 B15R2.562 Fc1ccccc1NCc2ncon2 34a_100000210422_100000233494 [0,1,0,0,0,0|2,0,0]=3 1797 B15R2.562 Fc1ccccc1NCc2nnn[nH]2 34a_100000210422_100000765167 [0,1,0,0,0,0|2,0,1]=4 1798 B15R2.562 Fc1ccccc1NCn2cncn2 34a_100000210422_200020645497 [0,1,0,0,0,0|1,0,1]=3 1799 B15R2.562 Fc1ccccc1OCc2c[nH]cn2 34a_100000210171_100000707719 [0,1,0,0,0,0|1,0,0]=2 1800 B15R2.562 Fc1ccccc1OCc2ccon2 34a_100000210171_100000234950 [0,1,0,0,0,0|3,0,0]=4 1801 B15R2.562 Fc1ccccc1OCc2ccon2 7a_100000210171_100000234950 [0,1,0,0,0,0|3,0,0]=4 1802 B15R2.562 Fc1ccccc1OCc2ccsc2 34a_100000210171_100011261437 [0,1,0,0,0,0|3,0,0]=4 1803 B15R2.562 Fc1ccccc1OCc2ccsc2 7a_100000210171_100011261437 [0,1,0,0,0,0|3,0,0]=4 1804 B15R2.562 Fc1ccccc1OCc2cncs2 34a_100000210171_100015185245 [0,1,0,0,0,0|2,0,1]=4 1805 B15R2.562 Fc1ccccc1OCc2cncs2 7a_100000210171_100015185245 [0,1,0,0,0,0|2,0,1]=4 1806 B15R2.562 Fc1ccccc1OCc2cscn2 34a_100000210171_100000205941 [0,1,0,0,0,0|2,0,0]=3 1807 B15R2.562 Fc1ccccc1OCc2cscn2 7a_100000210171_100000205941 [0,1,0,0,0,0|2,0,0]=3 1808 B15R2.562 Fc1ccccc1OCc2ncc[nH]2 34a_100000210171_100016991755 [0,1,0,0,0,0|3,0,0]=4 1809 B15R2.562 Fc1ccccc1OCc2ncc[nH]2 7a_100000210171_100000753453 [0,1,0,0,0,0|3,0,0]=4 1810 B15R2.562 Fc1ccccc1OCc2ncco2 34a_100000210171_103436540062 [0,1,0,0,0,0|3,0,0]=4 1811 B15R2.562 Fc1ccccc1OCc2ncco2 7a_100000210171_103436540062 [0,1,0,0,0,0|3,0,0]=4 1812 B15R2.562 Fc1ccccc1OCc2nccs2 34a_100000210171_100015184050 [0,1,0,0,0,0|3,0,0]=4 1813 B15R2.562 Fc1ccccc1OCc2nccs2 7a_100000210171_100015184050 [0,1,0,0,0,0|3,0,0]=4 1814 B15R2.562 Fc1ccccc1OCc2ncon2 34a_100000210171_100000233494 [0,1,0,0,0,0|3,0,0]=4 1815 B15R2.562 Fc1ccccc1OCn2cncn2 34a_100000210171_200020645497 [0,1,0,0,0,0|2,0,1]=4 1816 B15R2.562 Fc1ccccc1OCn2cncn2 7a_100000210171_200020645497 [0,1,0,0,0,0|2,0,1]=4 1817 B15R2.562 Fc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011215700 [0,1,0,0,0,0|1,0,0]=2 1818 B15R2.562 Fc1ccccc1SCc2c[nH]cn2 62a_100011215700_100000707719 [0,1,0,0,0,0|1,0,0]=2 1819 B15R2.562 Fc1ccccc1SCc2ccon2 62a_100000234950_100011215700 [0,1,0,0,0,0|3,0,0]=4 1820 B15R2.562 Fc1ccccc1SCc2ccon2 62a_100011215700_100000234950 [0,1,0,0,0,0|3,0,0]=4 1821 B15R2.562 Fc1ccccc1SCc2ccsc2 62a_100011215700_100011233845 [0,1,0,0,0,0|3,0,0]=4 1822 B15R2.562 Fc1ccccc1SCc2ccsc2 62a_100011261437_100011215700 [0,1,0,0,0,0|3,0,0]=4 1823 B15R2.562 Fc1ccccc1SCc2cncs2 62a_100011215700_100015185245 [0,1,0,0,0,0|2,0,1]=4 1824 B15R2.562 Fc1ccccc1SCc2cncs2 62a_100015185245_100011215700 [0,1,0,0,0,0|2,0,1]=4 1825 B15R2.562 Fc1ccccc1SCc2cscn2 62a_100000205941_100011215700 [0,1,0,0,0,0|2,0,0]=3 1826 B15R2.562 Fc1ccccc1SCc2cscn2 62a_100011215700_100000205941 [0,1,0,0,0,0|2,0,0]=3 1827 B15R2.562 Fc1ccccc1SCc2ncc[nH]2 62a_100011215700_100016991755 [0,1,0,0,0,0|3,0,0]=4 1828 B15R2.562 Fc1ccccc1SCc2ncc[nH]2 62a_100016991755_100011215700 [0,1,0,0,0,0|3,0,0]=4 1829 B15R2.562 Fc1ccccc1SCc2ncco2 62a_100011215700_103436540062 [0,1,0,0,0,0|3,0,0]=4 1830 B15R2.562 Fc1ccccc1SCc2ncco2 62a_103436540062_100011215700 [0,1,0,0,0,0|3,0,0]=4 1831 B15R2.562 Fc1ccccc1SCc2nccs2 62a_100011215700_100015184050 [0,1,0,0,0,0|3,0,0]=4 1832 B15R2.562 Fc1ccccc1SCc2nccs2 62a_100015184050_100011215700 [0,1,0,0,0,0|3,0,0]=4 1833 B15R2.562 Fc1ccccc1SCc2ncon2 62a_100000233494_100011215700 [0,1,0,0,0,0|3,0,0]=4 1834 B15R2.562 Fc1ccccc1SCc2ncon2 62a_100011215700_100000233494 [0,1,0,0,0,0|3,0,0]=4 1835 B15R2.562 Fc1ccccc1SCn2cncn2 62a_100011215700_200020645497 [0,1,0,0,0,0|2,0,1]=4 1836 B15R2.562 Fc1ccccc1SCn2cncn2 62a_200020645497_100011215700 [0,1,0,0,0,0|2,0,1]=4 1837 B15R2.562 Fc1cccnc1CSc2c[nH]cn2 62a_100000104219_100000756875 [0,1,0,0,0,0|3,0,0]=4 1838 B15R2.562 Fc1cccnc1CSc2c[nH]cn2 62a_100000756875_100000104219 [0,1,0,0,0,0|3,0,0]=4 1839 B15R2.562 Fc1cccnc1OCc2c[nH]cn2 34a_100011219419_100000707719 [0,1,0,0,0,0|2,0,0]=3 1840 B15R2.562 Fc1cccnc1OCc2cscn2 34a_100011219419_100000205941 [0,1,0,0,0,0|3,0,0]=4 1841 B15R2.562 Fc1cccnc1SCc2c[nH]cn2 62a_100000685392_100000707719 [0,1,0,0,0,0|2,0,0]=3 1842 B15R2.562 Fc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000685392 [0,1,0,0,0,0|2,0,0]=3 1843 B15R2.562 Fc1cccnc1SCc2cscn2 62a_100000205941_100000685392 [0,1,0,0,0,0|3,0,0]=4 1844 B15R2.562 Fc1cccnc1SCc2cscn2 62a_100000685392_100000205941 [0,1,0,0,0,0|3,0,0]=4 1845 B15R2.562 Fc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009820683 [0,1,0,0,0,0|2,0,0]=3 1846 B15R2.562 Fc1ccncc1SCc2c[nH]cn2 62a_100009820683_100000707719 [0,1,0,0,0,0|2,0,0]=3 1847 B15R2.562 Fc1ccncc1SCc2cscn2 62a_100000205941_100009820683 [0,1,0,0,0,0|3,0,0]=4 1848 B15R2.562 Fc1ccncc1SCc2cscn2 62a_100009820683_100000205941 [0,1,0,0,0,0|3,0,0]=4 1849 B15R2.562 Fc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000035921 [0,1,0,0,0,0|1,0,0]=2 1850 B15R2.562 Fc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000035921 [0,1,0,0,0,0|2,0,0]=3 1851 B15R2.562 Fc1cnccc1NCc2cc[nH]n2 27a_100000739516_100000035921 [0,1,0,0,0,0|3,0,0]=4 1852 B15R2.562 Fc1cnccc1NCc2ccco2 27a_100000185738_100000035921 [0,1,0,0,0,0|3,0,0]=4 1853 B15R2.562 Fc1cnccc1NCc2cccs2 27a_100000211653_100000035921 [0,1,0,0,0,0|3,0,0]=4 1854 B15R2.562 Fc1cnccc1NCc2ccoc2 27a_100015206860_100000035921 [0,1,0,0,0,0|3,0,0]=4 1855 B15R2.562 Fc1cnccc1NCc2ccon2 27a_100000688301_100000035921 [0,1,0,0,0,0|3,0,0]=4 1856 B15R2.562 Fc1cnccc1NCc2ccsc2 27a_100000186416_100000035921 [0,1,0,0,0,0|3,0,0]=4 1857 B15R2.562 Fc1cnccc1NCc2cn[nH]c2 27a_100000737208_100000035921 [0,1,0,0,0,0|3,0,0]=4 1858 B15R2.562 Fc1cnccc1NCc2cnco2 27a_100020634212_100000035921 [0,1,0,0,0,0|2,0,1]=4 1859 B15R2.562 Fc1cnccc1NCc2cncs2 27a_100016987365_100000035921 [0,1,0,0,0,0|2,0,1]=4 1860 B15R2.562 Fc1cnccc1NCc2cocn2 27a_100015188801_100000035921 [0,1,0,0,0,0|2,0,0]=3 1861 B15R2.562 Fc1cnccc1NCc2cscn2 27a_100015185402_100000035921 [0,1,0,0,0,0|2,0,0]=3 1862 B15R2.562 Fc1cnccc1NCc2ncc[nH]2 27a_100000754540_100000035921 [0,1,0,0,0,0|3,0,0]=4 1863 B15R2.562 Fc1cnccc1NCc2ncco2 27a_100016994969_100000035921 [0,1,0,0,0,0|3,0,0]=4 1864 B15R2.562 Fc1cnccc1NCc2nccs2 27a_100000740555_100000035921 [0,1,0,0,0,0|3,0,0]=4 1865 B15R2.562 Fc1cnccc1OCc2c[nH]cn2 34a_200000081243_100000707719 [0,1,0,0,0,0|2,0,0]=3 1866 B15R2.562 Fc1cnccc1OCc2cscn2 34a_200000081243_100000205941 [0,1,0,0,0,0|3,0,0]=4 1867 B15R2.562 Fc1cnccc1SCc2c[nH]cn2 62a_100000047030_100000707719 [0,1,0,0,0,0|2,0,0]=3 1868 B15R2.562 Fc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000047030 [0,1,0,0,0,0|2,0,0]=3 1869 B15R2.562 Fc1cnccc1SCc2cscn2 62a_100000047030_100000205941 [0,1,0,0,0,0|3,0,0]=4 1870 B15R2.562 Fc1cnccc1SCc2cscn2 62a_100000205941_100000047030 [0,1,0,0,0,0|3,0,0]=4 1871 B15R2.562 Fc1cncnc1NCc2c[nH]cn2 27a_100000758547_100000069762 [0,1,0,0,0,0|2,0,0]=3 1872 B15R2.562 Fc1cncnc1NCc2c[nH]nn2 27a_100020620823_100000069762 [0,1,0,0,0,0|3,0,0]=4 1873 B15R2.562 Fc1cncnc1NCc2cocn2 27a_100015188801_100000069762 [0,1,0,0,0,0|3,0,0]=4 1874 B15R2.562 Fc1cncnc1NCc2cscn2 27a_100015185402_100000069762 [0,1,0,0,0,0|3,0,0]=4 1875 B15R2.562 Fc1cncnc1SCc2c[nH]cn2 62a_100000069762_100000707719 [0,1,0,0,0,0|3,0,0]=4 1876 B15R2.562 Fc1cncnc1SCc2c[nH]cn2 62a_100000707719_100000069762 [0,1,0,0,0,0|3,0,0]=4 1877 B15R2.562 Fc1ncccc1CSc2c[nH]cn2 62a_100000099810_100000756875 [0,1,0,0,0,0|3,0,0]=4 1878 B15R2.562 Fc1ncccc1CSc2c[nH]cn2 62a_100000756875_100000099810 [0,1,0,0,0,0|3,0,0]=4 1879 B15R2.562 Fc1ncccc1OCc2c[nH]cn2 34a_100000061740_100000707719 [0,1,0,0,0,0|2,0,0]=3 1880 B15R2.562 Fc1ncccc1OCc2cscn2 34a_100000061740_100000205941 [0,1,0,0,0,0|3,0,0]=4 1881 B15R2.562 Fc1ncccc1OCc2cscn2 7a_100000061740_100000205941 [0,1,0,0,0,0|3,0,0]=4 1882 B15R2.562 Fc1ncccc1SCc2c[nH]cn2 62a_100000707719_100009816115 [0,1,0,0,0,0|2,0,0]=3 1883 B15R2.562 Fc1ncccc1SCc2c[nH]cn2 62a_100009816115_100000707719 [0,1,0,0,0,0|2,0,0]=3 1884 B15R2.562 Fc1ncccc1SCc2cscn2 62a_100000205941_100009816115 [0,1,0,0,0,0|3,0,0]=4 1885 B15R2.562 Fc1ncccc1SCc2cscn2 62a_100009816115_100000205941 [0,1,0,0,0,0|3,0,0]=4 1886 B15R2.562 Fc1nccnc1NCc2c[nH]cn2 27a_100000758547_200010125657 [0,1,0,0,0,0|2,0,0]=3 1887 B15R2.562 Fc1nccnc1NCc2c[nH]nn2 27a_100020620823_200010125657 [0,1,0,0,0,0|3,0,0]=4 1888 B15R2.562 Fc1nccnc1NCc2cocn2 27a_100015188801_200010125657 [0,1,0,0,0,0|3,0,0]=4 1889 B15R2.562 Fc1nccnc1NCc2cscn2 27a_100015185402_200010125657 [0,1,0,0,0,0|3,0,0]=4 1890 B15R2.562 Fc1nccnc1SCc2c[nH]cn2 62a_100000707719_200010125657 [0,1,0,0,0,0|3,0,0]=4 1891 B15R2.562 Fc1nccnc1SCc2c[nH]cn2 62a_200010125657_100000707719 [0,1,0,0,0,0|3,0,0]=4 1892 B15R2.562 Ic1ccccc1CSc2c[nH]cn2 62a_100000756875_100011216222 [0,1,0,0,0,0|2,0,0]=3 1893 B15R2.562 Ic1ccccc1CSc2c[nH]cn2 62a_100011216222_100000756875 [0,1,0,0,0,0|2,0,0]=3 1894 B15R2.562 Ic1ccccc1CSc2c[nH]nn2 62a_100009819707_100011216222 [0,1,0,0,0,0|3,0,0]=4 1895 B15R2.562 Ic1ccccc1CSc2c[nH]nn2 62a_100011216222_100009819707 [0,1,0,0,0,0|3,0,0]=4 1896 B15R2.562 Ic1ccccc1CSc2cscn2 62a_100000751502_100011216222 [0,1,0,0,0,0|3,0,0]=4 1897 B15R2.562 Ic1ccccc1CSc2cscn2 62a_100011216222_100000751502 [0,1,0,0,0,0|3,0,0]=4 1898 B15R2.562 Ic1ccccc1CSc2nc[nH]n2 62a_100000761765_100011216222 [0,1,0,0,0,0|3,0,0]=4 1899 B15R2.562 Ic1ccccc1CSc2nc[nH]n2 62a_100011216222_100000761765 [0,1,0,0,0,0|3,0,0]=4 1900 B15R2.562 Ic1ccccc1NCC2=NCCN2 34a_100000210053_100000737910 [0,1,0,0,0,0|2,0,1]=4 1901 B15R2.562 Ic1ccccc1NCc2c[nH]cn2 34a_100000210053_100000707719 [0,1,0,0,0,0|0,0,0]=1 1902 B15R2.562 Ic1ccccc1NCc2cc[nH]n2 207a_100000210053_100000738523 [0,1,0,0,0,0|2,0,0]=3 1903 B15R2.562 Ic1ccccc1NCc2ccco2 207a_100000210053_100000186105 [0,1,0,0,0,0|2,0,0]=3 1904 B15R2.562 Ic1ccccc1NCc2cccs2 207a_100000210053_100000209959 [0,1,0,0,0,0|2,0,0]=3 1905 B15R2.562 Ic1ccccc1NCc2ccn[nH]2 34a_100000210053_100000728653 [0,1,0,0,0,0|2,0,1]=4 1906 B15R2.562 Ic1ccccc1NCc2ccoc2 207a_100000210053_100011215517 [0,1,0,0,0,0|2,0,0]=3 1907 B15R2.562 Ic1ccccc1NCc2ccon2 34a_100000210053_100000234950 [0,1,0,0,0,0|2,0,0]=3 1908 B15R2.562 Ic1ccccc1NCc2ccsc2 207a_100000210053_100000188534 [0,1,0,0,0,0|2,0,0]=3 1909 B15R2.562 Ic1ccccc1NCc2ccsc2 34a_100000210053_100011261437 [0,1,0,0,0,0|2,0,0]=3 1910 B15R2.562 Ic1ccccc1NCc2cn[nH]c2 207a_100000210053_100016992096 [0,1,0,0,0,0|2,0,0]=3 1911 B15R2.562 Ic1ccccc1NCc2cnc[nH]2 207a_100000210053_100000742939 [0,1,0,0,0,0|0,0,2]=3 1912 B15R2.562 Ic1ccccc1NCc2cncs2 207a_100000210053_100000749870 [0,1,0,0,0,0|1,0,1]=3 1913 B15R2.562 Ic1ccccc1NCc2cncs2 34a_100000210053_100015185245 [0,1,0,0,0,0|1,0,1]=3 1914 B15R2.562 Ic1ccccc1NCc2cscn2 207a_100000210053_100000743575 [0,1,0,0,0,0|1,0,0]=2 1915 B15R2.562 Ic1ccccc1NCc2cscn2 34a_100000210053_100000205941 [0,1,0,0,0,0|1,0,0]=2 1916 B15R2.562 Ic1ccccc1NCc2ncc[nH]2 207a_100000210053_100000743867 [0,1,0,0,0,0|2,0,0]=3 1917 B15R2.562 Ic1ccccc1NCc2ncc[nH]2 34a_100000210053_100016991755 [0,1,0,0,0,0|2,0,0]=3 1918 B15R2.562 Ic1ccccc1NCc2ncco2 34a_100000210053_103436540062 [0,1,0,0,0,0|2,0,0]=3 1919 B15R2.562 Ic1ccccc1NCc2nccs2 207a_100000210053_100000750902 [0,1,0,0,0,0|2,0,0]=3 1920 B15R2.562 Ic1ccccc1NCc2nccs2 34a_100000210053_100015184050 [0,1,0,0,0,0|2,0,0]=3 1921 B15R2.562 Ic1ccccc1NCc2ncon2 34a_100000210053_100000233494 [0,1,0,0,0,0|2,0,0]=3 1922 B15R2.562 Ic1ccccc1NCc2nnn[nH]2 34a_100000210053_100000765167 [0,1,0,0,0,0|2,0,1]=4 1923 B15R2.562 Ic1ccccc1NCn2cncn2 34a_100000210053_200020645497 [0,1,0,0,0,0|1,0,1]=3 1924 B15R2.562 Ic1ccccc1OCc2c[nH]cn2 34a_100000739446_100000707719 [0,1,0,0,0,0|1,0,0]=2 1925 B15R2.562 Ic1ccccc1OCc2ccon2 34a_100000739446_100000234950 [0,1,0,0,0,0|3,0,0]=4 1926 B15R2.562 Ic1ccccc1OCc2ccon2 7a_100000739446_100000234950 [0,1,0,0,0,0|3,0,0]=4 1927 B15R2.562 Ic1ccccc1OCc2ccsc2 34a_100000739446_100011261437 [0,1,0,0,0,0|3,0,0]=4 1928 B15R2.562 Ic1ccccc1OCc2ccsc2 7a_100000739446_100011261437 [0,1,0,0,0,0|3,0,0]=4 1929 B15R2.562 Ic1ccccc1OCc2cncs2 34a_100000739446_100015185245 [0,1,0,0,0,0|2,0,1]=4 1930 B15R2.562 Ic1ccccc1OCc2cncs2 7a_100000739446_100015185245 [0,1,0,0,0,0|2,0,1]=4 1931 B15R2.562 Ic1ccccc1OCc2cscn2 34a_100000739446_100000205941 [0,1,0,0,0,0|2,0,0]=3 1932 B15R2.562 Ic1ccccc1OCc2cscn2 7a_100000739446_100000205941 [0,1,0,0,0,0|2,0,0]=3 1933 B15R2.562 Ic1ccccc1OCc2ncc[nH]2 34a_100000739446_100016991755 [0,1,0,0,0,0|3,0,0]=4 1934 B15R2.562 Ic1ccccc1OCc2ncc[nH]2 7a_100000739446_100000753453 [0,1,0,0,0,0|3,0,0]=4 1935 B15R2.562 Ic1ccccc1OCc2ncco2 34a_100000739446_103436540062 [0,1,0,0,0,0|3,0,0]=4 1936 B15R2.562 Ic1ccccc1OCc2ncco2 7a_100000739446_103436540062 [0,1,0,0,0,0|3,0,0]=4 1937 B15R2.562 Ic1ccccc1OCc2nccs2 34a_100000739446_100015184050 [0,1,0,0,0,0|3,0,0]=4 1938 B15R2.562 Ic1ccccc1OCc2nccs2 7a_100000739446_100015184050 [0,1,0,0,0,0|3,0,0]=4 1939 B15R2.562 Ic1ccccc1OCc2ncon2 34a_100000739446_100000233494 [0,1,0,0,0,0|3,0,0]=4 1940 B15R2.562 Ic1ccccc1OCn2cncn2 34a_100000739446_200020645497 [0,1,0,0,0,0|2,0,1]=4 1941 B15R2.562 Ic1ccccc1OCn2cncn2 7a_100000739446_200020645497 [0,1,0,0,0,0|2,0,1]=4 1942 B15R2.562 Ic1ccncc1OCc2c[nH]cn2 34a_100000050107_100000707719 [0,1,0,0,0,0|2,0,0]=3 1943 B15R2.562 Ic1ccncc1OCc2cscn2 34a_100000050107_100000205941 [0,1,0,0,0,0|3,0,0]=4 1944 B15R2.562 Ic1ncccc1OCc2c[nH]cn2 34a_100000034122_100000707719 [0,1,0,0,0,0|2,0,0]=3 1945 B15R2.562 Ic1ncccc1OCc2cscn2 34a_100000034122_100000205941 [0,1,0,0,0,0|3,0,0]=4 1946 B15R2.562 Ic1ncccc1OCc2cscn2 7a_100000034122_100000205941 [0,1,0,0,0,0|3,0,0]=4 1947 B15R2.562 Nc1ccccc1OCc2c[nH]cn2 34a_100000185747_100000707719 [0,1,0,0,0,0|1,0,0]=2 1948 B15R2.562 Nc1ccccc1OCc2ccon2 34a_100000185747_100000234950 [0,1,0,0,0,0|3,0,0]=4 1949 B15R2.562 Nc1ccccc1OCc2ccon2 7a_100000185747_100000234950 [0,1,0,0,0,0|3,0,0]=4 1950 B15R2.562 Nc1ccccc1OCc2ccsc2 34a_100000185747_100011261437 [0,1,0,0,0,0|3,0,0]=4 1951 B15R2.562 Nc1ccccc1OCc2ccsc2 7a_100000185747_100011261437 [0,1,0,0,0,0|3,0,0]=4 1952 B15R2.562 Nc1ccccc1OCc2cncs2 34a_100000185747_100015185245 [0,1,0,0,0,0|2,0,1]=4 1953 B15R2.562 Nc1ccccc1OCc2cncs2 7a_100000185747_100015185245 [0,1,0,0,0,0|2,0,1]=4 1954 B15R2.562 Nc1ccccc1OCc2cscn2 34a_100000185747_100000205941 [0,1,0,0,0,0|2,0,0]=3 1955 B15R2.562 Nc1ccccc1OCc2cscn2 7a_100000185747_100000205941 [0,1,0,0,0,0|2,0,0]=3 1956 B15R2.562 Nc1ccccc1OCc2ncc[nH]2 34a_100000185747_100016991755 [0,1,0,0,0,0|3,0,0]=4 1957 B15R2.562 Nc1ccccc1OCc2ncc[nH]2 7a_100000185747_100000753453 [0,1,0,0,0,0|3,0,0]=4 1958 B15R2.562 Nc1ccccc1OCc2ncco2 34a_100000185747_103436540062 [0,1,0,0,0,0|3,0,0]=4 1959 B15R2.562 Nc1ccccc1OCc2ncco2 7a_100000185747_103436540062 [0,1,0,0,0,0|3,0,0]=4 1960 B15R2.562 Nc1ccccc1OCc2nccs2 34a_100000185747_100015184050 [0,1,0,0,0,0|3,0,0]=4 1961 B15R2.562 Nc1ccccc1OCc2nccs2 7a_100000185747_100015184050 [0,1,0,0,0,0|3,0,0]=4 1962 B15R2.562 Nc1ccccc1OCc2ncon2 34a_100000185747_100000233494 [0,1,0,0,0,0|3,0,0]=4 1963 B15R2.562 Nc1ccccc1OCn2cncn2 34a_100000185747_200020645497 [0,1,0,0,0,0|2,0,1]=4 1964 B15R2.562 Nc1ccccc1OCn2cncn2 7a_100000185747_200020645497 [0,1,0,0,0,0|2,0,1]=4 1965 B15R2.562 Nc1ccccc1SCc2c[nH]cn2 62a_100000210017_100000707719 [0,1,0,0,0,0|1,0,0]=2 1966 B15R2.562 Nc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210017 [0,1,0,0,0,0|1,0,0]=2 1967 B15R2.562 Nc1ccccc1SCc2ccon2 62a_100000210017_100000234950 [0,1,0,0,0,0|3,0,0]=4 1968 B15R2.562 Nc1ccccc1SCc2ccon2 62a_100000234950_100000210017 [0,1,0,0,0,0|3,0,0]=4 1969 B15R2.562 Nc1ccccc1SCc2ccsc2 62a_100000210017_100011233845 [0,1,0,0,0,0|3,0,0]=4 1970 B15R2.562 Nc1ccccc1SCc2ccsc2 62a_100011261437_100000210017 [0,1,0,0,0,0|3,0,0]=4 1971 B15R2.562 Nc1ccccc1SCc2cncs2 62a_100000210017_100015185245 [0,1,0,0,0,0|2,0,1]=4 1972 B15R2.562 Nc1ccccc1SCc2cncs2 62a_100015185245_100000210017 [0,1,0,0,0,0|2,0,1]=4 1973 B15R2.562 Nc1ccccc1SCc2cscn2 62a_100000205941_100000210017 [0,1,0,0,0,0|2,0,0]=3 1974 B15R2.562 Nc1ccccc1SCc2cscn2 62a_100000210017_100000205941 [0,1,0,0,0,0|2,0,0]=3 1975 B15R2.562 Nc1ccccc1SCc2ncc[nH]2 62a_100000210017_100016991755 [0,1,0,0,0,0|3,0,0]=4 1976 B15R2.562 Nc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000210017 [0,1,0,0,0,0|3,0,0]=4 1977 B15R2.562 Nc1ccccc1SCc2ncco2 62a_100000210017_103436540062 [0,1,0,0,0,0|3,0,0]=4 1978 B15R2.562 Nc1ccccc1SCc2ncco2 62a_103436540062_100000210017 [0,1,0,0,0,0|3,0,0]=4 1979 B15R2.562 Nc1ccccc1SCc2nccs2 62a_100000210017_100015184050 [0,1,0,0,0,0|3,0,0]=4 1980 B15R2.562 Nc1ccccc1SCc2nccs2 62a_100015184050_100000210017 [0,1,0,0,0,0|3,0,0]=4 1981 B15R2.562 Nc1ccccc1SCc2ncon2 62a_100000210017_100000233494 [0,1,0,0,0,0|3,0,0]=4 1982 B15R2.562 Nc1ccccc1SCc2ncon2 62a_100000233494_100000210017 [0,1,0,0,0,0|3,0,0]=4 1983 B15R2.562 Nc1ccccc1SCn2cncn2 62a_100000210017_200020645497 [0,1,0,0,0,0|2,0,1]=4 1984 B15R2.562 Nc1ccccc1SCn2cncn2 62a_200020645497_100000210017 [0,1,0,0,0,0|2,0,1]=4 1985 B15R2.562 Nc1cccnc1OCc2c[nH]cn2 34a_100000746358_100000707719 [0,1,0,0,0,0|2,0,0]=3 1986 B15R2.562 Nc1cccnc1OCc2cscn2 34a_100000746358_100000205941 [0,1,0,0,0,0|3,0,0]=4 1987 B15R2.562 Nc1cccnc1SCc2c[nH]cn2 62a_100000688686_100000707719 [0,1,0,0,0,0|2,0,0]=3 1988 B15R2.562 Nc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000688686 [0,1,0,0,0,0|2,0,0]=3 1989 B15R2.562 Nc1cccnc1SCc2cscn2 62a_100000205941_100000688686 [0,1,0,0,0,0|3,0,0]=4 1990 B15R2.562 Nc1cccnc1SCc2cscn2 62a_100000688686_100000205941 [0,1,0,0,0,0|3,0,0]=4 1991 B15R2.562 Nc1ccncc1OCc2c[nH]cn2 34a_100000753702_100000707719 [0,1,0,0,0,0|2,0,0]=3 1992 B15R2.562 Nc1ccncc1OCc2cscn2 34a_100000753702_100000205941 [0,1,0,0,0,0|3,0,0]=4 1993 B15R2.562 Nc1ccncc1SCc2c[nH]cn2 62a_100000047001_100000707719 [0,1,0,0,0,0|2,0,0]=3 1994 B15R2.562 Nc1ccncc1SCc2c[nH]cn2 62a_100000707719_100000047001 [0,1,0,0,0,0|2,0,0]=3 1995 B15R2.562 Nc1ccncc1SCc2cscn2 62a_100000047001_100000205941 [0,1,0,0,0,0|3,0,0]=4 1996 B15R2.562 Nc1ccncc1SCc2cscn2 62a_100000205941_100000047001 [0,1,0,0,0,0|3,0,0]=4 1997 B15R2.562 Nc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000756074 [0,1,0,0,0,0|2,0,0]=3 1998 B15R2.562 Nc1cnccc1SCc2c[nH]cn2 62a_100000756074_100000707719 [0,1,0,0,0,0|2,0,0]=3 1999 B15R2.562 Nc1cnccc1SCc2cscn2 62a_100000205941_100000756074 [0,1,0,0,0,0|3,0,0]=4 2000 B15R2.562 Nc1cnccc1SCc2cscn2 62a_100000756074_100000205941 [0,1,0,0,0,0|3,0,0]=4 2001 B15R2.562 Nc1cncnc1NCc2c[nH]cn2 27a_100000758547_100000709731 [0,1,0,0,0,0|2,0,0]=3 2002 B15R2.562 Nc1cncnc1NCc2c[nH]nn2 27a_100020620823_100000709731 [0,1,0,0,0,0|3,0,0]=4 2003 B15R2.562 Nc1cncnc1NCc2cocn2 27a_100015188801_100000709731 [0,1,0,0,0,0|3,0,0]=4 2004 B15R2.562 Nc1cncnc1NCc2cscn2 27a_100015185402_100000709731 [0,1,0,0,0,0|3,0,0]=4 2005 B15R2.562 Nc1cncnc1SCc2c[nH]cn2 62a_100000707719_100000709731 [0,1,0,0,0,0|3,0,0]=4 2006 B15R2.562 Nc1cncnc1SCc2c[nH]cn2 62a_100000709731_100000707719 [0,1,0,0,0,0|3,0,0]=4 2007 B15R2.562 Nc1cnncc1SCc2c[nH]cn2 62a_100000707719_100009829405 [0,1,0,0,0,0|3,0,0]=4 2008 B15R2.562 Nc1cnncc1SCc2c[nH]cn2 62a_100009829405_100000707719 [0,1,0,0,0,0|3,0,0]=4 2009 B15R2.562 Nc1ncccc1OCc2c[nH]cn2 34a_100000211975_100000707719 [0,1,0,0,0,0|2,0,0]=3 2010 B15R2.562 Nc1ncccc1OCc2cscn2 34a_100000211975_100000205941 [0,1,0,0,0,0|3,0,0]=4 2011 B15R2.562 Nc1ncccc1OCc2cscn2 7a_100000211975_100000205941 [0,1,0,0,0,0|3,0,0]=4 2012 B15R2.562 Nc1ncccc1SCc2c[nH]cn2 62a_100000045569_100000707719 [0,1,0,0,0,0|2,0,0]=3 2013 B15R2.562 Nc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000045569 [0,1,0,0,0,0|2,0,0]=3 2014 B15R2.562 Nc1ncccc1SCc2cscn2 62a_100000045569_100000205941 [0,1,0,0,0,0|3,0,0]=4 2015 B15R2.562 Nc1ncccc1SCc2cscn2 62a_100000205941_100000045569 [0,1,0,0,0,0|3,0,0]=4 2016 B15R2.562 Nc1nccnc1SCc2c[nH]cn2 62a_100000707719_100000747729 [0,1,0,0,0,0|3,0,0]=4 2017 B15R2.562 Nc1nccnc1SCc2c[nH]cn2 62a_100000747729_100000707719 [0,1,0,0,0,0|3,0,0]=4 2018 B15R2.562 Nc1ncncc1SCc2c[nH]cn2 62a_100000707719_100011996079 [0,1,0,0,0,0|3,0,0]=4 2019 B15R2.562 Nc1ncncc1SCc2c[nH]cn2 62a_100011996079_100000707719 [0,1,0,0,0,0|3,0,0]=4 2020 B15R2.562 O=c1[nH]ccnc1SCc2c[nH]cn2 62a_100000707719_100000763361 [0,1,0,0,0,0|3,0,0]=4 2021 B15R2.562 O=c1[nH]nccc1NCc2c[nH]cn2 27a_100000758547_100000087129 [0,1,0,0,0,0|2,0,0]=3 2022 B15R2.562 O=c1[nH]nccc1NCc2c[nH]nn2 27a_100020620823_100000087129 [0,1,0,0,0,0|3,0,0]=4 2023 B15R2.562 O=c1[nH]nccc1NCc2cocn2 27a_100015188801_100000087129 [0,1,0,0,0,0|3,0,0]=4 2024 B15R2.562 O=c1[nH]nccc1NCc2cscn2 27a_100015185402_100000087129 [0,1,0,0,0,0|3,0,0]=4 2025 B15R2.562 O=c1[nH]nccc1SCc2c[nH]cn2 62a_100000707719_100000087129 [0,1,0,0,0,0|3,0,0]=4 2026 B15R2.562 O=c1cc[nH]cc1SCc2c[nH]cn2 62a_100000707719_100009998708 [0,1,0,0,0,0|2,0,0]=3 2027 B15R2.562 O=c1cc[nH]cc1SCc2c[nH]cn2 62a_100009998708_100000707719 [0,1,0,0,0,0|2,0,0]=3 2028 B15R2.562 O=c1cc[nH]cc1SCc2cscn2 62a_100000205941_100009998708 [0,1,0,0,0,0|3,0,0]=4 2029 B15R2.562 O=c1cc[nH]cc1SCc2cscn2 62a_100009998708_100000205941 [0,1,0,0,0,0|3,0,0]=4 2030 B15R2.562 O=c1ccocc1OCc2c[nH]cn2 34a_100000060831_100000707719 [0,1,0,0,0,0|2,0,0]=3 2031 B15R2.562 O=c1ccocc1OCc2cscn2 34a_100000060831_100000205941 [0,1,0,0,0,0|3,0,0]=4 2032 B15R2.562 O=c1occcc1OCc2c[nH]cn2 34a_100000077404_100000707719 [0,1,0,0,0,0|2,0,0]=3 2033 B15R2.562 O=c1occcc1OCc2cscn2 34a_100000077404_100000205941 [0,1,0,0,0,0|3,0,0]=4 2034 B15R2.562 O=c1occcc1OCc2cscn2 7a_100000077404_100000205941 [0,1,0,0,0,0|3,0,0]=4 2035 B15R2.562 Oc1ccccc1NCC2=NCCN2 34a_100000185747_100000737910 [0,1,0,0,0,0|2,0,1]=4 2036 B15R2.562 Oc1ccccc1NCc2c[nH]cn2 34a_100000185747_100000707719 [0,1,0,0,0,0|0,0,0]=1 2037 B15R2.562 Oc1ccccc1NCc2ccn[nH]2 34a_100000185747_100000728653 [0,1,0,0,0,0|2,0,1]=4 2038 B15R2.562 Oc1ccccc1NCc2ccon2 34a_100000185747_100000234950 [0,1,0,0,0,0|2,0,0]=3 2039 B15R2.562 Oc1ccccc1NCc2ccsc2 34a_100000185747_100011261437 [0,1,0,0,0,0|2,0,0]=3 2040 B15R2.562 Oc1ccccc1NCc2cncs2 34a_100000185747_100015185245 [0,1,0,0,0,0|1,0,1]=3 2041 B15R2.562 Oc1ccccc1NCc2cscn2 34a_100000185747_100000205941 [0,1,0,0,0,0|1,0,0]=2 2042 B15R2.562 Oc1ccccc1NCc2ncc[nH]2 34a_100000185747_100016991755 [0,1,0,0,0,0|2,0,0]=3 2043 B15R2.562 Oc1ccccc1NCc2ncco2 34a_100000185747_103436540062 [0,1,0,0,0,0|2,0,0]=3 2044 B15R2.562 Oc1ccccc1NCc2nccs2 34a_100000185747_100015184050 [0,1,0,0,0,0|2,0,0]=3 2045 B15R2.562 Oc1ccccc1NCc2ncon2 34a_100000185747_100000233494 [0,1,0,0,0,0|2,0,0]=3 2046 B15R2.562 Oc1ccccc1NCc2nnn[nH]2 34a_100000185747_100000765167 [0,1,0,0,0,0|2,0,1]=4 2047 B15R2.562 Oc1ccccc1NCn2cncn2 34a_100000185747_200020645497 [0,1,0,0,0,0|1,0,1]=3 2048 B15R2.562 Oc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000739446 [0,1,0,0,0,0|1,0,0]=2 2049 B15R2.562 Oc1ccccc1SCc2c[nH]cn2 62a_100000739446_100000707719 [0,1,0,0,0,0|1,0,0]=2 2050 B15R2.562 Oc1ccccc1SCc2ccon2 62a_100000234950_100000739446 [0,1,0,0,0,0|3,0,0]=4 2051 B15R2.562 Oc1ccccc1SCc2ccon2 62a_100000739446_100000234950 [0,1,0,0,0,0|3,0,0]=4 2052 B15R2.562 Oc1ccccc1SCc2ccsc2 62a_100000739446_100011233845 [0,1,0,0,0,0|3,0,0]=4 2053 B15R2.562 Oc1ccccc1SCc2ccsc2 62a_100011261437_100000739446 [0,1,0,0,0,0|3,0,0]=4 2054 B15R2.562 Oc1ccccc1SCc2cncs2 62a_100000739446_100015185245 [0,1,0,0,0,0|2,0,1]=4 2055 B15R2.562 Oc1ccccc1SCc2cncs2 62a_100015185245_100000739446 [0,1,0,0,0,0|2,0,1]=4 2056 B15R2.562 Oc1ccccc1SCc2cscn2 62a_100000205941_100000739446 [0,1,0,0,0,0|2,0,0]=3 2057 B15R2.562 Oc1ccccc1SCc2cscn2 62a_100000739446_100000205941 [0,1,0,0,0,0|2,0,0]=3 2058 B15R2.562 Oc1ccccc1SCc2ncc[nH]2 62a_100000739446_100016991755 [0,1,0,0,0,0|3,0,0]=4 2059 B15R2.562 Oc1ccccc1SCc2ncc[nH]2 62a_100016991755_100000739446 [0,1,0,0,0,0|3,0,0]=4 2060 B15R2.562 Oc1ccccc1SCc2ncco2 62a_100000739446_103436540062 [0,1,0,0,0,0|3,0,0]=4 2061 B15R2.562 Oc1ccccc1SCc2ncco2 62a_103436540062_100000739446 [0,1,0,0,0,0|3,0,0]=4 2062 B15R2.562 Oc1ccccc1SCc2nccs2 62a_100000739446_100015184050 [0,1,0,0,0,0|3,0,0]=4 2063 B15R2.562 Oc1ccccc1SCc2nccs2 62a_100015184050_100000739446 [0,1,0,0,0,0|3,0,0]=4 2064 B15R2.562 Oc1ccccc1SCc2ncon2 62a_100000233494_100000739446 [0,1,0,0,0,0|3,0,0]=4 2065 B15R2.562 Oc1ccccc1SCc2ncon2 62a_100000739446_100000233494 [0,1,0,0,0,0|3,0,0]=4 2066 B15R2.562 Oc1ccccc1SCn2cncn2 62a_100000739446_200020645497 [0,1,0,0,0,0|2,0,1]=4 2067 B15R2.562 Oc1ccccc1SCn2cncn2 62a_200020645497_100000739446 [0,1,0,0,0,0|2,0,1]=4 2068 B15R2.562 Oc1cccnc1CSc2c[nH]cn2 62a_100000756875_200020655725 [0,1,0,0,0,0|3,0,0]=4 2069 B15R2.562 Oc1cccnc1CSc2c[nH]cn2 62a_200020655725_100000756875 [0,1,0,0,0,0|3,0,0]=4 2070 B15R2.562 Oc1cccnc1SCc2c[nH]cn2 62a_100000034122_100000707719 [0,1,0,0,0,0|2,0,0]=3 2071 B15R2.562 Oc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000034122 [0,1,0,0,0,0|2,0,0]=3 2072 B15R2.562 Oc1cccnc1SCc2cscn2 62a_100000034122_100000205941 [0,1,0,0,0,0|3,0,0]=4 2073 B15R2.562 Oc1cccnc1SCc2cscn2 62a_100000205941_100000034122 [0,1,0,0,0,0|3,0,0]=4 2074 B15R2.562 Oc1cnccc1SCc2c[nH]cn2 62a_100000707719_100009817591 [0,1,0,0,0,0|2,0,0]=3 2075 B15R2.562 Oc1cnccc1SCc2c[nH]cn2 62a_100009817591_100000707719 [0,1,0,0,0,0|2,0,0]=3 2076 B15R2.562 Oc1cnccc1SCc2cscn2 62a_100000205941_100009817591 [0,1,0,0,0,0|3,0,0]=4 2077 B15R2.562 Oc1cnccc1SCc2cscn2 62a_100009817591_100000205941 [0,1,0,0,0,0|3,0,0]=4 2078 B15R2.562 Oc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000760158 [0,1,0,0,0,0|2,0,0]=3 2079 B15R2.562 Oc1ncccc1SCc2c[nH]cn2 62a_100000760158_100000707719 [0,1,0,0,0,0|2,0,0]=3 2080 B15R2.562 Oc1ncccc1SCc2cscn2 62a_100000205941_100000760158 [0,1,0,0,0,0|3,0,0]=4 2081 B15R2.562 Oc1ncccc1SCc2cscn2 62a_100000760158_100000205941 [0,1,0,0,0,0|3,0,0]=4 2082 B15R2.562 Oc1ncncc1SCc2c[nH]cn2 62a_100000707719_100000751107 [0,1,0,0,0,0|3,0,0]=4 2083 B15R2.562 Oc1ncncc1SCc2c[nH]cn2 62a_100000751107_100000707719 [0,1,0,0,0,0|3,0,0]=4 2084 B15R2.562 S=c1cc[nH]cc1SCc2c[nH]cn2 62a_100000707719_200012280681 [0,1,0,0,0,0|2,0,0]=3 2085 B15R2.562 S=c1cc[nH]cc1SCc2c[nH]cn2 62a_200012280681_100000707719 [0,1,0,0,0,0|2,0,0]=3 2086 B15R2.562 S=c1cc[nH]cc1SCc2cscn2 62a_100000205941_200012280681 [0,1,0,0,0,0|3,0,0]=4 2087 B15R2.562 S=c1cc[nH]cc1SCc2cscn2 62a_200012280681_100000205941 [0,1,0,0,0,0|3,0,0]=4 2088 B15R2.562 [O-][n+]1ccccc1OCc2cscn2 7a_100000211761_100000205941 [0,1,0,0,0,0|3,0,0]=4 2089 B15R2.562 [O-][n+]1ccccc1SCc2c[nH]cn2 62a_100000707719_200000042595 [0,1,0,0,0,0|2,0,0]=3 2090 B15R2.562 [O-][n+]1ccccc1SCc2cscn2 62a_100000205941_200000042595 [0,1,0,0,0,0|3,0,0]=4 2091 B15R2.1117 Brc1cc(ccn1)CSc2c[nH]cn2 62a_100000756875_100010243470 [0,1,0,0,0,0|3,0,0]=4 2092 B15R2.1117 Brc1cc(ccn1)CSc2c[nH]cn2 62a_100010254460_100000756875 [0,1,0,0,0,0|3,0,0]=4 2093 B15R2.1117 Brc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100009814637 [0,1,0,0,0,0|2,0,0]=3 2094 B15R2.1117 Brc1cc(ccn1)SCc2c[nH]cn2 62a_100009814637_100000707719 [0,1,0,0,0,0|2,0,0]=3 2095 B15R2.1117 Brc1cc(ccn1)SCc2cscn2 62a_100000205941_100009814637 [0,1,0,0,0,0|3,0,0]=4 2096 B15R2.1117 Brc1cc(ccn1)SCc2cscn2 62a_100009814637_100000205941 [0,1,0,0,0,0|3,0,0]=4 2097 B15R2.1117 Brc1cccc(c1)CSc2c[nH]cn2 62a_100000211773_100000756875 [0,1,0,0,0,0|2,0,0]=3 2098 B15R2.1117 Brc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000211773 [0,1,0,0,0,0|2,0,0]=3 2099 B15R2.1117 Brc1cccc(c1)CSc2c[nH]nn2 62a_100000211773_100009819707 [0,1,0,0,0,0|3,0,0]=4 2100 B15R2.1117 Brc1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100000211773 [0,1,0,0,0,0|3,0,0]=4 2101 B15R2.1117 Brc1cccc(c1)CSc2cscn2 62a_100000211773_100000751502 [0,1,0,0,0,0|3,0,0]=4 2102 B15R2.1117 Brc1cccc(c1)CSc2cscn2 62a_100000751502_100000211773 [0,1,0,0,0,0|3,0,0]=4 2103 B15R2.1117 Brc1cccc(c1)CSc2nc[nH]n2 62a_100000211773_100000761765 [0,1,0,0,0,0|3,0,0]=4 2104 B15R2.1117 Brc1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100000211773 [0,1,0,0,0,0|3,0,0]=4 2105 B15R2.1117 Brc1cccc(c1)NCC2=NCCN2 34a_100000210019_100000737910 [0,1,0,0,0,0|2,0,1]=4 2106 B15R2.1117 Brc1cccc(c1)NCc2c[nH]cn2 34a_100000210019_100000707719 [0,1,0,0,0,0|0,0,0]=1 2107 B15R2.1117 Brc1cccc(c1)NCc2cc[nH]n2 207a_100000210019_100000738523 [0,1,0,0,0,0|2,0,0]=3 2108 B15R2.1117 Brc1cccc(c1)NCc2ccco2 207a_100000210019_100000186105 [0,1,0,0,0,0|2,0,0]=3 2109 B15R2.1117 Brc1cccc(c1)NCc2ccco2 270302a_100000210019_100000186105 [0,1,0,0,0,0|2,0,0]=3 2110 B15R2.1117 Brc1cccc(c1)NCc2cccs2 207a_100000210019_100000209959 [0,1,0,0,0,0|2,0,0]=3 2111 B15R2.1117 Brc1cccc(c1)NCc2cccs2 270302a_100000210019_100000209959 [0,1,0,0,0,0|2,0,0]=3 2112 B15R2.1117 Brc1cccc(c1)NCc2ccn[nH]2 34a_100000210019_100000728653 [0,1,0,0,0,0|2,0,1]=4 2113 B15R2.1117 Brc1cccc(c1)NCc2ccoc2 207a_100000210019_100011215517 [0,1,0,0,0,0|2,0,0]=3 2114 B15R2.1117 Brc1cccc(c1)NCc2ccon2 34a_100000210019_100000234950 [0,1,0,0,0,0|2,0,0]=3 2115 B15R2.1117 Brc1cccc(c1)NCc2ccsc2 207a_100000210019_100000188534 [0,1,0,0,0,0|2,0,0]=3 2116 B15R2.1117 Brc1cccc(c1)NCc2ccsc2 270302a_100000210019_100000188534 [0,1,0,0,0,0|2,0,0]=3 2117 B15R2.1117 Brc1cccc(c1)NCc2ccsc2 34a_100000210019_100011261437 [0,1,0,0,0,0|2,0,0]=3 2118 B15R2.1117 Brc1cccc(c1)NCc2cn[nH]c2 207a_100000210019_100016992096 [0,1,0,0,0,0|2,0,0]=3 2119 B15R2.1117 Brc1cccc(c1)NCc2cn[nH]c2 270302a_100000210019_100016992096 [0,1,0,0,0,0|2,0,0]=3 2120 B15R2.1117 Brc1cccc(c1)NCc2cnc[nH]2 207a_100000210019_100000742939 [0,1,0,0,0,0|0,0,2]=3 2121 B15R2.1117 Brc1cccc(c1)NCc2cncs2 207a_100000210019_100000749870 [0,1,0,0,0,0|1,0,1]=3 2122 B15R2.1117 Brc1cccc(c1)NCc2cncs2 270302a_100000210019_100000749870 [0,1,0,0,0,0|1,0,1]=3 2123 B15R2.1117 Brc1cccc(c1)NCc2cncs2 34a_100000210019_100015185245 [0,1,0,0,0,0|1,0,1]=3 2124 B15R2.1117 Brc1cccc(c1)NCc2cscn2 207a_100000210019_100000743575 [0,1,0,0,0,0|1,0,0]=2 2125 B15R2.1117 Brc1cccc(c1)NCc2cscn2 270302a_100000210019_100000743575 [0,1,0,0,0,0|1,0,0]=2 2126 B15R2.1117 Brc1cccc(c1)NCc2cscn2 34a_100000210019_100000205941 [0,1,0,0,0,0|1,0,0]=2 2127 B15R2.1117 Brc1cccc(c1)NCc2ncc[nH]2 207a_100000210019_100000743867 [0,1,0,0,0,0|2,0,0]=3 2128 B15R2.1117 Brc1cccc(c1)NCc2ncc[nH]2 34a_100000210019_100016991755 [0,1,0,0,0,0|2,0,0]=3 2129 B15R2.1117 Brc1cccc(c1)NCc2ncco2 34a_100000210019_103436540062 [0,1,0,0,0,0|2,0,0]=3 2130 B15R2.1117 Brc1cccc(c1)NCc2nccs2 207a_100000210019_100000750902 [0,1,0,0,0,0|2,0,0]=3 2131 B15R2.1117 Brc1cccc(c1)NCc2nccs2 270302a_100000210019_100000750902 [0,1,0,0,0,0|2,0,0]=3 2132 B15R2.1117 Brc1cccc(c1)NCc2nccs2 34a_100000210019_100015184050 [0,1,0,0,0,0|2,0,0]=3 2133 B15R2.1117 Brc1cccc(c1)NCc2ncon2 34a_100000210019_100000233494 [0,1,0,0,0,0|2,0,0]=3 2134 B15R2.1117 Brc1cccc(c1)NCc2nnn[nH]2 34a_100000210019_100000765167 [0,1,0,0,0,0|2,0,1]=4 2135 B15R2.1117 Brc1cccc(c1)NCn2cncn2 34a_100000210019_200020645497 [0,1,0,0,0,0|1,0,1]=3 2136 B15R2.1117 Brc1cccc(c1)OCc2c[nH]cn2 34a_100000210342_100000707719 [0,1,0,0,0,0|1,0,0]=2 2137 B15R2.1117 Brc1cccc(c1)OCc2ccon2 34a_100000210342_100000234950 [0,1,0,0,0,0|3,0,0]=4 2138 B15R2.1117 Brc1cccc(c1)OCc2ccon2 7a_100000210342_100000234950 [0,1,0,0,0,0|3,0,0]=4 2139 B15R2.1117 Brc1cccc(c1)OCc2ccsc2 34a_100000210342_100011261437 [0,1,0,0,0,0|3,0,0]=4 2140 B15R2.1117 Brc1cccc(c1)OCc2ccsc2 7a_100000210342_100011261437 [0,1,0,0,0,0|3,0,0]=4 2141 B15R2.1117 Brc1cccc(c1)OCc2cncs2 34a_100000210342_100015185245 [0,1,0,0,0,0|2,0,1]=4 2142 B15R2.1117 Brc1cccc(c1)OCc2cncs2 7a_100000210342_100015185245 [0,1,0,0,0,0|2,0,1]=4 2143 B15R2.1117 Brc1cccc(c1)OCc2cscn2 34a_100000210342_100000205941 [0,1,0,0,0,0|2,0,0]=3 2144 B15R2.1117 Brc1cccc(c1)OCc2cscn2 7a_100000210342_100000205941 [0,1,0,0,0,0|2,0,0]=3 2145 B15R2.1117 Brc1cccc(c1)OCc2ncc[nH]2 34a_100000210342_100016991755 [0,1,0,0,0,0|3,0,0]=4 2146 B15R2.1117 Brc1cccc(c1)OCc2ncc[nH]2 7a_100000210342_100000753453 [0,1,0,0,0,0|3,0,0]=4 2147 B15R2.1117 Brc1cccc(c1)OCc2ncco2 34a_100000210342_103436540062 [0,1,0,0,0,0|3,0,0]=4 2148 B15R2.1117 Brc1cccc(c1)OCc2ncco2 7a_100000210342_103436540062 [0,1,0,0,0,0|3,0,0]=4 2149 B15R2.1117 Brc1cccc(c1)OCc2nccs2 34a_100000210342_100015184050 [0,1,0,0,0,0|3,0,0]=4 2150 B15R2.1117 Brc1cccc(c1)OCc2nccs2 7a_100000210342_100015184050 [0,1,0,0,0,0|3,0,0]=4 2151 B15R2.1117 Brc1cccc(c1)OCc2ncon2 34a_100000210342_100000233494 [0,1,0,0,0,0|3,0,0]=4 2152 B15R2.1117 Brc1cccc(c1)OCn2cncn2 34a_100000210342_200020645497 [0,1,0,0,0,0|2,0,1]=4 2153 B15R2.1117 Brc1cccc(c1)OCn2cncn2 7a_100000210342_200020645497 [0,1,0,0,0,0|2,0,1]=4 2154 B15R2.1117 Brc1cccc(c1)SCc2c[nH]cn2 62a_100000691529_100000707719 [0,1,0,0,0,0|1,0,0]=2 2155 B15R2.1117 Brc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000691529 [0,1,0,0,0,0|1,0,0]=2 2156 B15R2.1117 Brc1cccc(c1)SCc2ccon2 62a_100000234950_100000691529 [0,1,0,0,0,0|3,0,0]=4 2157 B15R2.1117 Brc1cccc(c1)SCc2ccon2 62a_100000691529_100000234950 [0,1,0,0,0,0|3,0,0]=4 2158 B15R2.1117 Brc1cccc(c1)SCc2ccsc2 62a_100000691529_100011233845 [0,1,0,0,0,0|3,0,0]=4 2159 B15R2.1117 Brc1cccc(c1)SCc2ccsc2 62a_100011261437_100000691529 [0,1,0,0,0,0|3,0,0]=4 2160 B15R2.1117 Brc1cccc(c1)SCc2cncs2 62a_100000691529_100015185245 [0,1,0,0,0,0|2,0,1]=4 2161 B15R2.1117 Brc1cccc(c1)SCc2cncs2 62a_100015185245_100000691529 [0,1,0,0,0,0|2,0,1]=4 2162 B15R2.1117 Brc1cccc(c1)SCc2cscn2 62a_100000205941_100000691529 [0,1,0,0,0,0|2,0,0]=3 2163 B15R2.1117 Brc1cccc(c1)SCc2cscn2 62a_100000691529_100000205941 [0,1,0,0,0,0|2,0,0]=3 2164 B15R2.1117 Brc1cccc(c1)SCc2ncc[nH]2 62a_100000691529_100016991755 [0,1,0,0,0,0|3,0,0]=4 2165 B15R2.1117 Brc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100000691529 [0,1,0,0,0,0|3,0,0]=4 2166 B15R2.1117 Brc1cccc(c1)SCc2ncco2 62a_100000691529_103436540062 [0,1,0,0,0,0|3,0,0]=4 2167 B15R2.1117 Brc1cccc(c1)SCc2ncco2 62a_103436540062_100000691529 [0,1,0,0,0,0|3,0,0]=4 2168 B15R2.1117 Brc1cccc(c1)SCc2nccs2 62a_100000691529_100015184050 [0,1,0,0,0,0|3,0,0]=4 2169 B15R2.1117 Brc1cccc(c1)SCc2nccs2 62a_100015184050_100000691529 [0,1,0,0,0,0|3,0,0]=4 2170 B15R2.1117 Brc1cccc(c1)SCc2ncon2 62a_100000233494_100000691529 [0,1,0,0,0,0|3,0,0]=4 2171 B15R2.1117 Brc1cccc(c1)SCc2ncon2 62a_100000691529_100000233494 [0,1,0,0,0,0|3,0,0]=4 2172 B15R2.1117 Brc1cccc(c1)SCn2cncn2 62a_100000691529_200020645497 [0,1,0,0,0,0|2,0,1]=4 2173 B15R2.1117 Brc1cccc(c1)SCn2cncn2 62a_200020645497_100000691529 [0,1,0,0,0,0|2,0,1]=4 2174 B15R2.1117 Brc1cccc(n1)CSc2c[nH]cn2 62a_100000756875_100009889011 [0,1,0,0,0,0|3,0,0]=4 2175 B15R2.1117 Brc1cccc(n1)CSc2c[nH]cn2 62a_100009889011_100000756875 [0,1,0,0,0,0|3,0,0]=4 2176 B15R2.1117 Brc1cccc(n1)SCc2c[nH]cn2 62a_100000684672_100000707719 [0,1,0,0,0,0|2,0,0]=3 2177 B15R2.1117 Brc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000684672 [0,1,0,0,0,0|2,0,0]=3 2178 B15R2.1117 Brc1cccc(n1)SCc2cscn2 62a_100000205941_100000684672 [0,1,0,0,0,0|3,0,0]=4 2179 B15R2.1117 Brc1cccc(n1)SCc2cscn2 62a_100000684672_100000205941 [0,1,0,0,0,0|3,0,0]=4 2180 B15R2.1117 Brc1ccnc(c1)CSc2c[nH]cn2 62a_100000756875_100010173614 [0,1,0,0,0,0|3,0,0]=4 2181 B15R2.1117 Brc1ccnc(c1)CSc2c[nH]cn2 62a_100010173614_100000756875 [0,1,0,0,0,0|3,0,0]=4 2182 B15R2.1117 Brc1cncc(c1)CSc2c[nH]cn2 62a_100000738771_100000756875 [0,1,0,0,0,0|3,0,0]=4 2183 B15R2.1117 Brc1cncc(c1)CSc2c[nH]cn2 62a_100000756875_100000738771 [0,1,0,0,0,0|3,0,0]=4 2184 B15R2.1117 Brc1cncc(c1)OCc2c[nH]cn2 34a_100000754920_100000707719 [0,1,0,0,0,0|2,0,0]=3 2185 B15R2.1117 Brc1cncc(c1)OCc2cscn2 34a_100000754920_100000205941 [0,1,0,0,0,0|3,0,0]=4 2186 B15R2.1117 Brc1cncc(c1)OCc2cscn2 7a_100000754920_100000205941 [0,1,0,0,0,0|3,0,0]=4 2187 B15R2.1117 Brc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000728054 [0,1,0,0,0,0|2,0,0]=3 2188 B15R2.1117 Brc1cncc(c1)SCc2c[nH]cn2 62a_100000728054_100000707719 [0,1,0,0,0,0|2,0,0]=3 2189 B15R2.1117 Brc1cncc(c1)SCc2cscn2 62a_100000205941_100000728054 [0,1,0,0,0,0|3,0,0]=4 2190 B15R2.1117 Brc1cncc(c1)SCc2cscn2 62a_100000728054_100000205941 [0,1,0,0,0,0|3,0,0]=4 2191 B15R2.1117 C[n+]1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100009996589 [0,1,0,0,0,0|2,0,0]=3 2192 B15R2.1117 C[n+]1cccc(c1)SCc2c[nH]cn2 62a_100009996589_100000707719 [0,1,0,0,0,0|2,0,0]=3 2193 B15R2.1117 C[n+]1cccc(c1)SCc2cscn2 62a_100000205941_100009996589 [0,1,0,0,0,0|3,0,0]=4 2194 B15R2.1117 C[n+]1cccc(c1)SCc2cscn2 62a_100009996589_100000205941 [0,1,0,0,0,0|3,0,0]=4 2195 B15R2.1117 Cc1cc(ccn1)CSc2c[nH]cn2 62a_100000756875_200020672517 [0,1,0,0,0,0|3,0,0]=4 2196 B15R2.1117 Cc1cc(ccn1)CSc2c[nH]cn2 62a_200020672517_100000756875 [0,1,0,0,0,0|3,0,0]=4 2197 B15R2.1117 Cc1cc(ccn1)NCc2c[nH]cn2 27a_100000758547_100000758586 [0,1,0,0,0,0|1,0,0]=2 2198 B15R2.1117 Cc1cc(ccn1)NCc2c[nH]nn2 27a_100020620823_100000758586 [0,1,0,0,0,0|2,0,0]=3 2199 B15R2.1117 Cc1cc(ccn1)NCc2cc[nH]n2 27a_100000739516_100000758586 [0,1,0,0,0,0|3,0,0]=4 2200 B15R2.1117 Cc1cc(ccn1)NCc2ccco2 27a_100000185738_100000758586 [0,1,0,0,0,0|3,0,0]=4 2201 B15R2.1117 Cc1cc(ccn1)NCc2cccs2 27a_100000211653_100000758586 [0,1,0,0,0,0|3,0,0]=4 2202 B15R2.1117 Cc1cc(ccn1)NCc2ccoc2 27a_100015206860_100000758586 [0,1,0,0,0,0|3,0,0]=4 2203 B15R2.1117 Cc1cc(ccn1)NCc2ccon2 27a_100000688301_100000758586 [0,1,0,0,0,0|3,0,0]=4 2204 B15R2.1117 Cc1cc(ccn1)NCc2ccsc2 27a_100000186416_100000758586 [0,1,0,0,0,0|3,0,0]=4 2205 B15R2.1117 Cc1cc(ccn1)NCc2cn[nH]c2 27a_100000737208_100000758586 [0,1,0,0,0,0|3,0,0]=4 2206 B15R2.1117 Cc1cc(ccn1)NCc2cnco2 27a_100020634212_100000758586 [0,1,0,0,0,0|2,0,1]=4 2207 B15R2.1117 Cc1cc(ccn1)NCc2cncs2 27a_100016987365_100000758586 [0,1,0,0,0,0|2,0,1]=4 2208 B15R2.1117 Cc1cc(ccn1)NCc2cocn2 27a_100015188801_100000758586 [0,1,0,0,0,0|2,0,0]=3 2209 B15R2.1117 Cc1cc(ccn1)NCc2cscn2 27a_100015185402_100000758586 [0,1,0,0,0,0|2,0,0]=3 2210 B15R2.1117 Cc1cc(ccn1)NCc2ncc[nH]2 27a_100000754540_100000758586 [0,1,0,0,0,0|3,0,0]=4 2211 B15R2.1117 Cc1cc(ccn1)NCc2ncco2 27a_100016994969_100000758586 [0,1,0,0,0,0|3,0,0]=4 2212 B15R2.1117 Cc1cc(ccn1)NCc2nccs2 27a_100000740555_100000758586 [0,1,0,0,0,0|3,0,0]=4 2213 B15R2.1117 Cc1cc(ccn1)OCc2c[nH]cn2 34a_100000688365_100000707719 [0,1,0,0,0,0|2,0,0]=3 2214 B15R2.1117 Cc1cc(ccn1)OCc2cscn2 34a_100000688365_100000205941 [0,1,0,0,0,0|3,0,0]=4 2215 B15R2.1117 Cc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000758586 [0,1,0,0,0,0|2,0,0]=3 2216 B15R2.1117 Cc1cc(ccn1)SCc2c[nH]cn2 62a_100000758586_100000707719 [0,1,0,0,0,0|2,0,0]=3 2217 B15R2.1117 Cc1cc(ccn1)SCc2cscn2 62a_100000205941_100000758586 [0,1,0,0,0,0|3,0,0]=4 2218 B15R2.1117 Cc1cc(ccn1)SCc2cscn2 62a_100000758586_100000205941 [0,1,0,0,0,0|3,0,0]=4 2219 B15R2.1117 Cc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000744208 [0,1,0,0,0,0|2,0,0]=3 2220 B15R2.1117 Cc1cc(ncn1)NCc2c[nH]nn2 27a_100020620823_100000744208 [0,1,0,0,0,0|3,0,0]=4 2221 B15R2.1117 Cc1cc(ncn1)NCc2cocn2 27a_100015188801_100000744208 [0,1,0,0,0,0|3,0,0]=4 2222 B15R2.1117 Cc1cc(ncn1)NCc2cscn2 27a_100015185402_100000744208 [0,1,0,0,0,0|3,0,0]=4 2223 B15R2.1117 Cc1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_100000744208 [0,1,0,0,0,0|3,0,0]=4 2224 B15R2.1117 Cc1cc(ncn1)SCc2c[nH]cn2 62a_100000744208_100000707719 [0,1,0,0,0,0|3,0,0]=4 2225 B15R2.1117 Cc1cccc(c1)C=Cc2c[nH]cn2 271570a_200135466880_100000756875 [0,1,0,0,0,0|1,0,1]=3 2226 B15R2.1117 Cc1cccc(c1)C=Cc2cscn2 271570a_200135466880_100000751502 [0,1,0,0,0,0|2,0,1]=4 2227 B15R2.1117 Cc1cccc(c1)C=Cc2nc[nH]n2 271570a_200135466880_100000761765 [0,1,0,0,0,0|2,0,1]=4 2228 B15R2.1117 Cc1cccc(c1)CSc2c[nH]cn2 62a_100000211840_100000756875 [0,1,0,0,0,0|2,0,0]=3 2229 B15R2.1117 Cc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000211840 [0,1,0,0,0,0|2,0,0]=3 2230 B15R2.1117 Cc1cccc(c1)CSc2c[nH]nn2 62a_100000211840_100009819707 [0,1,0,0,0,0|3,0,0]=4 2231 B15R2.1117 Cc1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100000211840 [0,1,0,0,0,0|3,0,0]=4 2232 B15R2.1117 Cc1cccc(c1)CSc2cscn2 62a_100000211840_100000751502 [0,1,0,0,0,0|3,0,0]=4 2233 B15R2.1117 Cc1cccc(c1)CSc2cscn2 62a_100000751502_100000211840 [0,1,0,0,0,0|3,0,0]=4 2234 B15R2.1117 Cc1cccc(c1)CSc2nc[nH]n2 62a_100000211840_100000761765 [0,1,0,0,0,0|3,0,0]=4 2235 B15R2.1117 Cc1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100000211840 [0,1,0,0,0,0|3,0,0]=4 2236 B15R2.1117 Cc1cccc(c1)NCC2=NCCN2 34a_100000188690_100000737910 [0,1,0,0,0,0|2,0,1]=4 2237 B15R2.1117 Cc1cccc(c1)NCc2c[nH]cn2 2230a_100000188690_100000707719 [0,1,0,0,0,0|0,0,0]=1 2238 B15R2.1117 Cc1cccc(c1)NCc2c[nH]cn2 34a_100000188690_100000707719 [0,1,0,0,0,0|0,0,0]=1 2239 B15R2.1117 Cc1cccc(c1)NCc2cc[nH]n2 207a_100000188690_100000738523 [0,1,0,0,0,0|2,0,0]=3 2240 B15R2.1117 Cc1cccc(c1)NCc2ccco2 207a_100000188690_100000186105 [0,1,0,0,0,0|2,0,0]=3 2241 B15R2.1117 Cc1cccc(c1)NCc2ccco2 270302a_100000188690_100000186105 [0,1,0,0,0,0|2,0,0]=3 2242 B15R2.1117 Cc1cccc(c1)NCc2cccs2 207a_100000188690_100000209959 [0,1,0,0,0,0|2,0,0]=3 2243 B15R2.1117 Cc1cccc(c1)NCc2cccs2 270302a_100000188690_100000209959 [0,1,0,0,0,0|2,0,0]=3 2244 B15R2.1117 Cc1cccc(c1)NCc2ccn[nH]2 2230a_100000188690_100000728653 [0,1,0,0,0,0|2,0,1]=4 2245 B15R2.1117 Cc1cccc(c1)NCc2ccn[nH]2 34a_100000188690_100000728653 [0,1,0,0,0,0|2,0,1]=4 2246 B15R2.1117 Cc1cccc(c1)NCc2ccoc2 207a_100000188690_100011215517 [0,1,0,0,0,0|2,0,0]=3 2247 B15R2.1117 Cc1cccc(c1)NCc2ccon2 2230a_100000188690_100000234950 [0,1,0,0,0,0|2,0,0]=3 2248 B15R2.1117 Cc1cccc(c1)NCc2ccon2 34a_100000188690_100000234950 [0,1,0,0,0,0|2,0,0]=3 2249 B15R2.1117 Cc1cccc(c1)NCc2ccsc2 207a_100000188690_100000188534 [0,1,0,0,0,0|2,0,0]=3 2250 B15R2.1117 Cc1cccc(c1)NCc2ccsc2 2230a_100000188690_100011261437 [0,1,0,0,0,0|2,0,0]=3 2251 B15R2.1117 Cc1cccc(c1)NCc2ccsc2 270302a_100000188690_100000188534 [0,1,0,0,0,0|2,0,0]=3 2252 B15R2.1117 Cc1cccc(c1)NCc2ccsc2 34a_100000188690_100011261437 [0,1,0,0,0,0|2,0,0]=3 2253 B15R2.1117 Cc1cccc(c1)NCc2cn[nH]c2 207a_100000188690_100016992096 [0,1,0,0,0,0|2,0,0]=3 2254 B15R2.1117 Cc1cccc(c1)NCc2cn[nH]c2 270302a_100000188690_100016992096 [0,1,0,0,0,0|2,0,0]=3 2255 B15R2.1117 Cc1cccc(c1)NCc2cnc[nH]2 207a_100000188690_100000742939 [0,1,0,0,0,0|0,0,2]=3 2256 B15R2.1117 Cc1cccc(c1)NCc2cncs2 207a_100000188690_100000749870 [0,1,0,0,0,0|1,0,1]=3 2257 B15R2.1117 Cc1cccc(c1)NCc2cncs2 2230a_100000188690_100015185245 [0,1,0,0,0,0|1,0,1]=3 2258 B15R2.1117 Cc1cccc(c1)NCc2cncs2 270302a_100000188690_100000749870 [0,1,0,0,0,0|1,0,1]=3 2259 B15R2.1117 Cc1cccc(c1)NCc2cncs2 34a_100000188690_100015185245 [0,1,0,0,0,0|1,0,1]=3 2260 B15R2.1117 Cc1cccc(c1)NCc2cscn2 207a_100000188690_100000743575 [0,1,0,0,0,0|1,0,0]=2 2261 B15R2.1117 Cc1cccc(c1)NCc2cscn2 2230a_100000188690_100000205941 [0,1,0,0,0,0|1,0,0]=2 2262 B15R2.1117 Cc1cccc(c1)NCc2cscn2 270302a_100000188690_100000743575 [0,1,0,0,0,0|1,0,0]=2 2263 B15R2.1117 Cc1cccc(c1)NCc2cscn2 34a_100000188690_100000205941 [0,1,0,0,0,0|1,0,0]=2 2264 B15R2.1117 Cc1cccc(c1)NCc2ncc[nH]2 207a_100000188690_100000743867 [0,1,0,0,0,0|2,0,0]=3 2265 B15R2.1117 Cc1cccc(c1)NCc2ncc[nH]2 2230a_100000188690_100016991755 [0,1,0,0,0,0|2,0,0]=3 2266 B15R2.1117 Cc1cccc(c1)NCc2ncc[nH]2 34a_100000188690_100016991755 [0,1,0,0,0,0|2,0,0]=3 2267 B15R2.1117 Cc1cccc(c1)NCc2ncco2 2230a_100000188690_103436540062 [0,1,0,0,0,0|2,0,0]=3 2268 B15R2.1117 Cc1cccc(c1)NCc2ncco2 34a_100000188690_103436540062 [0,1,0,0,0,0|2,0,0]=3 2269 B15R2.1117 Cc1cccc(c1)NCc2nccs2 207a_100000188690_100000750902 [0,1,0,0,0,0|2,0,0]=3 2270 B15R2.1117 Cc1cccc(c1)NCc2nccs2 2230a_100000188690_100015184050 [0,1,0,0,0,0|2,0,0]=3 2271 B15R2.1117 Cc1cccc(c1)NCc2nccs2 270302a_100000188690_100000750902 [0,1,0,0,0,0|2,0,0]=3 2272 B15R2.1117 Cc1cccc(c1)NCc2nccs2 34a_100000188690_100015184050 [0,1,0,0,0,0|2,0,0]=3 2273 B15R2.1117 Cc1cccc(c1)NCc2ncon2 34a_100000188690_100000233494 [0,1,0,0,0,0|2,0,0]=3 2274 B15R2.1117 Cc1cccc(c1)NCc2nnn[nH]2 34a_100000188690_100000765167 [0,1,0,0,0,0|2,0,1]=4 2275 B15R2.1117 Cc1cccc(c1)NCn2cncn2 2230a_100000188690_200020645497 [0,1,0,0,0,0|1,0,1]=3 2276 B15R2.1117 Cc1cccc(c1)NCn2cncn2 34a_100000188690_200020645497 [0,1,0,0,0,0|1,0,1]=3 2277 B15R2.1117 Cc1cccc(c1)OCc2c[nH]cn2 34a_100000210337_100000707719 [0,1,0,0,0,0|1,0,0]=2 2278 B15R2.1117 Cc1cccc(c1)OCc2ccon2 34a_100000210337_100000234950 [0,1,0,0,0,0|3,0,0]=4 2279 B15R2.1117 Cc1cccc(c1)OCc2ccon2 7a_100000210337_100000234950 [0,1,0,0,0,0|3,0,0]=4 2280 B15R2.1117 Cc1cccc(c1)OCc2ccsc2 34a_100000210337_100011261437 [0,1,0,0,0,0|3,0,0]=4 2281 B15R2.1117 Cc1cccc(c1)OCc2ccsc2 7a_100000210337_100011261437 [0,1,0,0,0,0|3,0,0]=4 2282 B15R2.1117 Cc1cccc(c1)OCc2cncs2 34a_100000210337_100015185245 [0,1,0,0,0,0|2,0,1]=4 2283 B15R2.1117 Cc1cccc(c1)OCc2cncs2 7a_100000210337_100015185245 [0,1,0,0,0,0|2,0,1]=4 2284 B15R2.1117 Cc1cccc(c1)OCc2cscn2 34a_100000210337_100000205941 [0,1,0,0,0,0|2,0,0]=3 2285 B15R2.1117 Cc1cccc(c1)OCc2cscn2 7a_100000210337_100000205941 [0,1,0,0,0,0|2,0,0]=3 2286 B15R2.1117 Cc1cccc(c1)OCc2ncc[nH]2 34a_100000210337_100016991755 [0,1,0,0,0,0|3,0,0]=4 2287 B15R2.1117 Cc1cccc(c1)OCc2ncc[nH]2 7a_100000210337_100000753453 [0,1,0,0,0,0|3,0,0]=4 2288 B15R2.1117 Cc1cccc(c1)OCc2ncco2 34a_100000210337_103436540062 [0,1,0,0,0,0|3,0,0]=4 2289 B15R2.1117 Cc1cccc(c1)OCc2ncco2 7a_100000210337_103436540062 [0,1,0,0,0,0|3,0,0]=4 2290 B15R2.1117 Cc1cccc(c1)OCc2nccs2 34a_100000210337_100015184050 [0,1,0,0,0,0|3,0,0]=4 2291 B15R2.1117 Cc1cccc(c1)OCc2nccs2 7a_100000210337_100015184050 [0,1,0,0,0,0|3,0,0]=4 2292 B15R2.1117 Cc1cccc(c1)OCc2ncon2 34a_100000210337_100000233494 [0,1,0,0,0,0|3,0,0]=4 2293 B15R2.1117 Cc1cccc(c1)OCn2cncn2 34a_100000210337_200020645497 [0,1,0,0,0,0|2,0,1]=4 2294 B15R2.1117 Cc1cccc(c1)OCn2cncn2 7a_100000210337_200020645497 [0,1,0,0,0,0|2,0,1]=4 2295 B15R2.1117 Cc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100011215228 [0,1,0,0,0,0|1,0,0]=2 2296 B15R2.1117 Cc1cccc(c1)SCc2c[nH]cn2 62a_100011215228_100000707719 [0,1,0,0,0,0|1,0,0]=2 2297 B15R2.1117 Cc1cccc(c1)SCc2ccon2 62a_100000234950_100011215228 [0,1,0,0,0,0|3,0,0]=4 2298 B15R2.1117 Cc1cccc(c1)SCc2ccon2 62a_100011215228_100000234950 [0,1,0,0,0,0|3,0,0]=4 2299 B15R2.1117 Cc1cccc(c1)SCc2ccsc2 62a_100011215228_100011233845 [0,1,0,0,0,0|3,0,0]=4 2300 B15R2.1117 Cc1cccc(c1)SCc2ccsc2 62a_100011261437_100011215228 [0,1,0,0,0,0|3,0,0]=4 2301 B15R2.1117 Cc1cccc(c1)SCc2cncs2 62a_100011215228_100015185245 [0,1,0,0,0,0|2,0,1]=4 2302 B15R2.1117 Cc1cccc(c1)SCc2cncs2 62a_100015185245_100011215228 [0,1,0,0,0,0|2,0,1]=4 2303 B15R2.1117 Cc1cccc(c1)SCc2cscn2 62a_100000205941_100011215228 [0,1,0,0,0,0|2,0,0]=3 2304 B15R2.1117 Cc1cccc(c1)SCc2cscn2 62a_100011215228_100000205941 [0,1,0,0,0,0|2,0,0]=3 2305 B15R2.1117 Cc1cccc(c1)SCc2ncc[nH]2 62a_100011215228_100016991755 [0,1,0,0,0,0|3,0,0]=4 2306 B15R2.1117 Cc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100011215228 [0,1,0,0,0,0|3,0,0]=4 2307 B15R2.1117 Cc1cccc(c1)SCc2ncco2 62a_100011215228_103436540062 [0,1,0,0,0,0|3,0,0]=4 2308 B15R2.1117 Cc1cccc(c1)SCc2ncco2 62a_103436540062_100011215228 [0,1,0,0,0,0|3,0,0]=4 2309 B15R2.1117 Cc1cccc(c1)SCc2nccs2 62a_100011215228_100015184050 [0,1,0,0,0,0|3,0,0]=4 2310 B15R2.1117 Cc1cccc(c1)SCc2nccs2 62a_100015184050_100011215228 [0,1,0,0,0,0|3,0,0]=4 2311 B15R2.1117 Cc1cccc(c1)SCc2ncon2 62a_100000233494_100011215228 [0,1,0,0,0,0|3,0,0]=4 2312 B15R2.1117 Cc1cccc(c1)SCc2ncon2 62a_100011215228_100000233494 [0,1,0,0,0,0|3,0,0]=4 2313 B15R2.1117 Cc1cccc(c1)SCn2cncn2 62a_100011215228_200020645497 [0,1,0,0,0,0|2,0,1]=4 2314 B15R2.1117 Cc1cccc(c1)SCn2cncn2 62a_200020645497_100011215228 [0,1,0,0,0,0|2,0,1]=4 2315 B15R2.1117 Cc1cccc(n1)CSc2c[nH]cn2 62a_100000756875_100000757606 [0,1,0,0,0,0|3,0,0]=4 2316 B15R2.1117 Cc1cccc(n1)CSc2c[nH]cn2 62a_100000757606_100000756875 [0,1,0,0,0,0|3,0,0]=4 2317 B15R2.1117 Cc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000742759 [0,1,0,0,0,0|2,0,0]=3 2318 B15R2.1117 Cc1cccc(n1)SCc2c[nH]cn2 62a_100000742759_100000707719 [0,1,0,0,0,0|2,0,0]=3 2319 B15R2.1117 Cc1cccc(n1)SCc2cscn2 62a_100000205941_100000742759 [0,1,0,0,0,0|3,0,0]=4 2320 B15R2.1117 Cc1cccc(n1)SCc2cscn2 62a_100000742759_100000205941 [0,1,0,0,0,0|3,0,0]=4 2321 B15R2.1117 Cc1ccnc(c1)CSc2c[nH]cn2 62a_100000718516_100000756875 [0,1,0,0,0,0|3,0,0]=4 2322 B15R2.1117 Cc1ccnc(c1)CSc2c[nH]cn2 62a_100000756875_100000718516 [0,1,0,0,0,0|3,0,0]=4 2323 B15R2.1117 Cc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100000750283 [0,1,0,0,0,0|2,0,0]=3 2324 B15R2.1117 Cc1ccnc(c1)SCc2c[nH]cn2 62a_100000750283_100000707719 [0,1,0,0,0,0|2,0,0]=3 2325 B15R2.1117 Cc1ccnc(c1)SCc2cscn2 62a_100000205941_100000750283 [0,1,0,0,0,0|3,0,0]=4 2326 B15R2.1117 Cc1ccnc(c1)SCc2cscn2 62a_100000750283_100000205941 [0,1,0,0,0,0|3,0,0]=4 2327 B15R2.1117 Cc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100000750684 [0,1,0,0,0,0|2,0,0]=3 2328 B15R2.1117 Cc1ccnc(n1)NCc2c[nH]nn2 27a_100020620823_100000750684 [0,1,0,0,0,0|3,0,0]=4 2329 B15R2.1117 Cc1ccnc(n1)NCc2cocn2 27a_100015188801_100000750684 [0,1,0,0,0,0|3,0,0]=4 2330 B15R2.1117 Cc1ccnc(n1)NCc2cscn2 27a_100015185402_100000750684 [0,1,0,0,0,0|3,0,0]=4 2331 B15R2.1117 Cc1ccnc(n1)SCc2c[nH]cn2 62a_100000707719_100011243806 [0,1,0,0,0,0|3,0,0]=4 2332 B15R2.1117 Cc1ccnc(n1)SCc2c[nH]cn2 62a_100011243806_100000707719 [0,1,0,0,0,0|3,0,0]=4 2333 B15R2.1117 Cc1cncc(c1)CSc2c[nH]cn2 62a_100000716715_100000756875 [0,1,0,0,0,0|3,0,0]=4 2334 B15R2.1117 Cc1cncc(c1)CSc2c[nH]cn2 62a_100000756875_100000716715 [0,1,0,0,0,0|3,0,0]=4 2335 B15R2.1117 Cc1cncc(c1)OCc2c[nH]cn2 34a_100011830280_100000707719 [0,1,0,0,0,0|2,0,0]=3 2336 B15R2.1117 Cc1cncc(c1)OCc2cscn2 34a_100011830280_100000205941 [0,1,0,0,0,0|3,0,0]=4 2337 B15R2.1117 Cc1cncc(c1)OCc2cscn2 7a_100011830280_100000205941 [0,1,0,0,0,0|3,0,0]=4 2338 B15R2.1117 Cc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000760492 [0,1,0,0,0,0|2,0,0]=3 2339 B15R2.1117 Cc1cncc(c1)SCc2c[nH]cn2 62a_100000760492_100000707719 [0,1,0,0,0,0|2,0,0]=3 2340 B15R2.1117 Cc1cncc(c1)SCc2cscn2 62a_100000205941_100000760492 [0,1,0,0,0,0|3,0,0]=4 2341 B15R2.1117 Cc1cncc(c1)SCc2cscn2 62a_100000760492_100000205941 [0,1,0,0,0,0|3,0,0]=4 2342 B15R2.1117 Cc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_100000754123 [0,1,0,0,0,0|2,0,0]=3 2343 B15R2.1117 Cc1cncc(n1)NCc2c[nH]nn2 27a_100020620823_100000754123 [0,1,0,0,0,0|3,0,0]=4 2344 B15R2.1117 Cc1cncc(n1)NCc2cocn2 27a_100015188801_100000754123 [0,1,0,0,0,0|3,0,0]=4 2345 B15R2.1117 Cc1cncc(n1)NCc2cscn2 27a_100015185402_100000754123 [0,1,0,0,0,0|3,0,0]=4 2346 B15R2.1117 Cc1cncc(n1)SCc2c[nH]cn2 62a_100000707719_100000754123 [0,1,0,0,0,0|3,0,0]=4 2347 B15R2.1117 Cc1cncc(n1)SCc2c[nH]cn2 62a_100000754123_100000707719 [0,1,0,0,0,0|3,0,0]=4 2348 B15R2.1117 Cc1cnnc(c1)NCc2c[nH]cn2 27a_100000758547_100000070100 [0,1,0,0,0,0|2,0,0]=3 2349 B15R2.1117 Cc1cnnc(c1)NCc2c[nH]nn2 27a_100020620823_100000070100 [0,1,0,0,0,0|3,0,0]=4 2350 B15R2.1117 Cc1cnnc(c1)NCc2cocn2 27a_100015188801_100000070100 [0,1,0,0,0,0|3,0,0]=4 2351 B15R2.1117 Cc1cnnc(c1)NCc2cscn2 27a_100015185402_100000070100 [0,1,0,0,0,0|3,0,0]=4 2352 B15R2.1117 Cc1cnnc(c1)OCc2c[nH]cn2 34a_100000766097_100000707719 [0,1,0,0,0,0|3,0,0]=4 2353 B15R2.1117 Cc1cnnc(c1)SCc2c[nH]cn2 62a_100000070100_100000707719 [0,1,0,0,0,0|3,0,0]=4 2354 B15R2.1117 Cc1cnnc(c1)SCc2c[nH]cn2 62a_100000707719_100000070100 [0,1,0,0,0,0|3,0,0]=4 2355 B15R2.1117 Cc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100000749937 [0,1,0,0,0,0|2,0,0]=3 2356 B15R2.1117 Cc1nccc(n1)NCc2c[nH]nn2 27a_100020620823_100000749937 [0,1,0,0,0,0|3,0,0]=4 2357 B15R2.1117 Cc1nccc(n1)NCc2cocn2 27a_100015188801_100000749937 [0,1,0,0,0,0|3,0,0]=4 2358 B15R2.1117 Cc1nccc(n1)NCc2cscn2 27a_100015185402_100000749937 [0,1,0,0,0,0|3,0,0]=4 2359 B15R2.1117 Cc1nccc(n1)SCc2c[nH]cn2 62a_100000707719_100000749937 [0,1,0,0,0,0|3,0,0]=4 2360 B15R2.1117 Cc1nccc(n1)SCc2c[nH]cn2 62a_100000749937_100000707719 [0,1,0,0,0,0|3,0,0]=4 2361 B15R2.1117 Clc1cc(ccn1)CSc2c[nH]cn2 62a_100000756875_100000764220 [0,1,0,0,0,0|3,0,0]=4 2362 B15R2.1117 Clc1cc(ccn1)CSc2c[nH]cn2 62a_100000764220_100000756875 [0,1,0,0,0,0|3,0,0]=4 2363 B15R2.1117 Clc1cc(ccn1)OCc2c[nH]cn2 34a_100000762945_100000707719 [0,1,0,0,0,0|2,0,0]=3 2364 B15R2.1117 Clc1cc(ccn1)OCc2cscn2 34a_100000762945_100000205941 [0,1,0,0,0,0|3,0,0]=4 2365 B15R2.1117 Clc1cc(ccn1)SCc2c[nH]cn2 62a_100000035001_100000707719 [0,1,0,0,0,0|2,0,0]=3 2366 B15R2.1117 Clc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000035001 [0,1,0,0,0,0|2,0,0]=3 2367 B15R2.1117 Clc1cc(ccn1)SCc2cscn2 62a_100000035001_100000205941 [0,1,0,0,0,0|3,0,0]=4 2368 B15R2.1117 Clc1cc(ccn1)SCc2cscn2 62a_100000205941_100000035001 [0,1,0,0,0,0|3,0,0]=4 2369 B15R2.1117 Clc1cc(cnn1)OCc2c[nH]cn2 34a_200010734679_100000707719 [0,1,0,0,0,0|3,0,0]=4 2370 B15R2.1117 Clc1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_100010161198 [0,1,0,0,0,0|3,0,0]=4 2371 B15R2.1117 Clc1cc(ncn1)SCc2c[nH]cn2 62a_100010161198_100000707719 [0,1,0,0,0,0|3,0,0]=4 2372 B15R2.1117 Clc1cccc(c1)C=Cc2c[nH]cn2 271570a_100102525933_100000756875 [0,1,0,0,0,0|1,0,1]=3 2373 B15R2.1117 Clc1cccc(c1)C=Cc2cscn2 271570a_100102525933_100000751502 [0,1,0,0,0,0|2,0,1]=4 2374 B15R2.1117 Clc1cccc(c1)C=Cc2nc[nH]n2 271570a_100102525933_100000761765 [0,1,0,0,0,0|2,0,1]=4 2375 B15R2.1117 Clc1cccc(c1)CSc2c[nH]cn2 62a_100000187163_100000756875 [0,1,0,0,0,0|2,0,0]=3 2376 B15R2.1117 Clc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000187163 [0,1,0,0,0,0|2,0,0]=3 2377 B15R2.1117 Clc1cccc(c1)CSc2c[nH]nn2 62a_100000187163_100009819707 [0,1,0,0,0,0|3,0,0]=4 2378 B15R2.1117 Clc1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100000187163 [0,1,0,0,0,0|3,0,0]=4 2379 B15R2.1117 Clc1cccc(c1)CSc2cscn2 62a_100000187163_100000751502 [0,1,0,0,0,0|3,0,0]=4 2380 B15R2.1117 Clc1cccc(c1)CSc2cscn2 62a_100000751502_100000187163 [0,1,0,0,0,0|3,0,0]=4 2381 B15R2.1117 Clc1cccc(c1)CSc2nc[nH]n2 62a_100000187163_100000761765 [0,1,0,0,0,0|3,0,0]=4 2382 B15R2.1117 Clc1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100000187163 [0,1,0,0,0,0|3,0,0]=4 2383 B15R2.1117 Clc1cccc(c1)NCC2=NCCN2 34a_100000185859_100000737910 [0,1,0,0,0,0|2,0,1]=4 2384 B15R2.1117 Clc1cccc(c1)NCc2c[nH]cn2 34a_100000185859_100000707719 [0,1,0,0,0,0|0,0,0]=1 2385 B15R2.1117 Clc1cccc(c1)NCc2cc[nH]n2 207a_100000185859_100000738523 [0,1,0,0,0,0|2,0,0]=3 2386 B15R2.1117 Clc1cccc(c1)NCc2ccco2 207a_100000185859_100000186105 [0,1,0,0,0,0|2,0,0]=3 2387 B15R2.1117 Clc1cccc(c1)NCc2ccco2 270302a_100000185859_100000186105 [0,1,0,0,0,0|2,0,0]=3 2388 B15R2.1117 Clc1cccc(c1)NCc2cccs2 207a_100000185859_100000209959 [0,1,0,0,0,0|2,0,0]=3 2389 B15R2.1117 Clc1cccc(c1)NCc2cccs2 270302a_100000185859_100000209959 [0,1,0,0,0,0|2,0,0]=3 2390 B15R2.1117 Clc1cccc(c1)NCc2ccn[nH]2 34a_100000185859_100000728653 [0,1,0,0,0,0|2,0,1]=4 2391 B15R2.1117 Clc1cccc(c1)NCc2ccoc2 207a_100000185859_100011215517 [0,1,0,0,0,0|2,0,0]=3 2392 B15R2.1117 Clc1cccc(c1)NCc2ccon2 34a_100000185859_100000234950 [0,1,0,0,0,0|2,0,0]=3 2393 B15R2.1117 Clc1cccc(c1)NCc2ccsc2 207a_100000185859_100000188534 [0,1,0,0,0,0|2,0,0]=3 2394 B15R2.1117 Clc1cccc(c1)NCc2ccsc2 270302a_100000185859_100000188534 [0,1,0,0,0,0|2,0,0]=3 2395 B15R2.1117 Clc1cccc(c1)NCc2ccsc2 34a_100000185859_100011261437 [0,1,0,0,0,0|2,0,0]=3 2396 B15R2.1117 Clc1cccc(c1)NCc2cn[nH]c2 207a_100000185859_100016992096 [0,1,0,0,0,0|2,0,0]=3 2397 B15R2.1117 Clc1cccc(c1)NCc2cn[nH]c2 270302a_100000185859_100016992096 [0,1,0,0,0,0|2,0,0]=3 2398 B15R2.1117 Clc1cccc(c1)NCc2cnc[nH]2 207a_100000185859_100000742939 [0,1,0,0,0,0|0,0,2]=3 2399 B15R2.1117 Clc1cccc(c1)NCc2cncs2 207a_100000185859_100000749870 [0,1,0,0,0,0|1,0,1]=3 2400 B15R2.1117 Clc1cccc(c1)NCc2cncs2 270302a_100000185859_100000749870 [0,1,0,0,0,0|1,0,1]=3 2401 B15R2.1117 Clc1cccc(c1)NCc2cncs2 34a_100000185859_100015185245 [0,1,0,0,0,0|1,0,1]=3 2402 B15R2.1117 Clc1cccc(c1)NCc2cscn2 207a_100000185859_100000743575 [0,1,0,0,0,0|1,0,0]=2 2403 B15R2.1117 Clc1cccc(c1)NCc2cscn2 270302a_100000185859_100000743575 [0,1,0,0,0,0|1,0,0]=2 2404 B15R2.1117 Clc1cccc(c1)NCc2cscn2 34a_100000185859_100000205941 [0,1,0,0,0,0|1,0,0]=2 2405 B15R2.1117 Clc1cccc(c1)NCc2ncc[nH]2 207a_100000185859_100000743867 [0,1,0,0,0,0|2,0,0]=3 2406 B15R2.1117 Clc1cccc(c1)NCc2ncc[nH]2 34a_100000185859_100016991755 [0,1,0,0,0,0|2,0,0]=3 2407 B15R2.1117 Clc1cccc(c1)NCc2ncco2 34a_100000185859_103436540062 [0,1,0,0,0,0|2,0,0]=3 2408 B15R2.1117 Clc1cccc(c1)NCc2nccs2 207a_100000185859_100000750902 [0,1,0,0,0,0|2,0,0]=3 2409 B15R2.1117 Clc1cccc(c1)NCc2nccs2 270302a_100000185859_100000750902 [0,1,0,0,0,0|2,0,0]=3 2410 B15R2.1117 Clc1cccc(c1)NCc2nccs2 34a_100000185859_100015184050 [0,1,0,0,0,0|2,0,0]=3 2411 B15R2.1117 Clc1cccc(c1)NCc2ncon2 34a_100000185859_100000233494 [0,1,0,0,0,0|2,0,0]=3 2412 B15R2.1117 Clc1cccc(c1)NCc2nnn[nH]2 34a_100000185859_100000765167 [0,1,0,0,0,0|2,0,1]=4 2413 B15R2.1117 Clc1cccc(c1)NCn2cncn2 34a_100000185859_200020645497 [0,1,0,0,0,0|1,0,1]=3 2414 B15R2.1117 Clc1cccc(c1)OCc2c[nH]cn2 34a_100000210295_100000707719 [0,1,0,0,0,0|1,0,0]=2 2415 B15R2.1117 Clc1cccc(c1)OCc2ccon2 34a_100000210295_100000234950 [0,1,0,0,0,0|3,0,0]=4 2416 B15R2.1117 Clc1cccc(c1)OCc2ccon2 7a_100000210295_100000234950 [0,1,0,0,0,0|3,0,0]=4 2417 B15R2.1117 Clc1cccc(c1)OCc2ccsc2 34a_100000210295_100011261437 [0,1,0,0,0,0|3,0,0]=4 2418 B15R2.1117 Clc1cccc(c1)OCc2ccsc2 7a_100000210295_100011261437 [0,1,0,0,0,0|3,0,0]=4 2419 B15R2.1117 Clc1cccc(c1)OCc2cncs2 34a_100000210295_100015185245 [0,1,0,0,0,0|2,0,1]=4 2420 B15R2.1117 Clc1cccc(c1)OCc2cncs2 7a_100000210295_100015185245 [0,1,0,0,0,0|2,0,1]=4 2421 B15R2.1117 Clc1cccc(c1)OCc2cscn2 34a_100000210295_100000205941 [0,1,0,0,0,0|2,0,0]=3 2422 B15R2.1117 Clc1cccc(c1)OCc2cscn2 7a_100000210295_100000205941 [0,1,0,0,0,0|2,0,0]=3 2423 B15R2.1117 Clc1cccc(c1)OCc2ncc[nH]2 34a_100000210295_100016991755 [0,1,0,0,0,0|3,0,0]=4 2424 B15R2.1117 Clc1cccc(c1)OCc2ncc[nH]2 7a_100000210295_100000753453 [0,1,0,0,0,0|3,0,0]=4 2425 B15R2.1117 Clc1cccc(c1)OCc2ncco2 34a_100000210295_103436540062 [0,1,0,0,0,0|3,0,0]=4 2426 B15R2.1117 Clc1cccc(c1)OCc2ncco2 7a_100000210295_103436540062 [0,1,0,0,0,0|3,0,0]=4 2427 B15R2.1117 Clc1cccc(c1)OCc2nccs2 34a_100000210295_100015184050 [0,1,0,0,0,0|3,0,0]=4 2428 B15R2.1117 Clc1cccc(c1)OCc2nccs2 7a_100000210295_100015184050 [0,1,0,0,0,0|3,0,0]=4 2429 B15R2.1117 Clc1cccc(c1)OCc2ncon2 34a_100000210295_100000233494 [0,1,0,0,0,0|3,0,0]=4 2430 B15R2.1117 Clc1cccc(c1)OCn2cncn2 34a_100000210295_200020645497 [0,1,0,0,0,0|2,0,1]=4 2431 B15R2.1117 Clc1cccc(c1)OCn2cncn2 7a_100000210295_200020645497 [0,1,0,0,0,0|2,0,1]=4 2432 B15R2.1117 Clc1cccc(c1)SCc2c[nH]cn2 62a_100000699651_100000707719 [0,1,0,0,0,0|1,0,0]=2 2433 B15R2.1117 Clc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000699651 [0,1,0,0,0,0|1,0,0]=2 2434 B15R2.1117 Clc1cccc(c1)SCc2ccon2 62a_100000234950_100000699651 [0,1,0,0,0,0|3,0,0]=4 2435 B15R2.1117 Clc1cccc(c1)SCc2ccon2 62a_100000699651_100000234950 [0,1,0,0,0,0|3,0,0]=4 2436 B15R2.1117 Clc1cccc(c1)SCc2ccsc2 62a_100000699651_100011233845 [0,1,0,0,0,0|3,0,0]=4 2437 B15R2.1117 Clc1cccc(c1)SCc2ccsc2 62a_100011261437_100000699651 [0,1,0,0,0,0|3,0,0]=4 2438 B15R2.1117 Clc1cccc(c1)SCc2cncs2 62a_100000699651_100015185245 [0,1,0,0,0,0|2,0,1]=4 2439 B15R2.1117 Clc1cccc(c1)SCc2cncs2 62a_100015185245_100000699651 [0,1,0,0,0,0|2,0,1]=4 2440 B15R2.1117 Clc1cccc(c1)SCc2cscn2 62a_100000205941_100000699651 [0,1,0,0,0,0|2,0,0]=3 2441 B15R2.1117 Clc1cccc(c1)SCc2cscn2 62a_100000699651_100000205941 [0,1,0,0,0,0|2,0,0]=3 2442 B15R2.1117 Clc1cccc(c1)SCc2ncc[nH]2 62a_100000699651_100016991755 [0,1,0,0,0,0|3,0,0]=4 2443 B15R2.1117 Clc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100000699651 [0,1,0,0,0,0|3,0,0]=4 2444 B15R2.1117 Clc1cccc(c1)SCc2ncco2 62a_100000699651_103436540062 [0,1,0,0,0,0|3,0,0]=4 2445 B15R2.1117 Clc1cccc(c1)SCc2ncco2 62a_103436540062_100000699651 [0,1,0,0,0,0|3,0,0]=4 2446 B15R2.1117 Clc1cccc(c1)SCc2nccs2 62a_100000699651_100015184050 [0,1,0,0,0,0|3,0,0]=4 2447 B15R2.1117 Clc1cccc(c1)SCc2nccs2 62a_100015184050_100000699651 [0,1,0,0,0,0|3,0,0]=4 2448 B15R2.1117 Clc1cccc(c1)SCc2ncon2 62a_100000233494_100000699651 [0,1,0,0,0,0|3,0,0]=4 2449 B15R2.1117 Clc1cccc(c1)SCc2ncon2 62a_100000699651_100000233494 [0,1,0,0,0,0|3,0,0]=4 2450 B15R2.1117 Clc1cccc(c1)SCn2cncn2 62a_100000699651_200020645497 [0,1,0,0,0,0|2,0,1]=4 2451 B15R2.1117 Clc1cccc(c1)SCn2cncn2 62a_200020645497_100000699651 [0,1,0,0,0,0|2,0,1]=4 2452 B15R2.1117 Clc1cccc(n1)CSc2c[nH]cn2 62a_100000086093_100000756875 [0,1,0,0,0,0|3,0,0]=4 2453 B15R2.1117 Clc1cccc(n1)CSc2c[nH]cn2 62a_100000756875_100000086093 [0,1,0,0,0,0|3,0,0]=4 2454 B15R2.1117 Clc1cccc(n1)SCc2c[nH]cn2 62a_100000051397_100000707719 [0,1,0,0,0,0|2,0,0]=3 2455 B15R2.1117 Clc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000051397 [0,1,0,0,0,0|2,0,0]=3 2456 B15R2.1117 Clc1cccc(n1)SCc2cscn2 62a_100000051397_100000205941 [0,1,0,0,0,0|3,0,0]=4 2457 B15R2.1117 Clc1cccc(n1)SCc2cscn2 62a_100000205941_100000051397 [0,1,0,0,0,0|3,0,0]=4 2458 B15R2.1117 Clc1ccnc(c1)CSc2c[nH]cn2 62a_100000756875_100016988179 [0,1,0,0,0,0|3,0,0]=4 2459 B15R2.1117 Clc1ccnc(c1)CSc2c[nH]cn2 62a_100016988179_100000756875 [0,1,0,0,0,0|3,0,0]=4 2460 B15R2.1117 Clc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100010167805 [0,1,0,0,0,0|2,0,0]=3 2461 B15R2.1117 Clc1ccnc(c1)SCc2c[nH]cn2 62a_100010167805_100000707719 [0,1,0,0,0,0|2,0,0]=3 2462 B15R2.1117 Clc1ccnc(c1)SCc2cscn2 62a_100000205941_100010167805 [0,1,0,0,0,0|3,0,0]=4 2463 B15R2.1117 Clc1ccnc(c1)SCc2cscn2 62a_100010167805_100000205941 [0,1,0,0,0,0|3,0,0]=4 2464 B15R2.1117 Clc1cncc(c1)CSc2c[nH]cn2 62a_100000756875_100016992070 [0,1,0,0,0,0|3,0,0]=4 2465 B15R2.1117 Clc1cncc(c1)CSc2c[nH]cn2 62a_100016992070_100000756875 [0,1,0,0,0,0|3,0,0]=4 2466 B15R2.1117 Clc1cncc(c1)OCc2cscn2 7a_100000032511_100000205941 [0,1,0,0,0,0|3,0,0]=4 2467 B15R2.1117 Clc1cncc(c1)SCc2c[nH]cn2 62a_100000049639_100000707719 [0,1,0,0,0,0|2,0,0]=3 2468 B15R2.1117 Clc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000049639 [0,1,0,0,0,0|2,0,0]=3 2469 B15R2.1117 Clc1cncc(c1)SCc2cscn2 62a_100000049639_100000205941 [0,1,0,0,0,0|3,0,0]=4 2470 B15R2.1117 Clc1cncc(c1)SCc2cscn2 62a_100000205941_100000049639 [0,1,0,0,0,0|3,0,0]=4 2471 B15R2.1117 Clc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_100010892449 [0,1,0,0,0,0|2,0,0]=3 2472 B15R2.1117 Clc1cncc(n1)NCc2c[nH]nn2 27a_100020620823_100010892449 [0,1,0,0,0,0|3,0,0]=4 2473 B15R2.1117 Clc1cncc(n1)NCc2cocn2 27a_100015188801_100010892449 [0,1,0,0,0,0|3,0,0]=4 2474 B15R2.1117 Clc1cncc(n1)NCc2cscn2 27a_100015185402_100010892449 [0,1,0,0,0,0|3,0,0]=4 2475 B15R2.1117 Clc1cncc(n1)SCc2c[nH]cn2 62a_100000707719_100010892449 [0,1,0,0,0,0|3,0,0]=4 2476 B15R2.1117 Clc1cncc(n1)SCc2c[nH]cn2 62a_100010892449_100000707719 [0,1,0,0,0,0|3,0,0]=4 2477 B15R2.1117 Clc1nccc(n1)SCc2c[nH]cn2 62a_100000707719_100010154678 [0,1,0,0,0,0|3,0,0]=4 2478 B15R2.1117 Clc1nccc(n1)SCc2c[nH]cn2 62a_100010154678_100000707719 [0,1,0,0,0,0|3,0,0]=4 2479 B15R2.1117 Fc1cc(ccn1)NCc2c[nH]cn2 27a_100000758547_100009816116 [0,1,0,0,0,0|1,0,0]=2 2480 B15R2.1117 Fc1cc(ccn1)NCc2c[nH]nn2 27a_100020620823_100009816116 [0,1,0,0,0,0|2,0,0]=3 2481 B15R2.1117 Fc1cc(ccn1)NCc2cc[nH]n2 27a_100000739516_100009816116 [0,1,0,0,0,0|3,0,0]=4 2482 B15R2.1117 Fc1cc(ccn1)NCc2ccco2 27a_100000185738_100009816116 [0,1,0,0,0,0|3,0,0]=4 2483 B15R2.1117 Fc1cc(ccn1)NCc2cccs2 27a_100000211653_100009816116 [0,1,0,0,0,0|3,0,0]=4 2484 B15R2.1117 Fc1cc(ccn1)NCc2ccoc2 27a_100015206860_100009816116 [0,1,0,0,0,0|3,0,0]=4 2485 B15R2.1117 Fc1cc(ccn1)NCc2ccon2 27a_100000688301_100009816116 [0,1,0,0,0,0|3,0,0]=4 2486 B15R2.1117 Fc1cc(ccn1)NCc2ccsc2 27a_100000186416_100009816116 [0,1,0,0,0,0|3,0,0]=4 2487 B15R2.1117 Fc1cc(ccn1)NCc2cn[nH]c2 27a_100000737208_100009816116 [0,1,0,0,0,0|3,0,0]=4 2488 B15R2.1117 Fc1cc(ccn1)NCc2cnco2 27a_100020634212_100009816116 [0,1,0,0,0,0|2,0,1]=4 2489 B15R2.1117 Fc1cc(ccn1)NCc2cncs2 27a_100016987365_100009816116 [0,1,0,0,0,0|2,0,1]=4 2490 B15R2.1117 Fc1cc(ccn1)NCc2cocn2 27a_100015188801_100009816116 [0,1,0,0,0,0|2,0,0]=3 2491 B15R2.1117 Fc1cc(ccn1)NCc2cscn2 27a_100015185402_100009816116 [0,1,0,0,0,0|2,0,0]=3 2492 B15R2.1117 Fc1cc(ccn1)NCc2ncc[nH]2 27a_100000754540_100009816116 [0,1,0,0,0,0|3,0,0]=4 2493 B15R2.1117 Fc1cc(ccn1)NCc2ncco2 27a_100016994969_100009816116 [0,1,0,0,0,0|3,0,0]=4 2494 B15R2.1117 Fc1cc(ccn1)NCc2nccs2 27a_100000740555_100009816116 [0,1,0,0,0,0|3,0,0]=4 2495 B15R2.1117 Fc1cc(ccn1)OCc2c[nH]cn2 34a_100000732698_100000707719 [0,1,0,0,0,0|2,0,0]=3 2496 B15R2.1117 Fc1cc(ccn1)OCc2cscn2 34a_100000732698_100000205941 [0,1,0,0,0,0|3,0,0]=4 2497 B15R2.1117 Fc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100009816116 [0,1,0,0,0,0|2,0,0]=3 2498 B15R2.1117 Fc1cc(ccn1)SCc2c[nH]cn2 62a_100009816116_100000707719 [0,1,0,0,0,0|2,0,0]=3 2499 B15R2.1117 Fc1cc(ccn1)SCc2cscn2 62a_100000205941_100009816116 [0,1,0,0,0,0|3,0,0]=4 2500 B15R2.1117 Fc1cc(ccn1)SCc2cscn2 62a_100009816116_100000205941 [0,1,0,0,0,0|3,0,0]=4 2501 B15R2.1117 Fc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_200009880791 [0,1,0,0,0,0|2,0,0]=3 2502 B15R2.1117 Fc1cc(ncn1)NCc2c[nH]nn2 27a_100020620823_200009880791 [0,1,0,0,0,0|3,0,0]=4 2503 B15R2.1117 Fc1cc(ncn1)NCc2cocn2 27a_100015188801_200009880791 [0,1,0,0,0,0|3,0,0]=4 2504 B15R2.1117 Fc1cc(ncn1)NCc2cscn2 27a_100015185402_200009880791 [0,1,0,0,0,0|3,0,0]=4 2505 B15R2.1117 Fc1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_200009880791 [0,1,0,0,0,0|3,0,0]=4 2506 B15R2.1117 Fc1cc(ncn1)SCc2c[nH]cn2 62a_200009880791_100000707719 [0,1,0,0,0,0|3,0,0]=4 2507 B15R2.1117 Fc1cccc(c1)C=Cc2c[nH]cn2 271570a_100102525537_100000756875 [0,1,0,0,0,0|1,0,1]=3 2508 B15R2.1117 Fc1cccc(c1)C=Cc2cscn2 271570a_100102525537_100000751502 [0,1,0,0,0,0|2,0,1]=4 2509 B15R2.1117 Fc1cccc(c1)C=Cc2nc[nH]n2 271570a_100102525537_100000761765 [0,1,0,0,0,0|2,0,1]=4 2510 B15R2.1117 Fc1cccc(c1)CSc2c[nH]cn2 62a_100000230114_100000756875 [0,1,0,0,0,0|2,0,0]=3 2511 B15R2.1117 Fc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000230114 [0,1,0,0,0,0|2,0,0]=3 2512 B15R2.1117 Fc1cccc(c1)CSc2c[nH]nn2 62a_100000230114_100009819707 [0,1,0,0,0,0|3,0,0]=4 2513 B15R2.1117 Fc1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100000230114 [0,1,0,0,0,0|3,0,0]=4 2514 B15R2.1117 Fc1cccc(c1)CSc2cscn2 62a_100000230114_100000751502 [0,1,0,0,0,0|3,0,0]=4 2515 B15R2.1117 Fc1cccc(c1)CSc2cscn2 62a_100000751502_100000230114 [0,1,0,0,0,0|3,0,0]=4 2516 B15R2.1117 Fc1cccc(c1)CSc2nc[nH]n2 62a_100000230114_100000761765 [0,1,0,0,0,0|3,0,0]=4 2517 B15R2.1117 Fc1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100000230114 [0,1,0,0,0,0|3,0,0]=4 2518 B15R2.1117 Fc1cccc(c1)NCC2=NCCN2 34a_100000210047_100000737910 [0,1,0,0,0,0|2,0,1]=4 2519 B15R2.1117 Fc1cccc(c1)NCc2c[nH]cn2 34a_100000210047_100000707719 [0,1,0,0,0,0|0,0,0]=1 2520 B15R2.1117 Fc1cccc(c1)NCc2cc[nH]n2 207a_100000210047_100000738523 [0,1,0,0,0,0|2,0,0]=3 2521 B15R2.1117 Fc1cccc(c1)NCc2ccco2 207a_100000210047_100000186105 [0,1,0,0,0,0|2,0,0]=3 2522 B15R2.1117 Fc1cccc(c1)NCc2ccco2 270302a_100000210047_100000186105 [0,1,0,0,0,0|2,0,0]=3 2523 B15R2.1117 Fc1cccc(c1)NCc2cccs2 207a_100000210047_100000209959 [0,1,0,0,0,0|2,0,0]=3 2524 B15R2.1117 Fc1cccc(c1)NCc2cccs2 270302a_100000210047_100000209959 [0,1,0,0,0,0|2,0,0]=3 2525 B15R2.1117 Fc1cccc(c1)NCc2ccn[nH]2 34a_100000210047_100000728653 [0,1,0,0,0,0|2,0,1]=4 2526 B15R2.1117 Fc1cccc(c1)NCc2ccoc2 207a_100000210047_100011215517 [0,1,0,0,0,0|2,0,0]=3 2527 B15R2.1117 Fc1cccc(c1)NCc2ccon2 34a_100000210047_100000234950 [0,1,0,0,0,0|2,0,0]=3 2528 B15R2.1117 Fc1cccc(c1)NCc2ccsc2 207a_100000210047_100000188534 [0,1,0,0,0,0|2,0,0]=3 2529 B15R2.1117 Fc1cccc(c1)NCc2ccsc2 270302a_100000210047_100000188534 [0,1,0,0,0,0|2,0,0]=3 2530 B15R2.1117 Fc1cccc(c1)NCc2ccsc2 34a_100000210047_100011261437 [0,1,0,0,0,0|2,0,0]=3 2531 B15R2.1117 Fc1cccc(c1)NCc2cn[nH]c2 207a_100000210047_100016992096 [0,1,0,0,0,0|2,0,0]=3 2532 B15R2.1117 Fc1cccc(c1)NCc2cn[nH]c2 270302a_100000210047_100016992096 [0,1,0,0,0,0|2,0,0]=3 2533 B15R2.1117 Fc1cccc(c1)NCc2cnc[nH]2 207a_100000210047_100000742939 [0,1,0,0,0,0|0,0,2]=3 2534 B15R2.1117 Fc1cccc(c1)NCc2cncs2 207a_100000210047_100000749870 [0,1,0,0,0,0|1,0,1]=3 2535 B15R2.1117 Fc1cccc(c1)NCc2cncs2 270302a_100000210047_100000749870 [0,1,0,0,0,0|1,0,1]=3 2536 B15R2.1117 Fc1cccc(c1)NCc2cncs2 34a_100000210047_100015185245 [0,1,0,0,0,0|1,0,1]=3 2537 B15R2.1117 Fc1cccc(c1)NCc2cscn2 207a_100000210047_100000743575 [0,1,0,0,0,0|1,0,0]=2 2538 B15R2.1117 Fc1cccc(c1)NCc2cscn2 270302a_100000210047_100000743575 [0,1,0,0,0,0|1,0,0]=2 2539 B15R2.1117 Fc1cccc(c1)NCc2cscn2 34a_100000210047_100000205941 [0,1,0,0,0,0|1,0,0]=2 2540 B15R2.1117 Fc1cccc(c1)NCc2ncc[nH]2 207a_100000210047_100000743867 [0,1,0,0,0,0|2,0,0]=3 2541 B15R2.1117 Fc1cccc(c1)NCc2ncc[nH]2 34a_100000210047_100016991755 [0,1,0,0,0,0|2,0,0]=3 2542 B15R2.1117 Fc1cccc(c1)NCc2ncco2 34a_100000210047_103436540062 [0,1,0,0,0,0|2,0,0]=3 2543 B15R2.1117 Fc1cccc(c1)NCc2nccs2 207a_100000210047_100000750902 [0,1,0,0,0,0|2,0,0]=3 2544 B15R2.1117 Fc1cccc(c1)NCc2nccs2 270302a_100000210047_100000750902 [0,1,0,0,0,0|2,0,0]=3 2545 B15R2.1117 Fc1cccc(c1)NCc2nccs2 34a_100000210047_100015184050 [0,1,0,0,0,0|2,0,0]=3 2546 B15R2.1117 Fc1cccc(c1)NCc2ncon2 34a_100000210047_100000233494 [0,1,0,0,0,0|2,0,0]=3 2547 B15R2.1117 Fc1cccc(c1)NCc2nnn[nH]2 34a_100000210047_100000765167 [0,1,0,0,0,0|2,0,1]=4 2548 B15R2.1117 Fc1cccc(c1)NCn2cncn2 34a_100000210047_200020645497 [0,1,0,0,0,0|1,0,1]=3 2549 B15R2.1117 Fc1cccc(c1)OCc2c[nH]cn2 34a_100000210426_100000707719 [0,1,0,0,0,0|1,0,0]=2 2550 B15R2.1117 Fc1cccc(c1)OCc2ccon2 34a_100000210426_100000234950 [0,1,0,0,0,0|3,0,0]=4 2551 B15R2.1117 Fc1cccc(c1)OCc2ccon2 7a_100000210426_100000234950 [0,1,0,0,0,0|3,0,0]=4 2552 B15R2.1117 Fc1cccc(c1)OCc2ccsc2 34a_100000210426_100011261437 [0,1,0,0,0,0|3,0,0]=4 2553 B15R2.1117 Fc1cccc(c1)OCc2ccsc2 7a_100000210426_100011261437 [0,1,0,0,0,0|3,0,0]=4 2554 B15R2.1117 Fc1cccc(c1)OCc2cncs2 34a_100000210426_100015185245 [0,1,0,0,0,0|2,0,1]=4 2555 B15R2.1117 Fc1cccc(c1)OCc2cncs2 7a_100000210426_100015185245 [0,1,0,0,0,0|2,0,1]=4 2556 B15R2.1117 Fc1cccc(c1)OCc2cscn2 34a_100000210426_100000205941 [0,1,0,0,0,0|2,0,0]=3 2557 B15R2.1117 Fc1cccc(c1)OCc2cscn2 7a_100000210426_100000205941 [0,1,0,0,0,0|2,0,0]=3 2558 B15R2.1117 Fc1cccc(c1)OCc2ncc[nH]2 34a_100000210426_100016991755 [0,1,0,0,0,0|3,0,0]=4 2559 B15R2.1117 Fc1cccc(c1)OCc2ncc[nH]2 7a_100000210426_100000753453 [0,1,0,0,0,0|3,0,0]=4 2560 B15R2.1117 Fc1cccc(c1)OCc2ncco2 34a_100000210426_103436540062 [0,1,0,0,0,0|3,0,0]=4 2561 B15R2.1117 Fc1cccc(c1)OCc2ncco2 7a_100000210426_103436540062 [0,1,0,0,0,0|3,0,0]=4 2562 B15R2.1117 Fc1cccc(c1)OCc2nccs2 34a_100000210426_100015184050 [0,1,0,0,0,0|3,0,0]=4 2563 B15R2.1117 Fc1cccc(c1)OCc2nccs2 7a_100000210426_100015184050 [0,1,0,0,0,0|3,0,0]=4 2564 B15R2.1117 Fc1cccc(c1)OCc2ncon2 34a_100000210426_100000233494 [0,1,0,0,0,0|3,0,0]=4 2565 B15R2.1117 Fc1cccc(c1)OCn2cncn2 34a_100000210426_200020645497 [0,1,0,0,0,0|2,0,1]=4 2566 B15R2.1117 Fc1cccc(c1)OCn2cncn2 7a_100000210426_200020645497 [0,1,0,0,0,0|2,0,1]=4 2567 B15R2.1117 Fc1cccc(c1)SCc2c[nH]cn2 62a_100000685547_100000707719 [0,1,0,0,0,0|1,0,0]=2 2568 B15R2.1117 Fc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000685547 [0,1,0,0,0,0|1,0,0]=2 2569 B15R2.1117 Fc1cccc(c1)SCc2ccon2 62a_100000234950_100000685547 [0,1,0,0,0,0|3,0,0]=4 2570 B15R2.1117 Fc1cccc(c1)SCc2ccon2 62a_100000685547_100000234950 [0,1,0,0,0,0|3,0,0]=4 2571 B15R2.1117 Fc1cccc(c1)SCc2ccsc2 62a_100000685547_100011233845 [0,1,0,0,0,0|3,0,0]=4 2572 B15R2.1117 Fc1cccc(c1)SCc2ccsc2 62a_100011261437_100000685547 [0,1,0,0,0,0|3,0,0]=4 2573 B15R2.1117 Fc1cccc(c1)SCc2cncs2 62a_100000685547_100015185245 [0,1,0,0,0,0|2,0,1]=4 2574 B15R2.1117 Fc1cccc(c1)SCc2cncs2 62a_100015185245_100000685547 [0,1,0,0,0,0|2,0,1]=4 2575 B15R2.1117 Fc1cccc(c1)SCc2cscn2 62a_100000205941_100000685547 [0,1,0,0,0,0|2,0,0]=3 2576 B15R2.1117 Fc1cccc(c1)SCc2cscn2 62a_100000685547_100000205941 [0,1,0,0,0,0|2,0,0]=3 2577 B15R2.1117 Fc1cccc(c1)SCc2ncc[nH]2 62a_100000685547_100016991755 [0,1,0,0,0,0|3,0,0]=4 2578 B15R2.1117 Fc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100000685547 [0,1,0,0,0,0|3,0,0]=4 2579 B15R2.1117 Fc1cccc(c1)SCc2ncco2 62a_100000685547_103436540062 [0,1,0,0,0,0|3,0,0]=4 2580 B15R2.1117 Fc1cccc(c1)SCc2ncco2 62a_103436540062_100000685547 [0,1,0,0,0,0|3,0,0]=4 2581 B15R2.1117 Fc1cccc(c1)SCc2nccs2 62a_100000685547_100015184050 [0,1,0,0,0,0|3,0,0]=4 2582 B15R2.1117 Fc1cccc(c1)SCc2nccs2 62a_100015184050_100000685547 [0,1,0,0,0,0|3,0,0]=4 2583 B15R2.1117 Fc1cccc(c1)SCc2ncon2 62a_100000233494_100000685547 [0,1,0,0,0,0|3,0,0]=4 2584 B15R2.1117 Fc1cccc(c1)SCc2ncon2 62a_100000685547_100000233494 [0,1,0,0,0,0|3,0,0]=4 2585 B15R2.1117 Fc1cccc(c1)SCn2cncn2 62a_100000685547_200020645497 [0,1,0,0,0,0|2,0,1]=4 2586 B15R2.1117 Fc1cccc(c1)SCn2cncn2 62a_200020645497_100000685547 [0,1,0,0,0,0|2,0,1]=4 2587 B15R2.1117 Fc1cccc(n1)CSc2c[nH]cn2 62a_100000756875_100009819644 [0,1,0,0,0,0|3,0,0]=4 2588 B15R2.1117 Fc1cccc(n1)CSc2c[nH]cn2 62a_100009819644_100000756875 [0,1,0,0,0,0|3,0,0]=4 2589 B15R2.1117 Fc1cccc(n1)NCc2c[nH]cn2 27a_100000758547_100009815982 [0,1,0,0,0,0|1,0,0]=2 2590 B15R2.1117 Fc1cccc(n1)NCc2c[nH]nn2 27a_100020620823_100009815982 [0,1,0,0,0,0|2,0,0]=3 2591 B15R2.1117 Fc1cccc(n1)NCc2cc[nH]n2 27a_100000739516_100009815982 [0,1,0,0,0,0|3,0,0]=4 2592 B15R2.1117 Fc1cccc(n1)NCc2ccco2 27a_100000185738_100009815982 [0,1,0,0,0,0|3,0,0]=4 2593 B15R2.1117 Fc1cccc(n1)NCc2cccs2 27a_100000211653_100009815982 [0,1,0,0,0,0|3,0,0]=4 2594 B15R2.1117 Fc1cccc(n1)NCc2ccoc2 27a_100015206860_100009815982 [0,1,0,0,0,0|3,0,0]=4 2595 B15R2.1117 Fc1cccc(n1)NCc2ccon2 27a_100000688301_100009815982 [0,1,0,0,0,0|3,0,0]=4 2596 B15R2.1117 Fc1cccc(n1)NCc2ccsc2 27a_100000186416_100009815982 [0,1,0,0,0,0|3,0,0]=4 2597 B15R2.1117 Fc1cccc(n1)NCc2cn[nH]c2 27a_100000737208_100009815982 [0,1,0,0,0,0|3,0,0]=4 2598 B15R2.1117 Fc1cccc(n1)NCc2cnco2 27a_100020634212_100009815982 [0,1,0,0,0,0|2,0,1]=4 2599 B15R2.1117 Fc1cccc(n1)NCc2cncs2 27a_100016987365_100009815982 [0,1,0,0,0,0|2,0,1]=4 2600 B15R2.1117 Fc1cccc(n1)NCc2cocn2 27a_100015188801_100009815982 [0,1,0,0,0,0|2,0,0]=3 2601 B15R2.1117 Fc1cccc(n1)NCc2cscn2 27a_100015185402_100009815982 [0,1,0,0,0,0|2,0,0]=3 2602 B15R2.1117 Fc1cccc(n1)NCc2ncc[nH]2 27a_100000754540_100009815982 [0,1,0,0,0,0|3,0,0]=4 2603 B15R2.1117 Fc1cccc(n1)NCc2ncco2 27a_100016994969_100009815982 [0,1,0,0,0,0|3,0,0]=4 2604 B15R2.1117 Fc1cccc(n1)NCc2nccs2 27a_100000740555_100009815982 [0,1,0,0,0,0|3,0,0]=4 2605 B15R2.1117 Fc1cccc(n1)OCc2c[nH]cn2 34a_100011432558_100000707719 [0,1,0,0,0,0|2,0,0]=3 2606 B15R2.1117 Fc1cccc(n1)OCc2cscn2 34a_100011432558_100000205941 [0,1,0,0,0,0|3,0,0]=4 2607 B15R2.1117 Fc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100009815982 [0,1,0,0,0,0|2,0,0]=3 2608 B15R2.1117 Fc1cccc(n1)SCc2c[nH]cn2 62a_100009815982_100000707719 [0,1,0,0,0,0|2,0,0]=3 2609 B15R2.1117 Fc1cccc(n1)SCc2cscn2 62a_100000205941_100009815982 [0,1,0,0,0,0|3,0,0]=4 2610 B15R2.1117 Fc1cccc(n1)SCc2cscn2 62a_100009815982_100000205941 [0,1,0,0,0,0|3,0,0]=4 2611 B15R2.1117 Fc1ccnc(c1)NCc2c[nH]cn2 27a_100000758547_100000764206 [0,1,0,0,0,0|1,0,0]=2 2612 B15R2.1117 Fc1ccnc(c1)NCc2c[nH]nn2 27a_100020620823_100000764206 [0,1,0,0,0,0|2,0,0]=3 2613 B15R2.1117 Fc1ccnc(c1)NCc2cc[nH]n2 27a_100000739516_100000764206 [0,1,0,0,0,0|3,0,0]=4 2614 B15R2.1117 Fc1ccnc(c1)NCc2ccco2 27a_100000185738_100000764206 [0,1,0,0,0,0|3,0,0]=4 2615 B15R2.1117 Fc1ccnc(c1)NCc2cccs2 27a_100000211653_100000764206 [0,1,0,0,0,0|3,0,0]=4 2616 B15R2.1117 Fc1ccnc(c1)NCc2ccoc2 27a_100015206860_100000764206 [0,1,0,0,0,0|3,0,0]=4 2617 B15R2.1117 Fc1ccnc(c1)NCc2ccon2 27a_100000688301_100000764206 [0,1,0,0,0,0|3,0,0]=4 2618 B15R2.1117 Fc1ccnc(c1)NCc2ccsc2 27a_100000186416_100000764206 [0,1,0,0,0,0|3,0,0]=4 2619 B15R2.1117 Fc1ccnc(c1)NCc2cn[nH]c2 27a_100000737208_100000764206 [0,1,0,0,0,0|3,0,0]=4 2620 B15R2.1117 Fc1ccnc(c1)NCc2cnco2 27a_100020634212_100000764206 [0,1,0,0,0,0|2,0,1]=4 2621 B15R2.1117 Fc1ccnc(c1)NCc2cncs2 27a_100016987365_100000764206 [0,1,0,0,0,0|2,0,1]=4 2622 B15R2.1117 Fc1ccnc(c1)NCc2cocn2 27a_100015188801_100000764206 [0,1,0,0,0,0|2,0,0]=3 2623 B15R2.1117 Fc1ccnc(c1)NCc2cscn2 27a_100015185402_100000764206 [0,1,0,0,0,0|2,0,0]=3 2624 B15R2.1117 Fc1ccnc(c1)NCc2ncc[nH]2 27a_100000754540_100000764206 [0,1,0,0,0,0|3,0,0]=4 2625 B15R2.1117 Fc1ccnc(c1)NCc2ncco2 27a_100016994969_100000764206 [0,1,0,0,0,0|3,0,0]=4 2626 B15R2.1117 Fc1ccnc(c1)NCc2nccs2 27a_100000740555_100000764206 [0,1,0,0,0,0|3,0,0]=4 2627 B15R2.1117 Fc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100000764206 [0,1,0,0,0,0|2,0,0]=3 2628 B15R2.1117 Fc1ccnc(c1)SCc2c[nH]cn2 62a_100000764206_100000707719 [0,1,0,0,0,0|2,0,0]=3 2629 B15R2.1117 Fc1ccnc(c1)SCc2cscn2 62a_100000205941_100000764206 [0,1,0,0,0,0|3,0,0]=4 2630 B15R2.1117 Fc1ccnc(c1)SCc2cscn2 62a_100000764206_100000205941 [0,1,0,0,0,0|3,0,0]=4 2631 B15R2.1117 Fc1cncc(c1)CSc2c[nH]cn2 62a_100000725299_100000756875 [0,1,0,0,0,0|3,0,0]=4 2632 B15R2.1117 Fc1cncc(c1)CSc2c[nH]cn2 62a_100000756875_100000725299 [0,1,0,0,0,0|3,0,0]=4 2633 B15R2.1117 Fc1cncc(c1)OCc2c[nH]cn2 34a_100011830296_100000707719 [0,1,0,0,0,0|2,0,0]=3 2634 B15R2.1117 Fc1cncc(c1)OCc2cscn2 34a_100011830296_100000205941 [0,1,0,0,0,0|3,0,0]=4 2635 B15R2.1117 Fc1cncc(c1)OCc2cscn2 7a_100011830296_100000205941 [0,1,0,0,0,0|3,0,0]=4 2636 B15R2.1117 Fc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000744099 [0,1,0,0,0,0|2,0,0]=3 2637 B15R2.1117 Fc1cncc(c1)SCc2c[nH]cn2 62a_100000744099_100000707719 [0,1,0,0,0,0|2,0,0]=3 2638 B15R2.1117 Fc1cncc(c1)SCc2cscn2 62a_100000205941_100000744099 [0,1,0,0,0,0|3,0,0]=4 2639 B15R2.1117 Fc1cncc(c1)SCc2cscn2 62a_100000744099_100000205941 [0,1,0,0,0,0|3,0,0]=4 2640 B15R2.1117 Fc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_200009863489 [0,1,0,0,0,0|2,0,0]=3 2641 B15R2.1117 Fc1cncc(n1)NCc2c[nH]nn2 27a_100020620823_200009863489 [0,1,0,0,0,0|3,0,0]=4 2642 B15R2.1117 Fc1cncc(n1)NCc2cocn2 27a_100015188801_200009863489 [0,1,0,0,0,0|3,0,0]=4 2643 B15R2.1117 Fc1cncc(n1)NCc2cscn2 27a_100015185402_200009863489 [0,1,0,0,0,0|3,0,0]=4 2644 B15R2.1117 Fc1cncc(n1)SCc2c[nH]cn2 62a_100000707719_200009863489 [0,1,0,0,0,0|3,0,0]=4 2645 B15R2.1117 Fc1cncc(n1)SCc2c[nH]cn2 62a_200009863489_100000707719 [0,1,0,0,0,0|3,0,0]=4 2646 B15R2.1117 Ic1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100011218688 [0,1,0,0,0,0|2,0,0]=3 2647 B15R2.1117 Ic1cccc(c1)CSc2c[nH]cn2 62a_100011218688_100000756875 [0,1,0,0,0,0|2,0,0]=3 2648 B15R2.1117 Ic1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100011218688 [0,1,0,0,0,0|3,0,0]=4 2649 B15R2.1117 Ic1cccc(c1)CSc2c[nH]nn2 62a_100011218688_100009819707 [0,1,0,0,0,0|3,0,0]=4 2650 B15R2.1117 Ic1cccc(c1)CSc2cscn2 62a_100000751502_100011218688 [0,1,0,0,0,0|3,0,0]=4 2651 B15R2.1117 Ic1cccc(c1)CSc2cscn2 62a_100011218688_100000751502 [0,1,0,0,0,0|3,0,0]=4 2652 B15R2.1117 Ic1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100011218688 [0,1,0,0,0,0|3,0,0]=4 2653 B15R2.1117 Ic1cccc(c1)CSc2nc[nH]n2 62a_100011218688_100000761765 [0,1,0,0,0,0|3,0,0]=4 2654 B15R2.1117 Ic1cccc(c1)NCC2=NCCN2 34a_100000211102_100000737910 [0,1,0,0,0,0|2,0,1]=4 2655 B15R2.1117 Ic1cccc(c1)NCc2c[nH]cn2 34a_100000211102_100000707719 [0,1,0,0,0,0|0,0,0]=1 2656 B15R2.1117 Ic1cccc(c1)NCc2cc[nH]n2 207a_100000211102_100000738523 [0,1,0,0,0,0|2,0,0]=3 2657 B15R2.1117 Ic1cccc(c1)NCc2ccco2 207a_100000211102_100000186105 [0,1,0,0,0,0|2,0,0]=3 2658 B15R2.1117 Ic1cccc(c1)NCc2ccco2 270302a_100000211102_100000186105 [0,1,0,0,0,0|2,0,0]=3 2659 B15R2.1117 Ic1cccc(c1)NCc2cccs2 207a_100000211102_100000209959 [0,1,0,0,0,0|2,0,0]=3 2660 B15R2.1117 Ic1cccc(c1)NCc2cccs2 270302a_100000211102_100000209959 [0,1,0,0,0,0|2,0,0]=3 2661 B15R2.1117 Ic1cccc(c1)NCc2ccn[nH]2 34a_100000211102_100000728653 [0,1,0,0,0,0|2,0,1]=4 2662 B15R2.1117 Ic1cccc(c1)NCc2ccoc2 207a_100000211102_100011215517 [0,1,0,0,0,0|2,0,0]=3 2663 B15R2.1117 Ic1cccc(c1)NCc2ccon2 34a_100000211102_100000234950 [0,1,0,0,0,0|2,0,0]=3 2664 B15R2.1117 Ic1cccc(c1)NCc2ccsc2 207a_100000211102_100000188534 [0,1,0,0,0,0|2,0,0]=3 2665 B15R2.1117 Ic1cccc(c1)NCc2ccsc2 270302a_100000211102_100000188534 [0,1,0,0,0,0|2,0,0]=3 2666 B15R2.1117 Ic1cccc(c1)NCc2ccsc2 34a_100000211102_100011261437 [0,1,0,0,0,0|2,0,0]=3 2667 B15R2.1117 Ic1cccc(c1)NCc2cn[nH]c2 207a_100000211102_100016992096 [0,1,0,0,0,0|2,0,0]=3 2668 B15R2.1117 Ic1cccc(c1)NCc2cn[nH]c2 270302a_100000211102_100016992096 [0,1,0,0,0,0|2,0,0]=3 2669 B15R2.1117 Ic1cccc(c1)NCc2cnc[nH]2 207a_100000211102_100000742939 [0,1,0,0,0,0|0,0,2]=3 2670 B15R2.1117 Ic1cccc(c1)NCc2cncs2 207a_100000211102_100000749870 [0,1,0,0,0,0|1,0,1]=3 2671 B15R2.1117 Ic1cccc(c1)NCc2cncs2 270302a_100000211102_100000749870 [0,1,0,0,0,0|1,0,1]=3 2672 B15R2.1117 Ic1cccc(c1)NCc2cncs2 34a_100000211102_100015185245 [0,1,0,0,0,0|1,0,1]=3 2673 B15R2.1117 Ic1cccc(c1)NCc2cscn2 207a_100000211102_100000743575 [0,1,0,0,0,0|1,0,0]=2 2674 B15R2.1117 Ic1cccc(c1)NCc2cscn2 270302a_100000211102_100000743575 [0,1,0,0,0,0|1,0,0]=2 2675 B15R2.1117 Ic1cccc(c1)NCc2cscn2 34a_100000211102_100000205941 [0,1,0,0,0,0|1,0,0]=2 2676 B15R2.1117 Ic1cccc(c1)NCc2ncc[nH]2 207a_100000211102_100000743867 [0,1,0,0,0,0|2,0,0]=3 2677 B15R2.1117 Ic1cccc(c1)NCc2ncc[nH]2 34a_100000211102_100016991755 [0,1,0,0,0,0|2,0,0]=3 2678 B15R2.1117 Ic1cccc(c1)NCc2ncco2 34a_100000211102_103436540062 [0,1,0,0,0,0|2,0,0]=3 2679 B15R2.1117 Ic1cccc(c1)NCc2nccs2 207a_100000211102_100000750902 [0,1,0,0,0,0|2,0,0]=3 2680 B15R2.1117 Ic1cccc(c1)NCc2nccs2 270302a_100000211102_100000750902 [0,1,0,0,0,0|2,0,0]=3 2681 B15R2.1117 Ic1cccc(c1)NCc2nccs2 34a_100000211102_100015184050 [0,1,0,0,0,0|2,0,0]=3 2682 B15R2.1117 Ic1cccc(c1)NCc2ncon2 34a_100000211102_100000233494 [0,1,0,0,0,0|2,0,0]=3 2683 B15R2.1117 Ic1cccc(c1)NCc2nnn[nH]2 34a_100000211102_100000765167 [0,1,0,0,0,0|2,0,1]=4 2684 B15R2.1117 Ic1cccc(c1)NCn2cncn2 34a_100000211102_200020645497 [0,1,0,0,0,0|1,0,1]=3 2685 B15R2.1117 Ic1cccc(c1)OCc2c[nH]cn2 34a_100000211634_100000707719 [0,1,0,0,0,0|1,0,0]=2 2686 B15R2.1117 Ic1cccc(c1)OCc2ccon2 34a_100000211634_100000234950 [0,1,0,0,0,0|3,0,0]=4 2687 B15R2.1117 Ic1cccc(c1)OCc2ccon2 7a_100000211634_100000234950 [0,1,0,0,0,0|3,0,0]=4 2688 B15R2.1117 Ic1cccc(c1)OCc2ccsc2 34a_100000211634_100011261437 [0,1,0,0,0,0|3,0,0]=4 2689 B15R2.1117 Ic1cccc(c1)OCc2ccsc2 7a_100000211634_100011261437 [0,1,0,0,0,0|3,0,0]=4 2690 B15R2.1117 Ic1cccc(c1)OCc2cncs2 34a_100000211634_100015185245 [0,1,0,0,0,0|2,0,1]=4 2691 B15R2.1117 Ic1cccc(c1)OCc2cncs2 7a_100000211634_100015185245 [0,1,0,0,0,0|2,0,1]=4 2692 B15R2.1117 Ic1cccc(c1)OCc2cscn2 34a_100000211634_100000205941 [0,1,0,0,0,0|2,0,0]=3 2693 B15R2.1117 Ic1cccc(c1)OCc2cscn2 7a_100000211634_100000205941 [0,1,0,0,0,0|2,0,0]=3 2694 B15R2.1117 Ic1cccc(c1)OCc2ncc[nH]2 34a_100000211634_100016991755 [0,1,0,0,0,0|3,0,0]=4 2695 B15R2.1117 Ic1cccc(c1)OCc2ncc[nH]2 7a_100000211634_100000753453 [0,1,0,0,0,0|3,0,0]=4 2696 B15R2.1117 Ic1cccc(c1)OCc2ncco2 34a_100000211634_103436540062 [0,1,0,0,0,0|3,0,0]=4 2697 B15R2.1117 Ic1cccc(c1)OCc2ncco2 7a_100000211634_103436540062 [0,1,0,0,0,0|3,0,0]=4 2698 B15R2.1117 Ic1cccc(c1)OCc2nccs2 34a_100000211634_100015184050 [0,1,0,0,0,0|3,0,0]=4 2699 B15R2.1117 Ic1cccc(c1)OCc2nccs2 7a_100000211634_100015184050 [0,1,0,0,0,0|3,0,0]=4 2700 B15R2.1117 Ic1cccc(c1)OCc2ncon2 34a_100000211634_100000233494 [0,1,0,0,0,0|3,0,0]=4 2701 B15R2.1117 Ic1cccc(c1)OCn2cncn2 34a_100000211634_200020645497 [0,1,0,0,0,0|2,0,1]=4 2702 B15R2.1117 Ic1cccc(c1)OCn2cncn2 7a_100000211634_200020645497 [0,1,0,0,0,0|2,0,1]=4 2703 B15R2.1117 Nc1cc(ccn1)OCc2c[nH]cn2 34a_100011834064_100000707719 [0,1,0,0,0,0|2,0,0]=3 2704 B15R2.1117 Nc1cc(ccn1)OCc2cscn2 34a_100011834064_100000205941 [0,1,0,0,0,0|3,0,0]=4 2705 B15R2.1117 Nc1cc(ccn1)SCc2c[nH]cn2 62a_100000049665_100000707719 [0,1,0,0,0,0|2,0,0]=3 2706 B15R2.1117 Nc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000049665 [0,1,0,0,0,0|2,0,0]=3 2707 B15R2.1117 Nc1cc(ccn1)SCc2cscn2 62a_100000049665_100000205941 [0,1,0,0,0,0|3,0,0]=4 2708 B15R2.1117 Nc1cc(ccn1)SCc2cscn2 62a_100000205941_100000049665 [0,1,0,0,0,0|3,0,0]=4 2709 B15R2.1117 Nc1cc(cnn1)OCc2c[nH]cn2 34a_200015193112_100000707719 [0,1,0,0,0,0|3,0,0]=4 2710 B15R2.1117 Nc1cc(cnn1)SCc2c[nH]cn2 62a_100000130277_100000707719 [0,1,0,0,0,0|3,0,0]=4 2711 B15R2.1117 Nc1cc(cnn1)SCc2c[nH]cn2 62a_100000707719_100000130277 [0,1,0,0,0,0|3,0,0]=4 2712 B15R2.1117 Nc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000701291 [0,1,0,0,0,0|2,0,0]=3 2713 B15R2.1117 Nc1cc(ncn1)NCc2c[nH]nn2 27a_100020620823_100000701291 [0,1,0,0,0,0|3,0,0]=4 2714 B15R2.1117 Nc1cc(ncn1)NCc2cocn2 27a_100015188801_100000701291 [0,1,0,0,0,0|3,0,0]=4 2715 B15R2.1117 Nc1cc(ncn1)NCc2cscn2 27a_100015185402_100000701291 [0,1,0,0,0,0|3,0,0]=4 2716 B15R2.1117 Nc1cc(ncn1)SCc2c[nH]cn2 62a_100000701291_100000707719 [0,1,0,0,0,0|3,0,0]=4 2717 B15R2.1117 Nc1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_100000701291 [0,1,0,0,0,0|3,0,0]=4 2718 B15R2.1117 Nc1cccc(c1)OCc2c[nH]cn2 34a_100000210217_100000707719 [0,1,0,0,0,0|1,0,0]=2 2719 B15R2.1117 Nc1cccc(c1)OCc2ccon2 34a_100000210217_100000234950 [0,1,0,0,0,0|3,0,0]=4 2720 B15R2.1117 Nc1cccc(c1)OCc2ccsc2 34a_100000210217_100011261437 [0,1,0,0,0,0|3,0,0]=4 2721 B15R2.1117 Nc1cccc(c1)OCc2cncs2 34a_100000210217_100015185245 [0,1,0,0,0,0|2,0,1]=4 2722 B15R2.1117 Nc1cccc(c1)OCc2cscn2 34a_100000210217_100000205941 [0,1,0,0,0,0|2,0,0]=3 2723 B15R2.1117 Nc1cccc(c1)OCc2ncc[nH]2 34a_100000210217_100016991755 [0,1,0,0,0,0|3,0,0]=4 2724 B15R2.1117 Nc1cccc(c1)OCc2ncco2 34a_100000210217_103436540062 [0,1,0,0,0,0|3,0,0]=4 2725 B15R2.1117 Nc1cccc(c1)OCc2nccs2 34a_100000210217_100015184050 [0,1,0,0,0,0|3,0,0]=4 2726 B15R2.1117 Nc1cccc(c1)OCc2ncon2 34a_100000210217_100000233494 [0,1,0,0,0,0|3,0,0]=4 2727 B15R2.1117 Nc1cccc(c1)OCn2cncn2 34a_100000210217_200020645497 [0,1,0,0,0,0|2,0,1]=4 2728 B15R2.1117 Nc1cccc(c1)SCc2c[nH]cn2 62a_100000210019_100000707719 [0,1,0,0,0,0|1,0,0]=2 2729 B15R2.1117 Nc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000210019 [0,1,0,0,0,0|1,0,0]=2 2730 B15R2.1117 Nc1cccc(c1)SCc2ccon2 62a_100000210019_100000234950 [0,1,0,0,0,0|3,0,0]=4 2731 B15R2.1117 Nc1cccc(c1)SCc2ccon2 62a_100000234950_100000210019 [0,1,0,0,0,0|3,0,0]=4 2732 B15R2.1117 Nc1cccc(c1)SCc2ccsc2 62a_100000210019_100011233845 [0,1,0,0,0,0|3,0,0]=4 2733 B15R2.1117 Nc1cccc(c1)SCc2ccsc2 62a_100011261437_100000210019 [0,1,0,0,0,0|3,0,0]=4 2734 B15R2.1117 Nc1cccc(c1)SCc2cncs2 62a_100000210019_100015185245 [0,1,0,0,0,0|2,0,1]=4 2735 B15R2.1117 Nc1cccc(c1)SCc2cncs2 62a_100015185245_100000210019 [0,1,0,0,0,0|2,0,1]=4 2736 B15R2.1117 Nc1cccc(c1)SCc2cscn2 62a_100000205941_100000210019 [0,1,0,0,0,0|2,0,0]=3 2737 B15R2.1117 Nc1cccc(c1)SCc2cscn2 62a_100000210019_100000205941 [0,1,0,0,0,0|2,0,0]=3 2738 B15R2.1117 Nc1cccc(c1)SCc2ncc[nH]2 62a_100000210019_100016991755 [0,1,0,0,0,0|3,0,0]=4 2739 B15R2.1117 Nc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100000210019 [0,1,0,0,0,0|3,0,0]=4 2740 B15R2.1117 Nc1cccc(c1)SCc2ncco2 62a_100000210019_103436540062 [0,1,0,0,0,0|3,0,0]=4 2741 B15R2.1117 Nc1cccc(c1)SCc2ncco2 62a_103436540062_100000210019 [0,1,0,0,0,0|3,0,0]=4 2742 B15R2.1117 Nc1cccc(c1)SCc2nccs2 62a_100000210019_100015184050 [0,1,0,0,0,0|3,0,0]=4 2743 B15R2.1117 Nc1cccc(c1)SCc2nccs2 62a_100015184050_100000210019 [0,1,0,0,0,0|3,0,0]=4 2744 B15R2.1117 Nc1cccc(c1)SCc2ncon2 62a_100000210019_100000233494 [0,1,0,0,0,0|3,0,0]=4 2745 B15R2.1117 Nc1cccc(c1)SCc2ncon2 62a_100000233494_100000210019 [0,1,0,0,0,0|3,0,0]=4 2746 B15R2.1117 Nc1cccc(c1)SCn2cncn2 62a_100000210019_200020645497 [0,1,0,0,0,0|2,0,1]=4 2747 B15R2.1117 Nc1cccc(c1)SCn2cncn2 62a_200020645497_100000210019 [0,1,0,0,0,0|2,0,1]=4 2748 B15R2.1117 Nc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000740741 [0,1,0,0,0,0|2,0,0]=3 2749 B15R2.1117 Nc1cccc(n1)SCc2c[nH]cn2 62a_100000740741_100000707719 [0,1,0,0,0,0|2,0,0]=3 2750 B15R2.1117 Nc1cccc(n1)SCc2cscn2 62a_100000205941_100000740741 [0,1,0,0,0,0|3,0,0]=4 2751 B15R2.1117 Nc1cccc(n1)SCc2cscn2 62a_100000740741_100000205941 [0,1,0,0,0,0|3,0,0]=4 2752 B15R2.1117 Nc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100009814236 [0,1,0,0,0,0|2,0,0]=3 2753 B15R2.1117 Nc1ccnc(c1)SCc2c[nH]cn2 62a_100009814236_100000707719 [0,1,0,0,0,0|2,0,0]=3 2754 B15R2.1117 Nc1ccnc(c1)SCc2cscn2 62a_100000205941_100009814236 [0,1,0,0,0,0|3,0,0]=4 2755 B15R2.1117 Nc1ccnc(c1)SCc2cscn2 62a_100009814236_100000205941 [0,1,0,0,0,0|3,0,0]=4 2756 B15R2.1117 Nc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100000757536 [0,1,0,0,0,0|2,0,0]=3 2757 B15R2.1117 Nc1ccnc(n1)NCc2c[nH]nn2 27a_100020620823_100000757536 [0,1,0,0,0,0|3,0,0]=4 2758 B15R2.1117 Nc1ccnc(n1)NCc2cocn2 27a_100015188801_100000757536 [0,1,0,0,0,0|3,0,0]=4 2759 B15R2.1117 Nc1ccnc(n1)NCc2cscn2 27a_100015185402_100000757536 [0,1,0,0,0,0|3,0,0]=4 2760 B15R2.1117 Nc1ccnc(n1)SCc2c[nH]cn2 62a_100000707719_100000757536 [0,1,0,0,0,0|3,0,0]=4 2761 B15R2.1117 Nc1ccnc(n1)SCc2c[nH]cn2 62a_100000757536_100000707719 [0,1,0,0,0,0|3,0,0]=4 2762 B15R2.1117 Nc1cncc(c1)OCc2c[nH]cn2 34a_100011997051_100000707719 [0,1,0,0,0,0|2,0,0]=3 2763 B15R2.1117 Nc1cncc(c1)OCc2cscn2 34a_100011997051_100000205941 [0,1,0,0,0,0|3,0,0]=4 2764 B15R2.1117 Nc1cncc(c1)SCc2c[nH]cn2 62a_100000687067_100000707719 [0,1,0,0,0,0|2,0,0]=3 2765 B15R2.1117 Nc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000687067 [0,1,0,0,0,0|2,0,0]=3 2766 B15R2.1117 Nc1cncc(c1)SCc2cscn2 62a_100000205941_100000687067 [0,1,0,0,0,0|3,0,0]=4 2767 B15R2.1117 Nc1cncc(c1)SCc2cscn2 62a_100000687067_100000205941 [0,1,0,0,0,0|3,0,0]=4 2768 B15R2.1117 Nc1cncc(n1)SCc2c[nH]cn2 62a_100000707719_100000747728 [0,1,0,0,0,0|3,0,0]=4 2769 B15R2.1117 Nc1cncc(n1)SCc2c[nH]cn2 62a_100000747728_100000707719 [0,1,0,0,0,0|3,0,0]=4 2770 B15R2.1117 Nc1cnnc(c1)SCc2c[nH]cn2 62a_100000707719_100011996757 [0,1,0,0,0,0|3,0,0]=4 2771 B15R2.1117 Nc1cnnc(c1)SCc2c[nH]cn2 62a_100011996757_100000707719 [0,1,0,0,0,0|3,0,0]=4 2772 B15R2.1117 Nc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100000055538 [0,1,0,0,0,0|2,0,0]=3 2773 B15R2.1117 Nc1nccc(n1)NCc2c[nH]nn2 27a_100020620823_100000055538 [0,1,0,0,0,0|3,0,0]=4 2774 B15R2.1117 Nc1nccc(n1)NCc2cocn2 27a_100015188801_100000055538 [0,1,0,0,0,0|3,0,0]=4 2775 B15R2.1117 Nc1nccc(n1)NCc2cscn2 27a_100015185402_100000055538 [0,1,0,0,0,0|3,0,0]=4 2776 B15R2.1117 Nc1nccc(n1)SCc2c[nH]cn2 62a_100000055538_100000707719 [0,1,0,0,0,0|3,0,0]=4 2777 B15R2.1117 Nc1nccc(n1)SCc2c[nH]cn2 62a_100000707719_100000055538 [0,1,0,0,0,0|3,0,0]=4 2778 B15R2.1117 Nc1ncnc(n1)NCc2c[nH]cn2 27a_100000758547_100000123831 [0,1,0,0,0,0|3,0,0]=4 2779 B15R2.1117 O=c1cc(cc[nH]1)NCc2c[nH]cn2 27a_100000758547_100000061649 [0,1,0,0,0,0|1,0,0]=2 2780 B15R2.1117 O=c1cc(cc[nH]1)NCc2c[nH]nn2 27a_100020620823_100000061649 [0,1,0,0,0,0|2,0,0]=3 2781 B15R2.1117 O=c1cc(cc[nH]1)NCc2cc[nH]n2 27a_100000739516_100000061649 [0,1,0,0,0,0|3,0,0]=4 2782 B15R2.1117 O=c1cc(cc[nH]1)NCc2ccco2 27a_100000185738_100000061649 [0,1,0,0,0,0|3,0,0]=4 2783 B15R2.1117 O=c1cc(cc[nH]1)NCc2cccs2 27a_100000211653_100000061649 [0,1,0,0,0,0|3,0,0]=4 2784 B15R2.1117 O=c1cc(cc[nH]1)NCc2ccoc2 27a_100015206860_100000061649 [0,1,0,0,0,0|3,0,0]=4 2785 B15R2.1117 O=c1cc(cc[nH]1)NCc2ccon2 27a_100000688301_100000061649 [0,1,0,0,0,0|3,0,0]=4 2786 B15R2.1117 O=c1cc(cc[nH]1)NCc2ccsc2 27a_100000186416_100000061649 [0,1,0,0,0,0|3,0,0]=4 2787 B15R2.1117 O=c1cc(cc[nH]1)NCc2cn[nH]c2 27a_100000737208_100000061649 [0,1,0,0,0,0|3,0,0]=4 2788 B15R2.1117 O=c1cc(cc[nH]1)NCc2cnco2 27a_100020634212_100000061649 [0,1,0,0,0,0|2,0,1]=4 2789 B15R2.1117 O=c1cc(cc[nH]1)NCc2cncs2 27a_100016987365_100000061649 [0,1,0,0,0,0|2,0,1]=4 2790 B15R2.1117 O=c1cc(cc[nH]1)NCc2cocn2 27a_100015188801_100000061649 [0,1,0,0,0,0|2,0,0]=3 2791 B15R2.1117 O=c1cc(cc[nH]1)NCc2cscn2 27a_100015185402_100000061649 [0,1,0,0,0,0|2,0,0]=3 2792 B15R2.1117 O=c1cc(cc[nH]1)NCc2ncc[nH]2 27a_100000754540_100000061649 [0,1,0,0,0,0|3,0,0]=4 2793 B15R2.1117 O=c1cc(cc[nH]1)NCc2ncco2 27a_100016994969_100000061649 [0,1,0,0,0,0|3,0,0]=4 2794 B15R2.1117 O=c1cc(cc[nH]1)NCc2nccs2 27a_100000740555_100000061649 [0,1,0,0,0,0|3,0,0]=4 2795 B15R2.1117 O=c1cc(cc[nH]1)OCc2c[nH]cn2 34a_100000032262_100000707719 [0,1,0,0,0,0|2,0,0]=3 2796 B15R2.1117 O=c1cc(cc[nH]1)OCc2cscn2 34a_100000032262_100000205941 [0,1,0,0,0,0|3,0,0]=4 2797 B15R2.1117 O=c1cc(cc[nH]1)SCc2c[nH]cn2 62a_100000707719_100009816521 [0,1,0,0,0,0|2,0,0]=3 2798 B15R2.1117 O=c1cc(cc[nH]1)SCc2c[nH]cn2 62a_100009816521_100000707719 [0,1,0,0,0,0|2,0,0]=3 2799 B15R2.1117 O=c1cc(cc[nH]1)SCc2cscn2 62a_100000205941_100009816521 [0,1,0,0,0,0|3,0,0]=4 2800 B15R2.1117 O=c1cc(cc[nH]1)SCc2cscn2 62a_100009816521_100000205941 [0,1,0,0,0,0|3,0,0]=4 2801 B15R2.1117 O=c1cc(cn[nH]1)SCc2c[nH]cn2 62a_100000707719_100010197405 [0,1,0,0,0,0|3,0,0]=4 2802 B15R2.1117 O=c1cc(nc[nH]1)SCc2c[nH]cn2 62a_100012002517_100000707719 [0,1,0,0,0,0|3,0,0]=4 2803 B15R2.1117 O=c1cc[nH]c(c1)SCc2c[nH]cn2 62a_100009817434_100000707719 [0,1,0,0,0,0|2,0,0]=3 2804 B15R2.1117 O=c1cc[nH]c(c1)SCc2cscn2 62a_100009817434_100000205941 [0,1,0,0,0,0|3,0,0]=4 2805 B15R2.1117 O=c1cccc([nH]1)OCc2c[nH]cn2 34a_100000033347_100000707719 [0,1,0,0,0,0|2,0,0]=3 2806 B15R2.1117 O=c1cccc([nH]1)OCc2cscn2 34a_100000033347_100000205941 [0,1,0,0,0,0|3,0,0]=4 2807 B15R2.1117 O=c1cccc([nH]1)SCc2c[nH]cn2 62a_100000707719_100000752884 [0,1,0,0,0,0|2,0,0]=3 2808 B15R2.1117 O=c1cccc([nH]1)SCc2cscn2 62a_100000205941_100000752884 [0,1,0,0,0,0|3,0,0]=4 2809 B15R2.1117 O=c1nc(cc[nH]1)NCc2c[nH]cn2 27a_100000758547_200000134032 [0,1,0,0,0,0|2,0,0]=3 2810 B15R2.1117 O=c1nc(cc[nH]1)NCc2c[nH]nn2 27a_100020620823_200000134032 [0,1,0,0,0,0|3,0,0]=4 2811 B15R2.1117 O=c1nc(cc[nH]1)NCc2cocn2 27a_100015188801_200000134032 [0,1,0,0,0,0|3,0,0]=4 2812 B15R2.1117 O=c1nc(cc[nH]1)NCc2cscn2 27a_100015185402_200000134032 [0,1,0,0,0,0|3,0,0]=4 2813 B15R2.1117 O=c1nc(cc[nH]1)SCc2c[nH]cn2 62a_100000707719_200000134032 [0,1,0,0,0,0|3,0,0]=4 2814 B15R2.1117 Oc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000765262 [0,1,0,0,0,0|2,0,0]=3 2815 B15R2.1117 Oc1cc(ncn1)NCc2c[nH]nn2 27a_100020620823_100000765262 [0,1,0,0,0,0|3,0,0]=4 2816 B15R2.1117 Oc1cc(ncn1)NCc2cocn2 27a_100015188801_100000765262 [0,1,0,0,0,0|3,0,0]=4 2817 B15R2.1117 Oc1cc(ncn1)NCc2cscn2 27a_100015185402_100000765262 [0,1,0,0,0,0|3,0,0]=4 2818 B15R2.1117 Oc1cc(ncn1)SCc2c[nH]cn2 62a_100000707719_100000765262 [0,1,0,0,0,0|3,0,0]=4 2819 B15R2.1117 Oc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100011660834 [0,1,0,0,0,0|2,0,0]=3 2820 B15R2.1117 Oc1cccc(c1)CSc2c[nH]cn2 62a_100011660834_100000756875 [0,1,0,0,0,0|2,0,0]=3 2821 B15R2.1117 Oc1cccc(c1)CSc2c[nH]nn2 62a_100009819707_100011660834 [0,1,0,0,0,0|3,0,0]=4 2822 B15R2.1117 Oc1cccc(c1)CSc2c[nH]nn2 62a_100011660834_100009819707 [0,1,0,0,0,0|3,0,0]=4 2823 B15R2.1117 Oc1cccc(c1)CSc2cscn2 62a_100000751502_100011660834 [0,1,0,0,0,0|3,0,0]=4 2824 B15R2.1117 Oc1cccc(c1)CSc2cscn2 62a_100011660834_100000751502 [0,1,0,0,0,0|3,0,0]=4 2825 B15R2.1117 Oc1cccc(c1)CSc2nc[nH]n2 62a_100000761765_100011660834 [0,1,0,0,0,0|3,0,0]=4 2826 B15R2.1117 Oc1cccc(c1)CSc2nc[nH]n2 62a_100011660834_100000761765 [0,1,0,0,0,0|3,0,0]=4 2827 B15R2.1117 Oc1cccc(c1)NCC2=NCCN2 34a_100000210217_100000737910 [0,1,0,0,0,0|2,0,1]=4 2828 B15R2.1117 Oc1cccc(c1)NCc2c[nH]cn2 34a_100000210217_100000707719 [0,1,0,0,0,0|0,0,0]=1 2829 B15R2.1117 Oc1cccc(c1)NCc2ccco2 270302a_100000210217_100000186105 [0,1,0,0,0,0|2,0,0]=3 2830 B15R2.1117 Oc1cccc(c1)NCc2cccs2 270302a_100000210217_100000209959 [0,1,0,0,0,0|2,0,0]=3 2831 B15R2.1117 Oc1cccc(c1)NCc2ccn[nH]2 34a_100000210217_100000728653 [0,1,0,0,0,0|2,0,1]=4 2832 B15R2.1117 Oc1cccc(c1)NCc2ccon2 34a_100000210217_100000234950 [0,1,0,0,0,0|2,0,0]=3 2833 B15R2.1117 Oc1cccc(c1)NCc2ccsc2 270302a_100000210217_100000188534 [0,1,0,0,0,0|2,0,0]=3 2834 B15R2.1117 Oc1cccc(c1)NCc2ccsc2 34a_100000210217_100011261437 [0,1,0,0,0,0|2,0,0]=3 2835 B15R2.1117 Oc1cccc(c1)NCc2cn[nH]c2 270302a_100000210217_100016992096 [0,1,0,0,0,0|2,0,0]=3 2836 B15R2.1117 Oc1cccc(c1)NCc2cncs2 270302a_100000210217_100000749870 [0,1,0,0,0,0|1,0,1]=3 2837 B15R2.1117 Oc1cccc(c1)NCc2cncs2 34a_100000210217_100015185245 [0,1,0,0,0,0|1,0,1]=3 2838 B15R2.1117 Oc1cccc(c1)NCc2cscn2 270302a_100000210217_100000743575 [0,1,0,0,0,0|1,0,0]=2 2839 B15R2.1117 Oc1cccc(c1)NCc2cscn2 34a_100000210217_100000205941 [0,1,0,0,0,0|1,0,0]=2 2840 B15R2.1117 Oc1cccc(c1)NCc2ncc[nH]2 34a_100000210217_100016991755 [0,1,0,0,0,0|2,0,0]=3 2841 B15R2.1117 Oc1cccc(c1)NCc2ncco2 34a_100000210217_103436540062 [0,1,0,0,0,0|2,0,0]=3 2842 B15R2.1117 Oc1cccc(c1)NCc2nccs2 270302a_100000210217_100000750902 [0,1,0,0,0,0|2,0,0]=3 2843 B15R2.1117 Oc1cccc(c1)NCc2nccs2 34a_100000210217_100015184050 [0,1,0,0,0,0|2,0,0]=3 2844 B15R2.1117 Oc1cccc(c1)NCc2ncon2 34a_100000210217_100000233494 [0,1,0,0,0,0|2,0,0]=3 2845 B15R2.1117 Oc1cccc(c1)NCc2nnn[nH]2 34a_100000210217_100000765167 [0,1,0,0,0,0|2,0,1]=4 2846 B15R2.1117 Oc1cccc(c1)NCn2cncn2 34a_100000210217_200020645497 [0,1,0,0,0,0|1,0,1]=3 2847 B15R2.1117 Oc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000211634 [0,1,0,0,0,0|1,0,0]=2 2848 B15R2.1117 Oc1cccc(c1)SCc2ccon2 62a_100000234950_100000211634 [0,1,0,0,0,0|3,0,0]=4 2849 B15R2.1117 Oc1cccc(c1)SCc2ccsc2 62a_100011261437_100000211634 [0,1,0,0,0,0|3,0,0]=4 2850 B15R2.1117 Oc1cccc(c1)SCc2cncs2 62a_100015185245_100000211634 [0,1,0,0,0,0|2,0,1]=4 2851 B15R2.1117 Oc1cccc(c1)SCc2cscn2 62a_100000205941_100000211634 [0,1,0,0,0,0|2,0,0]=3 2852 B15R2.1117 Oc1cccc(c1)SCc2ncc[nH]2 62a_100016991755_100000211634 [0,1,0,0,0,0|3,0,0]=4 2853 B15R2.1117 Oc1cccc(c1)SCc2ncco2 62a_103436540062_100000211634 [0,1,0,0,0,0|3,0,0]=4 2854 B15R2.1117 Oc1cccc(c1)SCc2nccs2 62a_100015184050_100000211634 [0,1,0,0,0,0|3,0,0]=4 2855 B15R2.1117 Oc1cccc(c1)SCc2ncon2 62a_100000233494_100000211634 [0,1,0,0,0,0|3,0,0]=4 2856 B15R2.1117 Oc1cccc(c1)SCn2cncn2 62a_200020645497_100000211634 [0,1,0,0,0,0|2,0,1]=4 2857 B15R2.1117 Oc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100000762945 [0,1,0,0,0,0|2,0,0]=3 2858 B15R2.1117 Oc1ccnc(c1)SCc2cscn2 62a_100000205941_100000762945 [0,1,0,0,0,0|3,0,0]=4 2859 B15R2.1117 Oc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100011649813 [0,1,0,0,0,0|2,0,0]=3 2860 B15R2.1117 Oc1ccnc(n1)NCc2c[nH]nn2 27a_100020620823_100011649813 [0,1,0,0,0,0|3,0,0]=4 2861 B15R2.1117 Oc1ccnc(n1)NCc2cocn2 27a_100015188801_100011649813 [0,1,0,0,0,0|3,0,0]=4 2862 B15R2.1117 Oc1ccnc(n1)NCc2cscn2 27a_100015185402_100011649813 [0,1,0,0,0,0|3,0,0]=4 2863 B15R2.1117 Oc1ccnc(n1)SCc2c[nH]cn2 62a_100000707719_100011649813 [0,1,0,0,0,0|3,0,0]=4 2864 B15R2.1117 Oc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000754920 [0,1,0,0,0,0|2,0,0]=3 2865 B15R2.1117 Oc1cncc(c1)SCc2c[nH]cn2 62a_100000754920_100000707719 [0,1,0,0,0,0|2,0,0]=3 2866 B15R2.1117 Oc1cncc(c1)SCc2cscn2 62a_100000205941_100000754920 [0,1,0,0,0,0|3,0,0]=4 2867 B15R2.1117 Oc1cncc(c1)SCc2cscn2 62a_100000754920_100000205941 [0,1,0,0,0,0|3,0,0]=4 2868 B15R2.1117 Oc1cncc(n1)SCc2c[nH]cn2 62a_100000707719_100011269956 [0,1,0,0,0,0|3,0,0]=4 2869 B15R2.1117 Oc1cnnc(c1)SCc2c[nH]cn2 62a_100000707719_200010734679 [0,1,0,0,0,0|3,0,0]=4 2870 B15R2.1117 [O-][n+]1cccc(c1)OCc2c[nH]cn2 34a_100000039713_100000707719 [0,1,0,0,0,0|2,0,0]=3 2871 B15R2.1117 [O-][n+]1cccc(c1)OCc2cscn2 34a_100000039713_100000205941 [0,1,0,0,0,0|3,0,0]=4 2872 B15R2.1117 [O-][n+]1cccc(c1)OCc2cscn2 7a_100000039713_100000205941 [0,1,0,0,0,0|3,0,0]=4 2873 B15R2.1117 [O-][n+]1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100009815978 [0,1,0,0,0,0|2,0,0]=3 2874 B15R2.1117 [O-][n+]1cccc(c1)SCc2cscn2 62a_100000205941_100009815978 [0,1,0,0,0,0|3,0,0]=4 2875 B15R2.1117 [O-][n+]1ccnc(c1)NCc2c[nH]cn2 27a_100000758547_100009880115 [0,1,0,0,0,0|2,0,0]=3 2876 B15R2.1117 [O-][n+]1ccnc(c1)NCc2c[nH]nn2 27a_100020620823_100009880115 [0,1,0,0,0,0|3,0,0]=4 2877 B15R2.1117 [O-][n+]1ccnc(c1)NCc2cocn2 27a_100015188801_100009880115 [0,1,0,0,0,0|3,0,0]=4 2878 B15R2.1117 [O-][n+]1ccnc(c1)NCc2cscn2 27a_100015185402_100009880115 [0,1,0,0,0,0|3,0,0]=4 2879 B15R2.1117 [O-][n+]1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100009880115 [0,1,0,0,0,0|3,0,0]=4 2880 B15R2.1117 [S]c1cccc(c1)SCc2c[nH]cn2 62a_100000707719_114929384022 [0,1,0,0,0,0|1,0,0]=2 2881 B15R2.1117 [S]c1cccc(c1)SCc2c[nH]cn2 62a_114929384022_100000707719 [0,1,0,0,0,0|1,0,0]=2 2882 B15R2.1117 [S]c1cccc(c1)SCc2ccon2 62a_100000234950_114929384022 [0,1,0,0,0,0|3,0,0]=4 2883 B15R2.1117 [S]c1cccc(c1)SCc2ccon2 62a_114929384022_100000234950 [0,1,0,0,0,0|3,0,0]=4 2884 B15R2.1117 [S]c1cccc(c1)SCc2ccsc2 62a_100011261437_114929384022 [0,1,0,0,0,0|3,0,0]=4 2885 B15R2.1117 [S]c1cccc(c1)SCc2ccsc2 62a_114929384022_100011233845 [0,1,0,0,0,0|3,0,0]=4 2886 B15R2.1117 [S]c1cccc(c1)SCc2cncs2 62a_100015185245_114929384022 [0,1,0,0,0,0|2,0,1]=4 2887 B15R2.1117 [S]c1cccc(c1)SCc2cncs2 62a_114929384022_100015185245 [0,1,0,0,0,0|2,0,1]=4 2888 B15R2.1117 [S]c1cccc(c1)SCc2cscn2 62a_100000205941_114929384022 [0,1,0,0,0,0|2,0,0]=3 2889 B15R2.1117 [S]c1cccc(c1)SCc2cscn2 62a_114929384022_100000205941 [0,1,0,0,0,0|2,0,0]=3 2890 B15R2.1117 [S]c1cccc(c1)SCc2ncc[nH]2 62a_100016991755_114929384022 [0,1,0,0,0,0|3,0,0]=4 2891 B15R2.1117 [S]c1cccc(c1)SCc2ncc[nH]2 62a_114929384022_100016991755 [0,1,0,0,0,0|3,0,0]=4 2892 B15R2.1117 [S]c1cccc(c1)SCc2ncco2 62a_103436540062_114929384022 [0,1,0,0,0,0|3,0,0]=4 2893 B15R2.1117 [S]c1cccc(c1)SCc2ncco2 62a_114929384022_103436540062 [0,1,0,0,0,0|3,0,0]=4 2894 B15R2.1117 [S]c1cccc(c1)SCc2nccs2 62a_100015184050_114929384022 [0,1,0,0,0,0|3,0,0]=4 2895 B15R2.1117 [S]c1cccc(c1)SCc2nccs2 62a_114929384022_100015184050 [0,1,0,0,0,0|3,0,0]=4 2896 B15R2.1117 [S]c1cccc(c1)SCc2ncon2 62a_100000233494_114929384022 [0,1,0,0,0,0|3,0,0]=4 2897 B15R2.1117 [S]c1cccc(c1)SCc2ncon2 62a_114929384022_100000233494 [0,1,0,0,0,0|3,0,0]=4 2898 B15R2.1117 [S]c1cccc(c1)SCn2cncn2 62a_114929384022_200020645497 [0,1,0,0,0,0|2,0,1]=4 2899 B15R2.1117 [S]c1cccc(c1)SCn2cncn2 62a_200020645497_114929384022 [0,1,0,0,0,0|2,0,1]=4 2900 B15R2.1259 CC(Cc1c[nH]cn1)c2ccccc2 271570a_100000062452_100000756875 [0,1,0,0,0,0|1,0,0]=2 2901 B15R2.1259 CC(Cc1cc[nH]n1)c2ccccc2 271570a_100000062452_100000062575 [0,1,0,0,0,0|3,0,0]=4 2902 B15R2.1259 CC(Cc1ccco1)c2ccccc2 271570a_100000062452_100009814098 [0,1,0,0,0,0|3,0,0]=4 2903 B15R2.1259 CC(Cc1cccs1)c2ccccc2 271570a_100000062452_100011215356 [0,1,0,0,0,0|3,0,0]=4 2904 B15R2.1259 CC(Cc1ccoc1)c2ccccc2 271570a_100000062452_100011215275 [0,1,0,0,0,0|3,0,0]=4 2905 B15R2.1259 CC(Cc1ccsc1)c2ccccc2 271570a_100000062452_100000738268 [0,1,0,0,0,0|3,0,0]=4 2906 B15R2.1259 CC(Cc1ccsn1)c2ccccc2 271570a_100000062452_100009818082 [0,1,0,0,0,0|3,0,0]=4 2907 B15R2.1259 CC(Cc1cn[nH]c1)c2ccccc2 271570a_100000062452_100000238712 [0,1,0,0,0,0|3,0,0]=4 2908 B15R2.1259 CC(Cc1cnco1)c2ccccc2 271570a_100000062452_100020591547 [0,1,0,0,0,0|2,0,1]=4 2909 B15R2.1259 CC(Cc1cncs1)c2ccccc2 271570a_100000062452_100011934649 [0,1,0,0,0,0|2,0,1]=4 2910 B15R2.1259 CC(Cc1cscn1)c2ccccc2 271570a_100000062452_100000751502 [0,1,0,0,0,0|2,0,0]=3 2911 B15R2.1259 CC(Cc1nc[nH]n1)c2ccccc2 271570a_100000062452_100000761765 [0,1,0,0,0,0|2,0,0]=3 2912 B15R2.1259 CC(Cc1ncc[nH]1)c2ccccc2 271570a_100000062452_100025796157 [0,1,0,0,0,0|3,0,0]=4 2913 B15R2.1259 CC(Cc1ncco1)c2ccccc2 271570a_100000062452_100011787736 [0,1,0,0,0,0|3,0,0]=4 2914 B15R2.1259 CC(Cc1nccs1)c2ccccc2 271570a_100000062452_100000211983 [0,1,0,0,0,0|3,0,0]=4 2915 B15R2.1259 CC(Cc1ncns1)c2ccccc2 271570a_100000062452_100000693119 [0,1,0,0,0,0|2,0,1]=4 2916 B15R2.1259 CC(Sc1c[nH]cn1)c2ccccc2 62a_100000230085_100000756875 [0,1,0,0,0,0|2,0,0]=3 2917 B15R2.1259 CC(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_100000230085 [0,1,0,0,0,0|2,0,0]=3 2918 B15R2.1259 CC(Sc1c[nH]nn1)c2ccccc2 62a_100000230085_100009819707 [0,1,0,0,0,0|3,0,0]=4 2919 B15R2.1259 CC(Sc1c[nH]nn1)c2ccccc2 62a_100009819707_100000230085 [0,1,0,0,0,0|3,0,0]=4 2920 B15R2.1259 CC(Sc1cscn1)c2ccccc2 62a_100000230085_100000751502 [0,1,0,0,0,0|3,0,0]=4 2921 B15R2.1259 CC(Sc1cscn1)c2ccccc2 62a_100000751502_100000230085 [0,1,0,0,0,0|3,0,0]=4 2922 B15R2.1259 CC(Sc1nc[nH]n1)c2ccccc2 62a_100000230085_100000761765 [0,1,0,0,0,0|3,0,0]=4 2923 B15R2.1259 CC(Sc1nc[nH]n1)c2ccccc2 62a_100000761765_100000230085 [0,1,0,0,0,0|3,0,0]=4 2924 B15R2.1259 CN(CC1=NCCN1)c2ccccc2 269982a_100000210012_100000737910 [0,1,0,0,0,0|2,0,1]=4 2925 B15R2.1259 CN(CC1=NCCN1)c2ccccc2 34a_100000210012_100000737910 [0,1,0,0,0,0|2,0,1]=4 2926 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 2230a_100000210012_100000707719 [0,1,0,0,0,0|0,0,0]=1 2927 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 269982a_100000210012_100000707719 [0,1,0,0,0,0|0,0,0]=1 2928 B15R2.1259 CN(Cc1c[nH]cn1)c2ccccc2 34a_100000210012_100000707719 [0,1,0,0,0,0|0,0,0]=1 2929 B15R2.1259 CN(Cc1ccco1)c2ccccc2 2230a_100000230375_200000210301 [0,1,0,0,0,0|2,0,0]=3 2930 B15R2.1259 CN(Cc1ccco1)c2ccccc2 269982a_100000230375_200000210301 [0,1,0,0,0,0|2,0,0]=3 2931 B15R2.1259 CN(Cc1ccco1)c2ccccc2 34a_100000230375_200000210301 [0,1,0,0,0,0|2,0,0]=3 2932 B15R2.1259 CN(Cc1ccn[nH]1)c2ccccc2 2230a_100000210012_100000728653 [0,1,0,0,0,0|2,0,1]=4 2933 B15R2.1259 CN(Cc1ccn[nH]1)c2ccccc2 269982a_100000210012_100000728653 [0,1,0,0,0,0|2,0,1]=4 2934 B15R2.1259 CN(Cc1ccn[nH]1)c2ccccc2 34a_100000210012_100000728653 [0,1,0,0,0,0|2,0,1]=4 2935 B15R2.1259 CN(Cc1ccon1)c2ccccc2 2230a_100000210012_100000234950 [0,1,0,0,0,0|2,0,0]=3 2936 B15R2.1259 CN(Cc1ccon1)c2ccccc2 269982a_100000210012_100000234950 [0,1,0,0,0,0|2,0,0]=3 2937 B15R2.1259 CN(Cc1ccon1)c2ccccc2 34a_100000210012_100000234950 [0,1,0,0,0,0|2,0,0]=3 2938 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 2230a_100000210012_100011261437 [0,1,0,0,0,0|2,0,0]=3 2939 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 269982a_100000210012_100011233845 [0,1,0,0,0,0|2,0,0]=3 2940 B15R2.1259 CN(Cc1ccsc1)c2ccccc2 34a_100000210012_100011261437 [0,1,0,0,0,0|2,0,0]=3 2941 B15R2.1259 CN(Cc1cncs1)c2ccccc2 2230a_100000210012_100015185245 [0,1,0,0,0,0|1,0,1]=3 2942 B15R2.1259 CN(Cc1cncs1)c2ccccc2 269982a_100000210012_100015185245 [0,1,0,0,0,0|1,0,1]=3 2943 B15R2.1259 CN(Cc1cncs1)c2ccccc2 34a_100000210012_100015185245 [0,1,0,0,0,0|1,0,1]=3 2944 B15R2.1259 CN(Cc1cscn1)c2ccccc2 2230a_100000210012_100000205941 [0,1,0,0,0,0|1,0,0]=2 2945 B15R2.1259 CN(Cc1cscn1)c2ccccc2 269982a_100000210012_100000205941 [0,1,0,0,0,0|1,0,0]=2 2946 B15R2.1259 CN(Cc1cscn1)c2ccccc2 34a_100000210012_100000205941 [0,1,0,0,0,0|1,0,0]=2 2947 B15R2.1259 CN(Cc1cscn1)c2cccnn2 27a_100000225794_100016991348 [0,1,0,0,0,0|3,0,0]=4 2948 B15R2.1259 CN(Cc1cscn1)c2ccncn2 27a_100000225794_100000703185 [0,1,0,0,0,0|3,0,0]=4 2949 B15R2.1259 CN(Cc1cscn1)c2cnccn2 27a_100000225794_100000211759 [0,1,0,0,0,0|3,0,0]=4 2950 B15R2.1259 CN(Cc1cscn1)c2ncccn2 27a_100000225794_100000211032 [0,1,0,0,0,0|3,0,0]=4 2951 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 2230a_100000210012_100016991755 [0,1,0,0,0,0|2,0,0]=3 2952 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 269982a_100000210012_100016991755 [0,1,0,0,0,0|2,0,0]=3 2953 B15R2.1259 CN(Cc1ncc[nH]1)c2ccccc2 34a_100000210012_100016991755 [0,1,0,0,0,0|2,0,0]=3 2954 B15R2.1259 CN(Cc1ncco1)c2ccccc2 2230a_100000210012_103436540062 [0,1,0,0,0,0|2,0,0]=3 2955 B15R2.1259 CN(Cc1ncco1)c2ccccc2 269982a_100000210012_103436540062 [0,1,0,0,0,0|2,0,0]=3 2956 B15R2.1259 CN(Cc1ncco1)c2ccccc2 34a_100000210012_103436540062 [0,1,0,0,0,0|2,0,0]=3 2957 B15R2.1259 CN(Cc1nccs1)c2ccccc2 2230a_100000210012_100015184050 [0,1,0,0,0,0|2,0,0]=3 2958 B15R2.1259 CN(Cc1nccs1)c2ccccc2 269982a_100000210012_100015184050 [0,1,0,0,0,0|2,0,0]=3 2959 B15R2.1259 CN(Cc1nccs1)c2ccccc2 34a_100000210012_100015184050 [0,1,0,0,0,0|2,0,0]=3 2960 B15R2.1259 CN(Cc1ncon1)c2ccccc2 269982a_100000210012_100000233494 [0,1,0,0,0,0|2,0,0]=3 2961 B15R2.1259 CN(Cc1ncon1)c2ccccc2 34a_100000210012_100000233494 [0,1,0,0,0,0|2,0,0]=3 2962 B15R2.1259 CN(Cc1nnn[nH]1)c2ccccc2 269982a_100000210012_100000765167 [0,1,0,0,0,0|2,0,1]=4 2963 B15R2.1259 CN(Cc1nnn[nH]1)c2ccccc2 34a_100000210012_100000765167 [0,1,0,0,0,0|2,0,1]=4 2964 B15R2.1259 CN(Cn1cncn1)c2ccccc2 2230a_100000210012_200020645497 [0,1,0,0,0,0|1,0,1]=3 2965 B15R2.1259 CN(Cn1cncn1)c2ccccc2 269982a_100000210012_200020645497 [0,1,0,0,0,0|1,0,1]=3 2966 B15R2.1259 CN(Cn1cncn1)c2ccccc2 34a_100000210012_200020645497 [0,1,0,0,0,0|1,0,1]=3 2967 B15R2.1259 O=C(Cc1c[nH]cn1)c2ccccc2 1458a_100000185807_100000707719 [0,1,0,0,0,0|1,0,0]=2 2968 B15R2.1259 O=C(Cc1ccon1)c2ccccc2 1458a_100000185807_100000234950 [0,1,0,0,0,0|3,0,0]=4 2969 B15R2.1259 O=C(Cc1ccsc1)c2ccccc2 1458a_100000185807_100011233845 [0,1,0,0,0,0|3,0,0]=4 2970 B15R2.1259 O=C(Cc1cncs1)c2ccccc2 1458a_100000185807_100015185245 [0,1,0,0,0,0|2,0,1]=4 2971 B15R2.1259 O=C(Cc1cscn1)c2ccccc2 1458a_100000185807_100000205941 [0,1,0,0,0,0|2,0,0]=3 2972 B15R2.1259 O=C(Cc1ncco1)c2ccccc2 1458a_100000185807_103436540062 [0,1,0,0,0,0|3,0,0]=4 2973 B15R2.1259 O=C(Cc1nccs1)c2ccccc2 1458a_100000185807_100015184050 [0,1,0,0,0,0|3,0,0]=4 2974 B15R2.1259 O=C(Cn1cncn1)c2ccccc2 1458a_100000185807_200020645497 [0,1,0,0,0,0|2,0,1]=4 2975 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 2230a_100000230375_200025704644 [0,1,0,0,0,0|2,0,0]=3 2976 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 269982a_100000230375_200025704644 [0,1,0,0,0,0|2,0,0]=3 2977 B15R2.1259 [13CH3]N(Cc1ccco1)c2ccccc2 34a_100000230375_200025704644 [0,1,0,0,0,0|2,0,0]=3 2978 B13R1.42 C=COC(=O)CNc1ccccc1 34a_100000106764_100000036128 [0,0,1,0,0,0|3,0,0]=4 2979 B13R1.119 C/C=C/C=C/COCc1c[nH]cn1 34a_100016283227_100000707719 [0,0,1,0,0,0|1,0,2]=4 2980 B13R1.153 C=CC=CC(=O)CCc1c[nH]cn1 1458a_100016291481_100020628418 [0,0,1,0,0,0|2,0,0]=3 2981 B13R1.153 C=CC=CC(=O)NCc1ccco1 1626a_100000185738_100016291481 [0,0,1,0,0,0|3,0,0]=4 2982 B13R1.153 C=CC=CC(=O)NCc1cccs1 1626a_100000211653_100016291481 [0,0,1,0,0,0|3,0,0]=4 2983 B13R1.153 C=CC=CC(=O)NCc1ccoc1 1626a_100015206860_100016291481 [0,0,1,0,0,0|3,0,0]=4 2984 B13R1.153 C=CC=CC(=O)NCc1ccsc1 1626a_100000186416_100016291481 [0,0,1,0,0,0|3,0,0]=4 2985 B13R1.153 C=CC=CC(=O)NCc1cscn1 1626a_100015185402_100016291481 [0,0,1,0,0,0|2,0,0]=3 2986 B13R1.153 C=CC=CC(=O)NCc1ncco1 1626a_100016994969_100016291481 [0,0,1,0,0,0|3,0,0]=4 2987 B13R1.153 C=CC=CC(=O)NCc1nccs1 1626a_100000740555_100016291481 [0,0,1,0,0,0|3,0,0]=4 2988 B13R1.153 C=CCCC(=O)NCc1c[nH]cn1 11a_100000758547_100000749702 [0,0,1,0,0,0|1,0,2]=4 2989 B13R1.153 C=CCCC(=O)NCc1c[nH]cn1 240690a_100000758547_100000749702 [0,0,1,0,0,0|1,0,2]=4 2990 B13R1.153 C=CCCC(=O)NCc1c[nH]cn1 527a_100000758547_100000749702 [0,0,1,0,0,0|1,0,2]=4 2991 B13R1.153 C=CCNC(=O)NCc1c[nH]cn1 2708a_100000758547_100020586998 [0,0,1,0,0,0|2,0,1]=4 2992 B13R1.153 C=CCNC(=O)NCc1c[nH]cn1 273464a_100000758547_100020586998 [0,0,1,0,0,0|2,0,1]=4 2993 B13R1.153 C=CCNC(=O)NCc1c[nH]cn1 273464a_100020586998_100000758547 [0,0,1,0,0,0|2,0,1]=4 2994 B13R1.153 C=CCNC(=O)NCc1c[nH]cn1 512a_100000758547_100020586998 [0,0,1,0,0,0|2,0,1]=4 2995 B13R1.153 C=CCNC(=O)NCc1c[nH]cn1 512a_100020586998_100000758547 [0,0,1,0,0,0|2,0,1]=4 2996 B13R1.153 CC=CCC(=O)NCc1c[nH]cn1 11a_100000758547_100121576822 [0,0,1,0,0,0|1,0,2]=4 2997 B13R1.153 CC=CCC(=O)NCc1c[nH]cn1 240690a_100000758547_100121576822 [0,0,1,0,0,0|1,0,2]=4 2998 B13R1.153 CC=CCC(=O)NCc1c[nH]cn1 527a_100000758547_100121576822 [0,0,1,0,0,0|1,0,2]=4 2999 B13R1.153 CCC=CC(=O)NCc1c[nH]cn1 11a_100000758547_100000212282 [0,0,1,0,0,0|1,0,2]=4 3000 B13R1.153 CCC=CC(=O)NCc1c[nH]cn1 240690a_100000758547_100000212282 [0,0,1,0,0,0|1,0,2]=4 3001 B13R1.153 COC=CC(=O)NCc1c[nH]cn1 240690a_100000758547_100016268678 [0,0,1,0,0,0|2,0,1]=4 3002 B13R1.694 C=CCC(C=C)OCc1c[nH]cn1 34a_100000038011_100000707719 [0,0,1,0,0,0|1,0,2]=4 3003 B13R2.64 c1cc(ccn1)Sc2c[nH]cn2 62a_100000728582_100000756875 [0,0,0,0,1,0|2,0,0]=3 3004 B13R2.64 c1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100000728582 [0,0,0,0,1,0|2,0,0]=3 3005 B13R2.64 c1cc(ccn1)Sc2c[nH]nn2 62a_100000728582_100009819707 [0,0,0,0,1,0|3,0,0]=4 3006 B13R2.64 c1cc(ccn1)Sc2c[nH]nn2 62a_100009819707_100000728582 [0,0,0,0,1,0|3,0,0]=4 3007 B13R2.64 c1cc(ccn1)Sc2cscn2 62a_100000728582_100000751502 [0,0,0,0,1,0|3,0,0]=4 3008 B13R2.64 c1cc(ccn1)Sc2cscn2 62a_100000751502_100000728582 [0,0,0,0,1,0|3,0,0]=4 3009 B13R2.64 c1cc(ccn1)Sc2nc[nH]n2 62a_100000728582_100000761765 [0,0,0,0,1,0|3,0,0]=4 3010 B13R2.64 c1cc(ccn1)Sc2nc[nH]n2 62a_100000761765_100000728582 [0,0,0,0,1,0|3,0,0]=4 3011 B13R2.64 c1cc(cnn1)Sc2c[nH]cn2 62a_100000732662_100000756875 [0,0,0,0,1,0|3,0,0]=4 3012 B13R2.64 c1cc(cnn1)Sc2c[nH]cn2 62a_100000756875_100000732662 [0,0,0,0,1,0|3,0,0]=4 3013 B13R2.64 c1cc(ncn1)Sc2c[nH]cn2 62a_100000703185_100000756875 [0,0,0,0,1,0|3,0,0]=4 3014 B13R2.64 c1cc(ncn1)Sc2c[nH]cn2 62a_100000756875_100000703185 [0,0,0,0,1,0|3,0,0]=4 3015 B13R2.64 c1ccc(cc1)Nc2ncns2 27a_100000106764_100000693119 [0,0,0,0,1,0|1,0,1]=3 3016 B13R2.64 c1ccc(cc1)Nc2nncs2 27a_100000106764_100000739804 [0,0,0,0,1,0|2,0,1]=4 3017 B13R2.64 c1ccc(cc1)Sc2c[nH]cn2 62a_100000719477_100000756875 [0,0,0,0,1,0|1,0,0]=2 3018 B13R2.64 c1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000041952 [0,0,0,0,1,0|1,0,0]=2 3019 B13R2.64 c1ccc(cc1)Sc2c[nH]nn2 62a_100000719477_100009819707 [0,0,0,0,1,0|2,0,0]=3 3020 B13R2.64 c1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000041952 [0,0,0,0,1,0|2,0,0]=3 3021 B13R2.64 c1ccc(cc1)Sc2cc[nH]n2 62a_100000062575_100000041952 [0,0,0,0,1,0|3,0,0]=4 3022 B13R2.64 c1ccc(cc1)Sc2cc[nH]n2 62a_100000719477_100000062575 [0,0,0,0,1,0|3,0,0]=4 3023 B13R2.64 c1ccc(cc1)Sc2ccco2 62a_100000719477_100009814098 [0,0,0,0,1,0|3,0,0]=4 3024 B13R2.64 c1ccc(cc1)Sc2ccco2 62a_100009814098_100000041952 [0,0,0,0,1,0|3,0,0]=4 3025 B13R2.64 c1ccc(cc1)Sc2cccs2 62a_100000719477_100011215356 [0,0,0,0,1,0|3,0,0]=4 3026 B13R2.64 c1ccc(cc1)Sc2cccs2 62a_100011215356_100000041952 [0,0,0,0,1,0|3,0,0]=4 3027 B13R2.64 c1ccc(cc1)Sc2ccoc2 62a_100000719477_100011215275 [0,0,0,0,1,0|3,0,0]=4 3028 B13R2.64 c1ccc(cc1)Sc2ccoc2 62a_100011215275_100000041952 [0,0,0,0,1,0|3,0,0]=4 3029 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100000719477_100009818083 [0,0,0,0,1,0|3,0,0]=4 3030 B13R2.64 c1ccc(cc1)Sc2ccon2 62a_100009818083_100000041952 [0,0,0,0,1,0|3,0,0]=4 3031 B13R2.64 c1ccc(cc1)Sc2ccsc2 62a_100000719477_100000738268 [0,0,0,0,1,0|3,0,0]=4 3032 B13R2.64 c1ccc(cc1)Sc2ccsc2 62a_100000738268_100000041952 [0,0,0,0,1,0|3,0,0]=4 3033 B13R2.64 c1ccc(cc1)Sc2ccsn2 62a_100000719477_100009818082 [0,0,0,0,1,0|3,0,0]=4 3034 B13R2.64 c1ccc(cc1)Sc2ccsn2 62a_100009818082_100000041952 [0,0,0,0,1,0|3,0,0]=4 3035 B13R2.64 c1ccc(cc1)Sc2cn[nH]c2 62a_100000238712_100000041952 [0,0,0,0,1,0|3,0,0]=4 3036 B13R2.64 c1ccc(cc1)Sc2cn[nH]c2 62a_100000719477_100000238712 [0,0,0,0,1,0|3,0,0]=4 3037 B13R2.64 c1ccc(cc1)Sc2cnco2 62a_100000719477_100020591547 [0,0,0,0,1,0|2,0,1]=4 3038 B13R2.64 c1ccc(cc1)Sc2cnco2 62a_100020591547_100000041952 [0,0,0,0,1,0|2,0,1]=4 3039 B13R2.64 c1ccc(cc1)Sc2cncs2 62a_100000719477_100011934649 [0,0,0,0,1,0|2,0,1]=4 3040 B13R2.64 c1ccc(cc1)Sc2cncs2 62a_100011934649_100000041952 [0,0,0,0,1,0|2,0,1]=4 3041 B13R2.64 c1ccc(cc1)Sc2cscn2 62a_100000719477_100000751502 [0,0,0,0,1,0|2,0,0]=3 3042 B13R2.64 c1ccc(cc1)Sc2cscn2 62a_100000751502_100000041952 [0,0,0,0,1,0|2,0,0]=3 3043 B13R2.64 c1ccc(cc1)Sc2nc[nH]n2 62a_100000719477_100000761765 [0,0,0,0,1,0|2,0,0]=3 3044 B13R2.64 c1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000041952 [0,0,0,0,1,0|2,0,0]=3 3045 B13R2.64 c1ccc(cc1)Sc2ncc[nH]2 62a_100000719477_100025796157 [0,0,0,0,1,0|3,0,0]=4 3046 B13R2.64 c1ccc(cc1)Sc2ncc[nH]2 62a_100025796157_100000041952 [0,0,0,0,1,0|3,0,0]=4 3047 B13R2.64 c1ccc(cc1)Sc2ncco2 62a_100000719477_100011787736 [0,0,0,0,1,0|3,0,0]=4 3048 B13R2.64 c1ccc(cc1)Sc2ncco2 62a_100011787736_100000041952 [0,0,0,0,1,0|3,0,0]=4 3049 B13R2.64 c1ccc(cc1)Sc2nccs2 62a_100000211983_100000041952 [0,0,0,0,1,0|3,0,0]=4 3050 B13R2.64 c1ccc(cc1)Sc2nccs2 62a_100000719477_100000211983 [0,0,0,0,1,0|3,0,0]=4 3051 B13R2.64 c1ccc(cc1)Sc2ncns2 62a_100000693119_100000041952 [0,0,0,0,1,0|2,0,1]=4 3052 B13R2.64 c1ccc(cc1)Sc2ncns2 62a_100000719477_100000693119 [0,0,0,0,1,0|2,0,1]=4 3053 B13R2.64 c1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100011216584 [0,0,0,0,1,0|2,0,0]=3 3054 B13R2.64 c1ccc(nc1)Sc2c[nH]cn2 62a_100011216584_100000756875 [0,0,0,0,1,0|2,0,0]=3 3055 B13R2.64 c1ccc(nc1)Sc2c[nH]nn2 62a_100009819707_100011216584 [0,0,0,0,1,0|3,0,0]=4 3056 B13R2.64 c1ccc(nc1)Sc2c[nH]nn2 62a_100011216584_100009819707 [0,0,0,0,1,0|3,0,0]=4 3057 B13R2.64 c1ccc(nc1)Sc2cscn2 62a_100000751502_100011216584 [0,0,0,0,1,0|3,0,0]=4 3058 B13R2.64 c1ccc(nc1)Sc2cscn2 62a_100011216584_100000751502 [0,0,0,0,1,0|3,0,0]=4 3059 B13R2.64 c1ccc(nc1)Sc2nc[nH]n2 62a_100000761765_100011216584 [0,0,0,0,1,0|3,0,0]=4 3060 B13R2.64 c1ccc(nc1)Sc2nc[nH]n2 62a_100011216584_100000761765 [0,0,0,0,1,0|3,0,0]=4 3061 B13R2.64 c1cnc(cn1)Sc2c[nH]cn2 62a_100000211759_100000756875 [0,0,0,0,1,0|3,0,0]=4 3062 B13R2.64 c1cnc(cn1)Sc2c[nH]cn2 62a_100000756875_100000211759 [0,0,0,0,1,0|3,0,0]=4 3063 B13R2.64 c1cnc(nc1)Sc2c[nH]cn2 62a_100000211032_100000756875 [0,0,0,0,1,0|3,0,0]=4 3064 B13R2.64 c1cnc(nc1)Sc2c[nH]cn2 62a_100000756875_100000211032 [0,0,0,0,1,0|3,0,0]=4 3065 B13R2.64 c1cncc(c1)Sc2c[nH]cn2 62a_100000210063_100000756875 [0,0,0,0,1,0|2,0,0]=3 3066 B13R2.64 c1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000210063 [0,0,0,0,1,0|2,0,0]=3 3067 B13R2.64 c1cncc(c1)Sc2c[nH]nn2 62a_100000210063_100009819707 [0,0,0,0,1,0|3,0,0]=4 3068 B13R2.64 c1cncc(c1)Sc2c[nH]nn2 62a_100009819707_100000210063 [0,0,0,0,1,0|3,0,0]=4 3069 B13R2.64 c1cncc(c1)Sc2cscn2 62a_100000210063_100000751502 [0,0,0,0,1,0|3,0,0]=4 3070 B13R2.64 c1cncc(c1)Sc2cscn2 62a_100000751502_100000210063 [0,0,0,0,1,0|3,0,0]=4 3071 B13R2.64 c1cncc(c1)Sc2nc[nH]n2 62a_100000210063_100000761765 [0,0,0,0,1,0|3,0,0]=4 3072 B13R2.64 c1cncc(c1)Sc2nc[nH]n2 62a_100000761765_100000210063 [0,0,0,0,1,0|3,0,0]=4 3073 B13R2.64 c1cnnc(c1)Sc2c[nH]cn2 62a_100000756875_100016991348 [0,0,0,0,1,0|3,0,0]=4 3074 B13R2.64 c1cnnc(c1)Sc2c[nH]cn2 62a_100016991348_100000756875 [0,0,0,0,1,0|3,0,0]=4 3075 B13R2.64 c1ncc(cn1)Sc2c[nH]cn2 62a_100000756875_100011206942 [0,0,0,0,1,0|3,0,0]=4 3076 B13R2.64 c1ncc(cn1)Sc2c[nH]cn2 62a_100011206942_100000756875 [0,0,0,0,1,0|3,0,0]=4 3077 B13R2.183 C1=CCC(C1)NCc2c[nH]cn2 2230a_100015188752_100000707719 [0,0,0,0,1,0|0,0,3]=4 3078 B13R2.183 c1c[nH]c(n1)SCc2c[nH]cn2 62a_100000707719_100025796157 [0,0,0,0,1,0|3,0,0]=4 3079 B13R2.183 c1c[nH]c(n1)SCc2c[nH]cn2 62a_100025796157_100000707719 [0,0,0,0,1,0|3,0,0]=4 3080 B13R2.183 c1cc(co1)SCc2cscn2 62a_100000205941_100011215275 [0,0,0,0,1,0|3,0,0]=4 3081 B13R2.183 c1cc(co1)SCc2cscn2 62a_100011215275_100000205941 [0,0,0,0,1,0|3,0,0]=4 3082 B13R2.183 c1cc(cs1)OCc2cscn2 34a_100000106738_100000205941 [0,0,0,0,1,0|3,0,0]=4 3083 B13R2.183 c1cc(cs1)OCc2cscn2 7a_100000106738_100000205941 [0,0,0,0,1,0|3,0,0]=4 3084 B13R2.183 c1cc(cs1)SCc2cscn2 62a_100000205941_100000738268 [0,0,0,0,1,0|3,0,0]=4 3085 B13R2.183 c1cc(cs1)SCc2cscn2 62a_100000738268_100000205941 [0,0,0,0,1,0|3,0,0]=4 3086 B13R2.183 c1coc(c1)SCc2c[nH]cn2 62a_100000707719_100009814098 [0,0,0,0,1,0|2,0,0]=3 3087 B13R2.183 c1coc(c1)SCc2c[nH]cn2 62a_100009814098_100000707719 [0,0,0,0,1,0|2,0,0]=3 3088 B13R2.183 c1coc(c1)SCc2cscn2 62a_100000205941_100009814098 [0,0,0,0,1,0|3,0,0]=4 3089 B13R2.183 c1coc(c1)SCc2cscn2 62a_100009814098_100000205941 [0,0,0,0,1,0|3,0,0]=4 3090 B13R2.183 c1coc(n1)SCc2c[nH]cn2 62a_100000707719_100011787736 [0,0,0,0,1,0|3,0,0]=4 3091 B13R2.183 c1coc(n1)SCc2c[nH]cn2 62a_100011787736_100000707719 [0,0,0,0,1,0|3,0,0]=4 3092 B13R2.183 c1csc(c1)SCc2c[nH]cn2 62a_100000707719_100011215356 [0,0,0,0,1,0|2,0,0]=3 3093 B13R2.183 c1csc(c1)SCc2c[nH]cn2 62a_100011215356_100000707719 [0,0,0,0,1,0|2,0,0]=3 3094 B13R2.183 c1csc(c1)SCc2cscn2 62a_100000205941_100011215356 [0,0,0,0,1,0|3,0,0]=4 3095 B13R2.183 c1csc(c1)SCc2cscn2 62a_100011215356_100000205941 [0,0,0,0,1,0|3,0,0]=4 3096 B13R2.183 c1csc(n1)SCc2c[nH]cn2 62a_100000211983_100000707719 [0,0,0,0,1,0|3,0,0]=4 3097 B13R2.183 c1csc(n1)SCc2c[nH]cn2 62a_100000707719_100000211983 [0,0,0,0,1,0|3,0,0]=4 3098 B13R2.183 c1nc(c[nH]1)CNc2nncs2 27a_100000758547_100000739804 [0,0,0,0,1,0|3,0,0]=4 3099 B13R2.183 c1nc(c[nH]1)COc2ccsc2 34a_100000106738_100000707719 [0,0,0,0,1,0|2,0,0]=3 3100 B13R2.183 c1nc(c[nH]1)CSc2c[nH]cn2 62a_100000707719_100000756875 [0,0,0,0,1,0|3,0,0]=4 3101 B13R2.183 c1nc(c[nH]1)CSc2c[nH]cn2 62a_100000756875_100000707719 [0,0,0,0,1,0|3,0,0]=4 3102 B13R2.183 c1nc(c[nH]1)CSc2cc[nH]n2 62a_100000062575_100000707719 [0,0,0,0,1,0|3,0,0]=4 3103 B13R2.183 c1nc(c[nH]1)CSc2cc[nH]n2 62a_100000707719_100000062575 [0,0,0,0,1,0|3,0,0]=4 3104 B13R2.183 c1nc(c[nH]1)CSc2ccoc2 62a_100000707719_100011215275 [0,0,0,0,1,0|2,0,0]=3 3105 B13R2.183 c1nc(c[nH]1)CSc2ccoc2 62a_100011215275_100000707719 [0,0,0,0,1,0|2,0,0]=3 3106 B13R2.183 c1nc(c[nH]1)CSc2ccon2 62a_100000707719_100009818083 [0,0,0,0,1,0|3,0,0]=4 3107 B13R2.183 c1nc(c[nH]1)CSc2ccon2 62a_100009818083_100000707719 [0,0,0,0,1,0|3,0,0]=4 3108 B13R2.183 c1nc(c[nH]1)CSc2ccsc2 62a_100000707719_100000738268 [0,0,0,0,1,0|2,0,0]=3 3109 B13R2.183 c1nc(c[nH]1)CSc2ccsc2 62a_100000738268_100000707719 [0,0,0,0,1,0|2,0,0]=3 3110 B13R2.183 c1nc(c[nH]1)CSc2ccsn2 62a_100000707719_100009818082 [0,0,0,0,1,0|3,0,0]=4 3111 B13R2.183 c1nc(c[nH]1)CSc2ccsn2 62a_100009818082_100000707719 [0,0,0,0,1,0|3,0,0]=4 3112 B13R2.183 c1nc(c[nH]1)CSc2cn[nH]c2 62a_100000238712_100000707719 [0,0,0,0,1,0|3,0,0]=4 3113 B13R2.183 c1nc(c[nH]1)CSc2cn[nH]c2 62a_100000707719_100000238712 [0,0,0,0,1,0|3,0,0]=4 3114 B13R2.183 c1nc(c[nH]1)CSc2cnco2 62a_100000707719_100020591547 [0,0,0,0,1,0|3,0,0]=4 3115 B13R2.183 c1nc(c[nH]1)CSc2cnco2 62a_100020591547_100000707719 [0,0,0,0,1,0|3,0,0]=4 3116 B13R2.183 c1nc(c[nH]1)CSc2cncs2 62a_100000707719_100011934649 [0,0,0,0,1,0|3,0,0]=4 3117 B13R2.183 c1nc(c[nH]1)CSc2cncs2 62a_100011934649_100000707719 [0,0,0,0,1,0|3,0,0]=4 3118 B13R2.183 c1nc(c[nH]1)CSc2cnoc2 62a_100000707719_100009815712 [0,0,0,0,1,0|3,0,0]=4 3119 B13R2.183 c1nc(c[nH]1)CSc2cnoc2 62a_100009815712_100000707719 [0,0,0,0,1,0|3,0,0]=4 3120 B13R2.183 c1nc(c[nH]1)CSc2cnsc2 62a_100000707719_100009815736 [0,0,0,0,1,0|3,0,0]=4 3121 B13R2.183 c1nc(c[nH]1)CSc2cnsc2 62a_100009815736_100000707719 [0,0,0,0,1,0|3,0,0]=4 3122 B13R2.183 c1nc(c[nH]1)CSc2cscn2 62a_100000707719_100000751502 [0,0,0,0,1,0|3,0,0]=4 3123 B13R2.183 c1nc(c[nH]1)CSc2cscn2 62a_100000751502_100000707719 [0,0,0,0,1,0|3,0,0]=4 3124 B13R2.183 c1nc(c[nH]1)SCc2ccsc2 62a_100000756875_100011233845 [0,0,0,0,1,0|3,0,0]=4 3125 B13R2.183 c1nc(c[nH]1)SCc2ccsc2 62a_100011261437_100000756875 [0,0,0,0,1,0|3,0,0]=4 3126 B13R2.183 c1nsc(n1)NCc2c[nH]cn2 27a_100000758547_100000693119 [0,0,0,0,1,0|3,0,0]=4 3127 B15R2.2195 C(#Cc1ccccn1)c2ccccc2 271570a_100000069678_100011216584 [0,0,0,0,0,1|2,0,1]=4 3128 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 271570a_100000069678_100000752921 [0,0,0,0,0,1|2,0,1]=4 3129 B15R2.2195 C(#Cc1cccnn1)c2ccccc2 271570a_100000069678_100016991348 [0,0,0,0,0,1|2,0,1]=4 3130 B15R2.2195 C(#Cc1ccncn1)c2ccccc2 271570a_100000069678_100000703185 [0,0,0,0,0,1|1,0,2]=4 3131 B15R2.2195 C(#Cc1cnccn1)c2ccccc2 271570a_100000069678_100000758340 [0,0,0,0,0,1|1,0,2]=4 3132 B15R2.2195 C(#Cc1cncnc1)c2ccccc2 271570a_100000069678_100011206942 [0,0,0,0,0,1|1,0,2]=4 3133 B15R2.2195 C(#Cc1ncccn1)c2ccccc2 271570a_100000069678_100000211032 [0,0,0,0,0,1|2,0,1]=4 3134 B15R2.2195 C(=Cc1ccccn1)c2ccccc2 271570a_100102527694_100011216584 [0,0,0,0,0,1|2,0,1]=4 3135 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102525586_100000210277 [0,0,0,0,0,1|2,0,1]=4 3136 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102527694_100000752921 [0,0,0,0,0,1|2,0,1]=4 3137 B15R2.2195 C(=Cc1cccnn1)c2ccccc2 271570a_100102527694_100016991348 [0,0,0,0,0,1|2,0,1]=4 3138 B15R2.2195 C(=Cc1ccncn1)c2ccccc2 271570a_100102527694_100000703185 [0,0,0,0,0,1|1,0,2]=4 3139 B15R2.2195 C(=Cc1cnccn1)c2ccccc2 271570a_100102527694_100000758340 [0,0,0,0,0,1|1,0,2]=4 3140 B15R2.2195 C(=Cc1cncnc1)c2ccccc2 271570a_100102527694_100011206942 [0,0,0,0,0,1|1,0,2]=4 3141 B15R2.2195 C(=Cc1ncccn1)c2ccccc2 271570a_100102527694_100000211032 [0,0,0,0,0,1|2,0,1]=4 3142 B15R2.2195 c1cc(ccn1)OCc2cnccn2 34a_100000212176_100016995436 [0,0,0,0,0,1|2,0,1]=4 3143 B15R2.2195 c1cc(ccn1)OCc2cncnc2 34a_100000212176_100015196519 [0,0,0,0,0,1|2,0,1]=4 3144 B15R2.2195 c1cc(ccn1)SCc2cnccn2 62a_100000728582_100016995436 [0,0,0,0,0,1|2,0,1]=4 3145 B15R2.2195 c1cc(ccn1)SCc2cnccn2 62a_100016995436_100000728582 [0,0,0,0,0,1|2,0,1]=4 3146 B15R2.2195 c1cc(ccn1)SCc2cncnc2 62a_100000728582_100015196519 [0,0,0,0,0,1|2,0,1]=4 3147 B15R2.2195 c1cc(ccn1)SCc2cncnc2 62a_100015196519_100000728582 [0,0,0,0,0,1|2,0,1]=4 3148 B15R2.2195 c1cc(ncn1)CNc2ccncn2 27a_100000736019_100000703185 [0,0,0,0,0,1|2,0,1]=4 3149 B15R2.2195 c1cc(ncn1)CNc2cnccn2 27a_100000736019_100000211759 [0,0,0,0,0,1|2,0,1]=4 3150 B15R2.2195 c1cc(ncn1)NCc2cnccn2 27a_100000737960_100000703185 [0,0,0,0,0,1|2,0,1]=4 3151 B15R2.2195 c1cc(ncn1)NCc2cncnc2 27a_100011243677_100000703185 [0,0,0,0,0,1|2,0,1]=4 3152 B15R2.2195 c1ccc(cc1)CNc2ccccc2 207a_100000106764_100015611070 [0,0,0,0,0,1|2,0,0]=3 3153 B15R2.2195 c1ccc(cc1)CNc2ccccc2 270302a_100000106764_100015611070 [0,0,0,0,0,1|2,0,0]=3 3154 B15R2.2195 c1ccc(cc1)CNc2ccccc2 34a_100000106764_100015291786 [0,0,0,0,0,1|2,0,0]=3 3155 B15R2.2195 c1ccc(cc1)CNc2cccnn2 27a_100015324214_100016991348 [0,0,0,0,0,1|3,0,0]=4 3156 B15R2.2195 c1ccc(cc1)CNc2ccncn2 27a_100015324214_100000703185 [0,0,0,0,0,1|2,0,1]=4 3157 B15R2.2195 c1ccc(cc1)CNc2cnccn2 27a_100015324214_100000211759 [0,0,0,0,0,1|2,0,1]=4 3158 B15R2.2195 c1ccc(cc1)CNc2ncccn2 27a_100015324214_100000211032 [0,0,0,0,0,1|3,0,0]=4 3159 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [0,0,0,0,0,1|3,0,0]=4 3160 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [0,0,0,0,0,1|3,0,0]=4 3161 B15R2.2195 c1ccc(cc1)COc2cccnc2 34a_100000210849_100015291786 [0,0,0,0,0,1|3,0,0]=4 3162 B15R2.2195 c1ccc(cc1)COc2cccnc2 7a_100000210849_100000211182 [0,0,0,0,0,1|3,0,0]=4 3163 B15R2.2195 c1ccc(cc1)COc2cncnc2 7a_100000754086_100000211182 [0,0,0,0,0,1|2,0,1]=4 3164 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000211182_100000041952 [0,0,0,0,0,1|3,0,0]=4 3165 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000719477_100015291786 [0,0,0,0,0,1|3,0,0]=4 3166 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100000211182_100011216584 [0,0,0,0,0,1|3,0,0]=4 3167 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100011216584_100015291786 [0,0,0,0,0,1|3,0,0]=4 3168 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000210063_100015291786 [0,0,0,0,0,1|3,0,0]=4 3169 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000211182_100000210063 [0,0,0,0,0,1|3,0,0]=4 3170 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100000211182_100016991348 [0,0,0,0,0,1|3,0,0]=4 3171 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100016991348_100015291786 [0,0,0,0,0,1|3,0,0]=4 3172 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000211182_100000703185 [0,0,0,0,0,1|2,0,1]=4 3173 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000703185_100015291786 [0,0,0,0,0,1|2,0,1]=4 3174 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211182_100000211759 [0,0,0,0,0,1|2,0,1]=4 3175 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211759_100015291786 [0,0,0,0,0,1|2,0,1]=4 3176 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100000211182_100011206942 [0,0,0,0,0,1|2,0,1]=4 3177 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100011206942_100015291786 [0,0,0,0,0,1|2,0,1]=4 3178 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211032_100015291786 [0,0,0,0,0,1|3,0,0]=4 3179 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211182_100000211032 [0,0,0,0,0,1|3,0,0]=4 3180 B15R2.2195 c1ccc(cc1)NCc2ccccn2 207a_100000106764_100000209966 [0,0,0,0,0,1|1,0,0]=2 3181 B15R2.2195 c1ccc(cc1)NCc2ccccn2 270302a_100000106764_100000209966 [0,0,0,0,0,1|1,0,0]=2 3182 B15R2.2195 c1ccc(cc1)NCc2ccccn2 34a_100000106764_100000721315 [0,0,0,0,0,1|1,0,0]=2 3183 B15R2.2195 c1ccc(cc1)NCc2cccnc2 207a_100000106764_100000209961 [0,0,0,0,0,1|1,0,0]=2 3184 B15R2.2195 c1ccc(cc1)NCc2cccnc2 270302a_100000106764_100000209961 [0,0,0,0,0,1|1,0,0]=2 3185 B15R2.2195 c1ccc(cc1)NCc2cccnc2 34a_100000106764_100000733263 [0,0,0,0,0,1|1,0,0]=2 3186 B15R2.2195 c1ccc(cc1)NCc2cccnn2 34a_100000106764_100016990269 [0,0,0,0,0,1|1,0,0]=2 3187 B15R2.2195 c1ccc(cc1)NCc2ccncc2 207a_100000106764_100000186114 [0,0,0,0,0,1|1,0,1]=3 3188 B15R2.2195 c1ccc(cc1)NCc2ccnnc2 270302a_100000106764_100011934578 [0,0,0,0,0,1|1,0,1]=3 3189 B15R2.2195 c1ccc(cc1)NCc2cnccn2 34a_100000106764_100016995436 [0,0,0,0,0,1|0,0,1]=2 3190 B15R2.2195 c1ccc(cc1)NCc2cncnc2 270302a_100000106764_100000749868 [0,0,0,0,0,1|0,0,1]=2 3191 B15R2.2195 c1ccc(cc1)NCc2cncnc2 34a_100000106764_100015196519 [0,0,0,0,0,1|0,0,1]=2 3192 B15R2.2195 c1ccc(cc1)NCc2ncccn2 34a_100000106764_100000703007 [0,0,0,0,0,1|1,0,0]=2 3193 B15R2.2195 c1ccc(cc1)OCc2ccccn2 34a_100000210340_100000721315 [0,0,0,0,0,1|2,0,0]=3 3194 B15R2.2195 c1ccc(cc1)OCc2ccccn2 7a_100000210340_100000721315 [0,0,0,0,0,1|2,0,0]=3 3195 B15R2.2195 c1ccc(cc1)OCc2cccnc2 34a_100000210340_100000733263 [0,0,0,0,0,1|2,0,0]=3 3196 B15R2.2195 c1ccc(cc1)OCc2cccnc2 7a_100000210340_100000741622 [0,0,0,0,0,1|2,0,0]=3 3197 B15R2.2195 c1ccc(cc1)OCc2cccnn2 34a_100000210340_100016990269 [0,0,0,0,0,1|2,0,0]=3 3198 B15R2.2195 c1ccc(cc1)OCc2cccnn2 7a_100000210340_100016990269 [0,0,0,0,0,1|2,0,0]=3 3199 B15R2.2195 c1ccc(cc1)OCc2ccncc2 7a_100000210340_100015193705 [0,0,0,0,0,1|2,0,1]=4 3200 B15R2.2195 c1ccc(cc1)OCc2cnccn2 34a_100000210340_100016995436 [0,0,0,0,0,1|1,0,1]=3 3201 B15R2.2195 c1ccc(cc1)OCc2cnccn2 7a_100000210340_100016995436 [0,0,0,0,0,1|1,0,1]=3 3202 B15R2.2195 c1ccc(cc1)OCc2cncnc2 34a_100000210340_100015196519 [0,0,0,0,0,1|1,0,1]=3 3203 B15R2.2195 c1ccc(cc1)OCc2cncnc2 7a_100000210340_100015196519 [0,0,0,0,0,1|1,0,1]=3 3204 B15R2.2195 c1ccc(cc1)OCc2ncccn2 34a_100000210340_100000703007 [0,0,0,0,0,1|2,0,0]=3 3205 B15R2.2195 c1ccc(cc1)OCc2ncccn2 7a_100000210340_100000703007 [0,0,0,0,0,1|2,0,0]=3 3206 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000719477_100000721315 [0,0,0,0,0,1|2,0,0]=3 3207 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000721315_100000041952 [0,0,0,0,0,1|2,0,0]=3 3208 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000719477_100000741622 [0,0,0,0,0,1|2,0,0]=3 3209 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000741622_100000041952 [0,0,0,0,0,1|2,0,0]=3 3210 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100000719477_100016990269 [0,0,0,0,0,1|2,0,0]=3 3211 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100016990269_100000041952 [0,0,0,0,0,1|2,0,0]=3 3212 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100000719477_100015193705 [0,0,0,0,0,1|2,0,1]=4 3213 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100015193705_100000041952 [0,0,0,0,0,1|2,0,1]=4 3214 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100000719477_100016995436 [0,0,0,0,0,1|1,0,1]=3 3215 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100016995436_100000041952 [0,0,0,0,0,1|1,0,1]=3 3216 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100000719477_100015196519 [0,0,0,0,0,1|1,0,1]=3 3217 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100015196519_100000041952 [0,0,0,0,0,1|1,0,1]=3 3218 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000703007_100000041952 [0,0,0,0,0,1|2,0,0]=3 3219 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000719477_100000703007 [0,0,0,0,0,1|2,0,0]=3 3220 B15R2.2195 c1ccc(nc1)CNc2cccnn2 27a_100000210449_100016991348 [0,0,0,0,0,1|3,0,0]=4 3221 B15R2.2195 c1ccc(nc1)CNc2ccncn2 27a_100000210449_100000703185 [0,0,0,0,0,1|3,0,0]=4 3222 B15R2.2195 c1ccc(nc1)CNc2cnccn2 27a_100000210449_100000211759 [0,0,0,0,0,1|3,0,0]=4 3223 B15R2.2195 c1ccc(nc1)CNc2ncccn2 27a_100000210449_100000211032 [0,0,0,0,0,1|3,0,0]=4 3224 B15R2.2195 c1ccc(nc1)COc2cccnc2 34a_100000210849_100000721315 [0,0,0,0,0,1|3,0,0]=4 3225 B15R2.2195 c1ccc(nc1)COc2cccnc2 7a_100000210849_100000721315 [0,0,0,0,0,1|3,0,0]=4 3226 B15R2.2195 c1ccc(nc1)COc2ccncc2 34a_100000212176_100000721315 [0,0,0,0,0,1|3,0,0]=4 3227 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100000721315_100011216584 [0,0,0,0,0,1|3,0,0]=4 3228 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100011216584_100000721315 [0,0,0,0,0,1|3,0,0]=4 3229 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000210063_100000721315 [0,0,0,0,0,1|3,0,0]=4 3230 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000721315_100000210063 [0,0,0,0,0,1|3,0,0]=4 3231 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000721315_100000728582 [0,0,0,0,0,1|3,0,0]=4 3232 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000728582_100000721315 [0,0,0,0,0,1|3,0,0]=4 3233 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100000741622_100011216584 [0,0,0,0,0,1|3,0,0]=4 3234 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100011216584_100000741622 [0,0,0,0,0,1|3,0,0]=4 3235 B15R2.2195 c1ccc(nc1)SCc2cccnn2 62a_100011216584_100016990269 [0,0,0,0,0,1|3,0,0]=4 3236 B15R2.2195 c1ccc(nc1)SCc2cccnn2 62a_100016990269_100011216584 [0,0,0,0,0,1|3,0,0]=4 3237 B15R2.2195 c1ccc(nc1)SCc2cnccn2 62a_100011216584_100016995436 [0,0,0,0,0,1|2,0,1]=4 3238 B15R2.2195 c1ccc(nc1)SCc2cnccn2 62a_100016995436_100011216584 [0,0,0,0,0,1|2,0,1]=4 3239 B15R2.2195 c1ccc(nc1)SCc2cncnc2 62a_100011216584_100015196519 [0,0,0,0,0,1|2,0,1]=4 3240 B15R2.2195 c1ccc(nc1)SCc2cncnc2 62a_100015196519_100011216584 [0,0,0,0,0,1|2,0,1]=4 3241 B15R2.2195 c1ccc(nc1)SCc2ncccn2 62a_100000703007_100011216584 [0,0,0,0,0,1|3,0,0]=4 3242 B15R2.2195 c1ccc(nc1)SCc2ncccn2 62a_100011216584_100000703007 [0,0,0,0,0,1|3,0,0]=4 3243 B15R2.2195 c1cnc(cn1)CNc2cnccn2 27a_100000737960_100000211759 [0,0,0,0,0,1|2,0,1]=4 3244 B15R2.2195 c1cnc(cn1)NCc2cncnc2 27a_100011243677_100000211759 [0,0,0,0,0,1|2,0,1]=4 3245 B15R2.2195 c1cnc(nc1)CNc2cccnn2 27a_100015189908_100016991348 [0,0,0,0,0,1|3,0,0]=4 3246 B15R2.2195 c1cnc(nc1)CNc2ccncn2 27a_100015189908_100000703185 [0,0,0,0,0,1|3,0,0]=4 3247 B15R2.2195 c1cnc(nc1)CNc2cnccn2 27a_100015189908_100000211759 [0,0,0,0,0,1|3,0,0]=4 3248 B15R2.2195 c1cnc(nc1)CNc2ncccn2 27a_100015189908_100000211032 [0,0,0,0,0,1|3,0,0]=4 3249 B15R2.2195 c1cnc(nc1)COc2cccnc2 34a_100000210849_100000703007 [0,0,0,0,0,1|3,0,0]=4 3250 B15R2.2195 c1cnc(nc1)COc2cccnc2 7a_100000210849_100000703007 [0,0,0,0,0,1|3,0,0]=4 3251 B15R2.2195 c1cnc(nc1)COc2ccncc2 34a_100000212176_100000703007 [0,0,0,0,0,1|3,0,0]=4 3252 B15R2.2195 c1cnc(nc1)CSc2cccnc2 62a_100000210063_100000703007 [0,0,0,0,0,1|3,0,0]=4 3253 B15R2.2195 c1cnc(nc1)CSc2cccnc2 62a_100000703007_100000210063 [0,0,0,0,0,1|3,0,0]=4 3254 B15R2.2195 c1cnc(nc1)CSc2ccncc2 62a_100000703007_100000728582 [0,0,0,0,0,1|3,0,0]=4 3255 B15R2.2195 c1cnc(nc1)CSc2ccncc2 62a_100000728582_100000703007 [0,0,0,0,0,1|3,0,0]=4 3256 B15R2.2195 c1cnc(nc1)NCc2cccnc2 27a_100000210453_100000211032 [0,0,0,0,0,1|3,0,0]=4 3257 B15R2.2195 c1cnc(nc1)NCc2cccnn2 27a_100159270163_100000211032 [0,0,0,0,0,1|3,0,0]=4 3258 B15R2.2195 c1cnc(nc1)NCc2ccncn2 27a_100000736019_100000211032 [0,0,0,0,0,1|2,0,1]=4 3259 B15R2.2195 c1cnc(nc1)NCc2cnccn2 27a_100000737960_100000211032 [0,0,0,0,0,1|2,0,1]=4 3260 B15R2.2195 c1cnc(nc1)NCc2cncnc2 27a_100011243677_100000211032 [0,0,0,0,0,1|2,0,1]=4 3261 B15R2.2195 c1cncc(c1)CNc2cccnn2 27a_100000210453_100016991348 [0,0,0,0,0,1|3,0,0]=4 3262 B15R2.2195 c1cncc(c1)CNc2ccncn2 27a_100000210453_100000703185 [0,0,0,0,0,1|3,0,0]=4 3263 B15R2.2195 c1cncc(c1)CNc2cnccn2 27a_100000210453_100000211759 [0,0,0,0,0,1|3,0,0]=4 3264 B15R2.2195 c1cncc(c1)COc2cccnc2 34a_100000210849_100000733263 [0,0,0,0,0,1|3,0,0]=4 3265 B15R2.2195 c1cncc(c1)COc2cccnc2 7a_100000210849_100000741622 [0,0,0,0,0,1|3,0,0]=4 3266 B15R2.2195 c1cncc(c1)COc2ccncc2 34a_100000212176_100000733263 [0,0,0,0,0,1|3,0,0]=4 3267 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000210063_100000741622 [0,0,0,0,0,1|3,0,0]=4 3268 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000741622_100000210063 [0,0,0,0,0,1|3,0,0]=4 3269 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000728582_100000741622 [0,0,0,0,0,1|3,0,0]=4 3270 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000741622_100000728582 [0,0,0,0,0,1|3,0,0]=4 3271 B15R2.2195 c1cncc(c1)OCc2cccnn2 34a_100000210849_100016990269 [0,0,0,0,0,1|3,0,0]=4 3272 B15R2.2195 c1cncc(c1)OCc2cccnn2 7a_100000210849_100016990269 [0,0,0,0,0,1|3,0,0]=4 3273 B15R2.2195 c1cncc(c1)OCc2cnccn2 34a_100000210849_100016995436 [0,0,0,0,0,1|2,0,1]=4 3274 B15R2.2195 c1cncc(c1)OCc2cnccn2 7a_100000210849_100016995436 [0,0,0,0,0,1|2,0,1]=4 3275 B15R2.2195 c1cncc(c1)OCc2cncnc2 34a_100000210849_100015196519 [0,0,0,0,0,1|2,0,1]=4 3276 B15R2.2195 c1cncc(c1)OCc2cncnc2 7a_100000210849_100015196519 [0,0,0,0,0,1|2,0,1]=4 3277 B15R2.2195 c1cncc(c1)SCc2cccnn2 62a_100000210063_100016990269 [0,0,0,0,0,1|3,0,0]=4 3278 B15R2.2195 c1cncc(c1)SCc2cccnn2 62a_100016990269_100000210063 [0,0,0,0,0,1|3,0,0]=4 3279 B15R2.2195 c1cncc(c1)SCc2cnccn2 62a_100000210063_100016995436 [0,0,0,0,0,1|2,0,1]=4 3280 B15R2.2195 c1cncc(c1)SCc2cnccn2 62a_100016995436_100000210063 [0,0,0,0,0,1|2,0,1]=4 3281 B15R2.2195 c1cncc(c1)SCc2cncnc2 62a_100000210063_100015196519 [0,0,0,0,0,1|2,0,1]=4 3282 B15R2.2195 c1cncc(c1)SCc2cncnc2 62a_100015196519_100000210063 [0,0,0,0,0,1|2,0,1]=4 3283 B15R2.2195 c1cnnc(c1)CNc2cccnn2 27a_100159270163_100016991348 [0,0,0,0,0,1|3,0,0]=4 3284 B15R2.2195 c1cnnc(c1)CNc2ccncn2 27a_100159270163_100000703185 [0,0,0,0,0,1|3,0,0]=4 3285 B15R2.2195 c1cnnc(c1)CNc2cnccn2 27a_100159270163_100000211759 [0,0,0,0,0,1|3,0,0]=4 3286 B15R2.2195 c1cnnc(c1)COc2ccncc2 34a_100000212176_100016990269 [0,0,0,0,0,1|3,0,0]=4 3287 B15R2.2195 c1cnnc(c1)CSc2ccncc2 62a_100000728582_100016990269 [0,0,0,0,0,1|3,0,0]=4 3288 B15R2.2195 c1cnnc(c1)CSc2ccncc2 62a_100016990269_100000728582 [0,0,0,0,0,1|3,0,0]=4 3289 B15R2.2195 c1cnnc(c1)NCc2ccncn2 27a_100000736019_100016991348 [0,0,0,0,0,1|2,0,1]=4 3290 B15R2.2195 c1cnnc(c1)NCc2cnccn2 27a_100000737960_100016991348 [0,0,0,0,0,1|2,0,1]=4 3291 B15R2.2195 c1cnnc(c1)NCc2cncnc2 27a_100011243677_100016991348 [0,0,0,0,0,1|2,0,1]=4 3292 B15R2.2196 C(=Cc1c[nH]cn1)Cc2ccccc2 271570a_200016263579_100000756875 [0,0,0,0,0,1|1,0,1]=3 3293 B15R2.2196 C(=Cc1cscn1)Cc2ccccc2 271570a_200016263579_100000751502 [0,0,0,0,0,1|2,0,1]=4 3294 B15R2.2196 C(=Cc1nc[nH]n1)Cc2ccccc2 271570a_200016263579_100000761765 [0,0,0,0,0,1|2,0,1]=4 3295 B15R2.2196 C(=NNc1ccccc1)c2cc[nH]c2 4a_100015195140_100000760201 [0,0,0,0,0,1|1,0,1]=3 3296 B15R2.2196 C(=NNc1ccccc1)c2cc[nH]n2 4a_100015195140_100000738523 [0,0,0,0,0,1|2,0,1]=4 3297 B15R2.2196 C(=NNc1ccccc1)c2ccc[nH]2 4a_100015195140_100000211237 [0,0,0,0,0,1|1,0,2]=4 3298 B15R2.2196 C(=NNc1ccccc1)c2ccco2 4a_100015195140_100000186105 [0,0,0,0,0,1|2,0,1]=4 3299 B15R2.2196 C(=NNc1ccccc1)c2cccs2 4a_100015195140_100000209959 [0,0,0,0,0,1|2,0,1]=4 3300 B15R2.2196 C(=NNc1ccccc1)c2ccoc2 4a_100015195140_100011215517 [0,0,0,0,0,1|2,0,1]=4 3301 B15R2.2196 C(=NNc1ccccc1)c2ccsc2 4a_100015195140_100000188534 [0,0,0,0,0,1|2,0,1]=4 3302 B15R2.2196 C(=NNc1ccccc1)c2cn[nH]c2 4a_100015195140_100016992096 [0,0,0,0,0,1|2,0,1]=4 3303 B15R2.2196 C(=NNc1ccccc1)c2cnc[nH]2 4a_100015195140_100000742939 [0,0,0,0,0,1|0,0,3]=4 3304 B15R2.2196 C(=NNc1ccccc1)c2cnco2 4a_100015195140_100000064291 [0,0,0,0,0,1|1,0,2]=4 3305 B15R2.2196 C(=NNc1ccccc1)c2cncs2 4a_100015195140_100000749870 [0,0,0,0,0,1|1,0,2]=4 3306 B15R2.2196 C(=NNc1ccccc1)c2cocn2 4a_100015195140_100000050382 [0,0,0,0,0,1|1,0,1]=3 3307 B15R2.2196 C(=NNc1ccccc1)c2cscn2 4a_100015195140_100000743575 [0,0,0,0,0,1|1,0,1]=3 3308 B15R2.2196 C(=NNc1ccccc1)c2csnn2 4a_100015195140_100000738508 [0,0,0,0,0,1|2,0,1]=4 3309 B15R2.2196 C(=NNc1ccccc1)c2ncc[nH]2 4a_100015195140_100000743867 [0,0,0,0,0,1|2,0,1]=4 3310 B15R2.2196 C(=NNc1ccccc1)c2ncco2 4a_100015195140_100000064290 [0,0,0,0,0,1|2,0,1]=4 3311 B15R2.2196 C(=NNc1ccccc1)c2nccs2 4a_100015195140_100000750902 [0,0,0,0,0,1|2,0,1]=4 3312 B15R2.2196 C(=NNc1ccccn1)c2cc[nH]c2 4a_100000183288_100000760201 [0,0,0,0,0,1|2,0,1]=4 3313 B15R2.2196 C(=NNc1ccccn1)c2cocn2 4a_100000183288_100000050382 [0,0,0,0,0,1|2,0,1]=4 3314 B15R2.2196 C(=NNc1ccccn1)c2cscn2 4a_100000183288_100000743575 [0,0,0,0,0,1|2,0,1]=4 3315 B15R2.2196 C(=NNc1cccnc1)c2cc[nH]c2 4a_100000728903_100000760201 [0,0,0,0,0,1|2,0,1]=4 3316 B15R2.2196 C(=NNc1cccnc1)c2cocn2 4a_100000728903_100000050382 [0,0,0,0,0,1|2,0,1]=4 3317 B15R2.2196 C(=NNc1cccnc1)c2cscn2 4a_100000728903_100000743575 [0,0,0,0,0,1|2,0,1]=4 3318 B15R2.2196 C(=NNc1ccncc1)c2cc[nH]c2 4a_100000698918_100000760201 [0,0,0,0,0,1|2,0,1]=4 3319 B15R2.2196 C(=NNc1ccncc1)c2cocn2 4a_100000698918_100000050382 [0,0,0,0,0,1|2,0,1]=4 3320 B15R2.2196 C(=NNc1ccncc1)c2cscn2 4a_100000698918_100000743575 [0,0,0,0,0,1|2,0,1]=4 3321 B15R2.2196 c1cc(ccn1)CCSc2c[nH]cn2 62a_100000723409_100000756875 [0,0,0,0,0,1|2,0,0]=3 3322 B15R2.2196 c1cc(ccn1)CCSc2c[nH]cn2 62a_100000756875_100000723409 [0,0,0,0,0,1|2,0,0]=3 3323 B15R2.2196 c1cc(ccn1)CCSc2c[nH]nn2 62a_100000723409_100009819707 [0,0,0,0,0,1|3,0,0]=4 3324 B15R2.2196 c1cc(ccn1)CCSc2c[nH]nn2 62a_100009819707_100000723409 [0,0,0,0,0,1|3,0,0]=4 3325 B15R2.2196 c1cc(ccn1)CCSc2cscn2 62a_100000723409_100000751502 [0,0,0,0,0,1|3,0,0]=4 3326 B15R2.2196 c1cc(ccn1)CCSc2cscn2 62a_100000751502_100000723409 [0,0,0,0,0,1|3,0,0]=4 3327 B15R2.2196 c1cc(ccn1)CCSc2nc[nH]n2 62a_100000723409_100000761765 [0,0,0,0,0,1|3,0,0]=4 3328 B15R2.2196 c1cc(ccn1)CCSc2nc[nH]n2 62a_100000761765_100000723409 [0,0,0,0,0,1|3,0,0]=4 3329 B15R2.2196 c1cc(ccn1)CNCc2c[nH]cn2 207a_100000758547_100000186114 [0,0,0,0,0,1|1,0,0]=2 3330 B15R2.2196 c1cc(ccn1)CNCc2c[nH]nn2 207a_100020620823_100000186114 [0,0,0,0,0,1|2,0,0]=3 3331 B15R2.2196 c1cc(ccn1)CNCc2cc[nH]n2 207a_100000739516_100000186114 [0,0,0,0,0,1|3,0,0]=4 3332 B15R2.2196 c1cc(ccn1)CNCc2ccoc2 207a_100015206860_100000186114 [0,0,0,0,0,1|3,0,0]=4 3333 B15R2.2196 c1cc(ccn1)CNCc2ccoc2 2230a_100015206860_100015193705 [0,0,0,0,0,1|3,0,0]=4 3334 B15R2.2196 c1cc(ccn1)CNCc2ccon2 207a_100000688301_100000186114 [0,0,0,0,0,1|3,0,0]=4 3335 B15R2.2196 c1cc(ccn1)CNCc2ccsc2 207a_100000186416_100000186114 [0,0,0,0,0,1|3,0,0]=4 3336 B15R2.2196 c1cc(ccn1)CNCc2ccsc2 2230a_100000186416_100015193705 [0,0,0,0,0,1|3,0,0]=4 3337 B15R2.2196 c1cc(ccn1)CNCc2cn[nH]c2 207a_100000737208_100000186114 [0,0,0,0,0,1|3,0,0]=4 3338 B15R2.2196 c1cc(ccn1)CNCc2cnco2 207a_100020634212_100000186114 [0,0,0,0,0,1|2,0,1]=4 3339 B15R2.2196 c1cc(ccn1)CNCc2cncs2 207a_100016987365_100000186114 [0,0,0,0,0,1|2,0,1]=4 3340 B15R2.2196 c1cc(ccn1)CNCc2cncs2 2230a_100016987365_100015193705 [0,0,0,0,0,1|2,0,1]=4 3341 B15R2.2196 c1cc(ccn1)CNCc2cocn2 207a_100015188801_100000186114 [0,0,0,0,0,1|2,0,0]=3 3342 B15R2.2196 c1cc(ccn1)CNCc2cscn2 207a_100015185402_100000186114 [0,0,0,0,0,1|2,0,0]=3 3343 B15R2.2196 c1cc(ccn1)CNCc2cscn2 2230a_100015185402_100015193705 [0,0,0,0,0,1|2,0,0]=3 3344 B15R2.2196 c1cc(ccn1)CNCc2ncc[nH]2 207a_100000754540_100000186114 [0,0,0,0,0,1|3,0,0]=4 3345 B15R2.2196 c1cc(ccn1)CNCc2ncco2 207a_100016994969_100000186114 [0,0,0,0,0,1|3,0,0]=4 3346 B15R2.2196 c1cc(ccn1)CNCc2ncco2 2230a_100016994969_100015193705 [0,0,0,0,0,1|3,0,0]=4 3347 B15R2.2196 c1cc(ccn1)CNCc2nccs2 207a_100000740555_100000186114 [0,0,0,0,0,1|3,0,0]=4 3348 B15R2.2196 c1cc(ccn1)CNCc2nccs2 2230a_100000740555_100015193705 [0,0,0,0,0,1|3,0,0]=4 3349 B15R2.2196 c1cc(ccn1)CSCc2c[nH]cn2 62a_100000707719_100015193705 [0,0,0,0,0,1|2,0,0]=3 3350 B15R2.2196 c1cc(ccn1)CSCc2c[nH]cn2 62a_100015193705_100000707719 [0,0,0,0,0,1|2,0,0]=3 3351 B15R2.2196 c1cc(ccn1)CSCc2cscn2 62a_100000205941_100015193705 [0,0,0,0,0,1|3,0,0]=4 3352 B15R2.2196 c1cc(ccn1)CSCc2cscn2 62a_100015193705_100000205941 [0,0,0,0,0,1|3,0,0]=4 3353 B15R2.2196 c1cc(ccn1)SCCc2c[nH]cn2 62a_100000728582_100020628418 [0,0,0,0,0,1|2,0,0]=3 3354 B15R2.2196 c1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100000728582 [0,0,0,0,0,1|2,0,0]=3 3355 B15R2.2196 c1cc(cnn1)CNCc2c[nH]nn2 270004a_100020620823_100011934578 [0,0,0,0,0,1|3,0,0]=4 3356 B15R2.2196 c1cc(cnn1)CNCc2cocn2 270004a_100015188801_100011934578 [0,0,0,0,0,1|3,0,0]=4 3357 B15R2.2196 c1cc(cnn1)SCCc2c[nH]cn2 62a_100000732662_100020628418 [0,0,0,0,0,1|3,0,0]=4 3358 B15R2.2196 c1cc(cnn1)SCCc2c[nH]cn2 62a_100020628418_100000732662 [0,0,0,0,0,1|3,0,0]=4 3359 B15R2.2196 c1cc(ncn1)NCCc2c[nH]cn2 27a_100000755092_100000703185 [0,0,0,0,0,1|2,0,0]=3 3360 B15R2.2196 c1cc(ncn1)SCCc2c[nH]cn2 62a_100000703185_100020628418 [0,0,0,0,0,1|3,0,0]=4 3361 B15R2.2196 c1cc(ncn1)SCCc2c[nH]cn2 62a_100020628418_100000703185 [0,0,0,0,0,1|3,0,0]=4 3362 B15R2.2196 c1ccc(cc1)CCNc2ncns2 27a_100000106460_100000693119 [0,0,0,0,0,1|2,0,1]=4 3363 B15R2.2196 c1ccc(cc1)CCOc2ccsc2 34a_100000106738_100000765856 [0,0,0,0,0,1|3,0,0]=4 3364 B15R2.2196 c1ccc(cc1)CCOc2ccsc2 7a_100000106738_100000765856 [0,0,0,0,0,1|3,0,0]=4 3365 B15R2.2196 c1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011218657 [0,0,0,0,0,1|1,0,0]=2 3366 B15R2.2196 c1ccc(cc1)CCSc2c[nH]cn2 62a_100000765856_100000756875 [0,0,0,0,0,1|1,0,0]=2 3367 B15R2.2196 c1ccc(cc1)CCSc2c[nH]nn2 62a_100000765856_100009819707 [0,0,0,0,0,1|2,0,0]=3 3368 B15R2.2196 c1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011218657 [0,0,0,0,0,1|2,0,0]=3 3369 B15R2.2196 c1ccc(cc1)CCSc2cc[nH]n2 62a_100000062575_100011218657 [0,0,0,0,0,1|3,0,0]=4 3370 B15R2.2196 c1ccc(cc1)CCSc2cc[nH]n2 62a_100000765856_100000062575 [0,0,0,0,0,1|3,0,0]=4 3371 B15R2.2196 c1ccc(cc1)CCSc2ccco2 62a_100000765856_100009814098 [0,0,0,0,0,1|3,0,0]=4 3372 B15R2.2196 c1ccc(cc1)CCSc2ccco2 62a_100009814098_100011218657 [0,0,0,0,0,1|3,0,0]=4 3373 B15R2.2196 c1ccc(cc1)CCSc2cccs2 62a_100000765856_100011215356 [0,0,0,0,0,1|3,0,0]=4 3374 B15R2.2196 c1ccc(cc1)CCSc2cccs2 62a_100011215356_100011218657 [0,0,0,0,0,1|3,0,0]=4 3375 B15R2.2196 c1ccc(cc1)CCSc2ccoc2 62a_100000765856_100011215275 [0,0,0,0,0,1|3,0,0]=4 3376 B15R2.2196 c1ccc(cc1)CCSc2ccoc2 62a_100011215275_100011218657 [0,0,0,0,0,1|3,0,0]=4 3377 B15R2.2196 c1ccc(cc1)CCSc2ccon2 62a_100000765856_100009818083 [0,0,0,0,0,1|3,0,0]=4 3378 B15R2.2196 c1ccc(cc1)CCSc2ccon2 62a_100009818083_100011218657 [0,0,0,0,0,1|3,0,0]=4 3379 B15R2.2196 c1ccc(cc1)CCSc2ccsc2 62a_100000738268_100011218657 [0,0,0,0,0,1|3,0,0]=4 3380 B15R2.2196 c1ccc(cc1)CCSc2ccsc2 62a_100000765856_100000738268 [0,0,0,0,0,1|3,0,0]=4 3381 B15R2.2196 c1ccc(cc1)CCSc2ccsn2 62a_100000765856_100009818082 [0,0,0,0,0,1|3,0,0]=4 3382 B15R2.2196 c1ccc(cc1)CCSc2ccsn2 62a_100009818082_100011218657 [0,0,0,0,0,1|3,0,0]=4 3383 B15R2.2196 c1ccc(cc1)CCSc2cn[nH]c2 62a_100000238712_100011218657 [0,0,0,0,0,1|3,0,0]=4 3384 B15R2.2196 c1ccc(cc1)CCSc2cn[nH]c2 62a_100000765856_100000238712 [0,0,0,0,0,1|3,0,0]=4 3385 B15R2.2196 c1ccc(cc1)CCSc2cnco2 62a_100000765856_100020591547 [0,0,0,0,0,1|2,0,1]=4 3386 B15R2.2196 c1ccc(cc1)CCSc2cnco2 62a_100020591547_100011218657 [0,0,0,0,0,1|2,0,1]=4 3387 B15R2.2196 c1ccc(cc1)CCSc2cncs2 62a_100000765856_100011934649 [0,0,0,0,0,1|2,0,1]=4 3388 B15R2.2196 c1ccc(cc1)CCSc2cncs2 62a_100011934649_100011218657 [0,0,0,0,0,1|2,0,1]=4 3389 B15R2.2196 c1ccc(cc1)CCSc2cscn2 62a_100000751502_100011218657 [0,0,0,0,0,1|2,0,0]=3 3390 B15R2.2196 c1ccc(cc1)CCSc2cscn2 62a_100000765856_100000751502 [0,0,0,0,0,1|2,0,0]=3 3391 B15R2.2196 c1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011218657 [0,0,0,0,0,1|2,0,0]=3 3392 B15R2.2196 c1ccc(cc1)CCSc2nc[nH]n2 62a_100000765856_100000761765 [0,0,0,0,0,1|2,0,0]=3 3393 B15R2.2196 c1ccc(cc1)CCSc2ncc[nH]2 62a_100000765856_100025796157 [0,0,0,0,0,1|3,0,0]=4 3394 B15R2.2196 c1ccc(cc1)CCSc2ncc[nH]2 62a_100025796157_100011218657 [0,0,0,0,0,1|3,0,0]=4 3395 B15R2.2196 c1ccc(cc1)CCSc2ncco2 62a_100000765856_100011787736 [0,0,0,0,0,1|3,0,0]=4 3396 B15R2.2196 c1ccc(cc1)CCSc2ncco2 62a_100011787736_100011218657 [0,0,0,0,0,1|3,0,0]=4 3397 B15R2.2196 c1ccc(cc1)CCSc2nccs2 62a_100000211983_100011218657 [0,0,0,0,0,1|3,0,0]=4 3398 B15R2.2196 c1ccc(cc1)CCSc2nccs2 62a_100000765856_100000211983 [0,0,0,0,0,1|3,0,0]=4 3399 B15R2.2196 c1ccc(cc1)CCSc2ncns2 62a_100000693119_100011218657 [0,0,0,0,0,1|2,0,1]=4 3400 B15R2.2196 c1ccc(cc1)CCSc2ncns2 62a_100000765856_100000693119 [0,0,0,0,0,1|2,0,1]=4 3401 B15R2.2196 c1ccc(cc1)CNCC2=NCCN2 34a_100015324214_100000737910 [0,0,0,0,0,1|2,0,1]=4 3402 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100015611070 [0,0,0,0,0,1|0,0,0]=1 3403 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 2230a_100015324214_100000707719 [0,0,0,0,0,1|0,0,0]=1 3404 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 34a_100015324214_100000707719 [0,0,0,0,0,1|0,0,0]=1 3405 B15R2.2196 c1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100015611070 [0,0,0,0,0,1|1,0,0]=2 3406 B15R2.2196 c1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100015611070 [0,0,0,0,0,1|1,0,0]=2 3407 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100015611070 [0,0,0,0,0,1|2,0,0]=3 3408 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100015324214_100000738523 [0,0,0,0,0,1|2,0,0]=3 3409 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 270004a_100015324214_100000738523 [0,0,0,0,0,1|2,0,0]=3 3410 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100000185738_100015611070 [0,0,0,0,0,1|2,0,0]=3 3411 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100015324214_100000186105 [0,0,0,0,0,1|2,0,0]=3 3412 B15R2.2196 c1ccc(cc1)CNCc2ccco2 2230a_100000185738_100015291786 [0,0,0,0,0,1|2,0,0]=3 3413 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100000185738_100015611070 [0,0,0,0,0,1|2,0,0]=3 3414 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100015324214_100000186105 [0,0,0,0,0,1|2,0,0]=3 3415 B15R2.2196 c1ccc(cc1)CNCc2ccco2 34a_100000185738_100015291786 [0,0,0,0,0,1|2,0,0]=3 3416 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100000211653_100015611070 [0,0,0,0,0,1|2,0,0]=3 3417 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100015324214_100000209959 [0,0,0,0,0,1|2,0,0]=3 3418 B15R2.2196 c1ccc(cc1)CNCc2cccs2 2230a_100000211653_100015291786 [0,0,0,0,0,1|2,0,0]=3 3419 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100000211653_100015611070 [0,0,0,0,0,1|2,0,0]=3 3420 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100015324214_100000209959 [0,0,0,0,0,1|2,0,0]=3 3421 B15R2.2196 c1ccc(cc1)CNCc2ccn[nH]2 2230a_100015324214_100000728653 [0,0,0,0,0,1|2,0,1]=4 3422 B15R2.2196 c1ccc(cc1)CNCc2ccn[nH]2 34a_100015324214_100000728653 [0,0,0,0,0,1|2,0,1]=4 3423 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015206860_100015611070 [0,0,0,0,0,1|2,0,0]=3 3424 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015324214_100011215517 [0,0,0,0,0,1|2,0,0]=3 3425 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100015291786 [0,0,0,0,0,1|2,0,0]=3 3426 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100015611070 [0,0,0,0,0,1|2,0,0]=3 3427 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015324214_100011215517 [0,0,0,0,0,1|2,0,0]=3 3428 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 34a_100015206860_100015291786 [0,0,0,0,0,1|2,0,0]=3 3429 B15R2.2196 c1ccc(cc1)CNCc2ccon2 207a_100000688301_100015611070 [0,0,0,0,0,1|2,0,0]=3 3430 B15R2.2196 c1ccc(cc1)CNCc2ccon2 2230a_100015324214_100000234950 [0,0,0,0,0,1|2,0,0]=3 3431 B15R2.2196 c1ccc(cc1)CNCc2ccon2 270004a_100000688301_100015611070 [0,0,0,0,0,1|2,0,0]=3 3432 B15R2.2196 c1ccc(cc1)CNCc2ccon2 34a_100015324214_100000234950 [0,0,0,0,0,1|2,0,0]=3 3433 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100000186416_100015611070 [0,0,0,0,0,1|2,0,0]=3 3434 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100015324214_100000188534 [0,0,0,0,0,1|2,0,0]=3 3435 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100015291786 [0,0,0,0,0,1|2,0,0]=3 3436 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100015324214_100011261437 [0,0,0,0,0,1|2,0,0]=3 3437 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100015611070 [0,0,0,0,0,1|2,0,0]=3 3438 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100015324214_100000188534 [0,0,0,0,0,1|2,0,0]=3 3439 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100000186416_100015291786 [0,0,0,0,0,1|2,0,0]=3 3440 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100015324214_100011261437 [0,0,0,0,0,1|2,0,0]=3 3441 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100015611070 [0,0,0,0,0,1|2,0,0]=3 3442 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100015324214_100016992096 [0,0,0,0,0,1|2,0,0]=3 3443 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100015611070 [0,0,0,0,0,1|2,0,0]=3 3444 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100015324214_100016992096 [0,0,0,0,0,1|2,0,0]=3 3445 B15R2.2196 c1ccc(cc1)CNCc2cnc[nH]2 207a_100015324214_100000742939 [0,0,0,0,0,1|0,0,2]=3 3446 B15R2.2196 c1ccc(cc1)CNCc2cnco2 207a_100020634212_100015611070 [0,0,0,0,0,1|1,0,1]=3 3447 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100015324214_100000064291 [0,0,0,0,0,1|1,0,1]=3 3448 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100020634212_100015611070 [0,0,0,0,0,1|1,0,1]=3 3449 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100015324214_100000749870 [0,0,0,0,0,1|1,0,1]=3 3450 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100016987365_100015611070 [0,0,0,0,0,1|1,0,1]=3 3451 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100015324214_100015185245 [0,0,0,0,0,1|1,0,1]=3 3452 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100016987365_100015291786 [0,0,0,0,0,1|1,0,1]=3 3453 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100015324214_100000749870 [0,0,0,0,0,1|1,0,1]=3 3454 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100016987365_100015611070 [0,0,0,0,0,1|1,0,1]=3 3455 B15R2.2196 c1ccc(cc1)CNCc2cncs2 34a_100015324214_100015185245 [0,0,0,0,0,1|1,0,1]=3 3456 B15R2.2196 c1ccc(cc1)CNCc2cocn2 207a_100015188801_100015611070 [0,0,0,0,0,1|1,0,0]=2 3457 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015188801_100015611070 [0,0,0,0,0,1|1,0,0]=2 3458 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015324214_100000050382 [0,0,0,0,0,1|1,0,0]=2 3459 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015185402_100015611070 [0,0,0,0,0,1|1,0,0]=2 3460 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015324214_100000743575 [0,0,0,0,0,1|1,0,0]=2 3461 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015185402_100015291786 [0,0,0,0,0,1|1,0,0]=2 3462 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015324214_100000205941 [0,0,0,0,0,1|1,0,0]=2 3463 B15R2.2196 c1ccc(cc1)CNCc2cscn2 270004a_100015324214_100000743575 [0,0,0,0,0,1|1,0,0]=2 3464 B15R2.2196 c1ccc(cc1)CNCc2cscn2 34a_100015324214_100000205941 [0,0,0,0,0,1|1,0,0]=2 3465 B15R2.2196 c1ccc(cc1)CNCc2csnn2 270004a_100015324214_100000738508 [0,0,0,0,0,1|2,0,0]=3 3466 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100015611070 [0,0,0,0,0,1|2,0,0]=3 3467 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100015324214_100000743867 [0,0,0,0,0,1|2,0,0]=3 3468 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 2230a_100015324214_100016991755 [0,0,0,0,0,1|2,0,0]=3 3469 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100015611070 [0,0,0,0,0,1|2,0,0]=3 3470 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 34a_100015324214_100016991755 [0,0,0,0,0,1|2,0,0]=3 3471 B15R2.2196 c1ccc(cc1)CNCc2ncco2 207a_100016994969_100015611070 [0,0,0,0,0,1|2,0,0]=3 3472 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100015324214_103436540062 [0,0,0,0,0,1|2,0,0]=3 3473 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100016994969_100015291786 [0,0,0,0,0,1|2,0,0]=3 3474 B15R2.2196 c1ccc(cc1)CNCc2ncco2 270004a_100015324214_100000064290 [0,0,0,0,0,1|2,0,0]=3 3475 B15R2.2196 c1ccc(cc1)CNCc2ncco2 34a_100015324214_103436540062 [0,0,0,0,0,1|2,0,0]=3 3476 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100000740555_100015611070 [0,0,0,0,0,1|2,0,0]=3 3477 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100015324214_100000750902 [0,0,0,0,0,1|2,0,0]=3 3478 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100000740555_100015291786 [0,0,0,0,0,1|2,0,0]=3 3479 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100015324214_100015184050 [0,0,0,0,0,1|2,0,0]=3 3480 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100000740555_100015611070 [0,0,0,0,0,1|2,0,0]=3 3481 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100015324214_100000750902 [0,0,0,0,0,1|2,0,0]=3 3482 B15R2.2196 c1ccc(cc1)CNCc2nccs2 34a_100015324214_100015184050 [0,0,0,0,0,1|2,0,0]=3 3483 B15R2.2196 c1ccc(cc1)CNCc2ncon2 34a_100015324214_100000233494 [0,0,0,0,0,1|2,0,0]=3 3484 B15R2.2196 c1ccc(cc1)CNCc2nnc[nH]2 2230a_200015183720_100015291786 [0,0,0,0,0,1|1,0,2]=4 3485 B15R2.2196 c1ccc(cc1)CNCc2nnn[nH]2 34a_100015324214_100000765167 [0,0,0,0,0,1|2,0,1]=4 3486 B15R2.2196 c1ccc(cc1)CNCn2cncn2 2230a_100015324214_200020645497 [0,0,0,0,0,1|1,0,1]=3 3487 B15R2.2196 c1ccc(cc1)CNCn2cncn2 34a_100015324214_200020645497 [0,0,0,0,0,1|1,0,1]=3 3488 B15R2.2196 c1ccc(cc1)COCc2c[nH]cn2 34a_100000210790_100000707719 [0,0,0,0,0,1|1,0,0]=2 3489 B15R2.2196 c1ccc(cc1)COCc2ccco2 34a_100000210059_100015291786 [0,0,0,0,0,1|3,0,0]=4 3490 B15R2.2196 c1ccc(cc1)COCc2cccs2 34a_100000211240_100015291786 [0,0,0,0,0,1|3,0,0]=4 3491 B15R2.2196 c1ccc(cc1)COCc2ccoc2 34a_100011215357_100015291786 [0,0,0,0,0,1|3,0,0]=4 3492 B15R2.2196 c1ccc(cc1)COCc2ccon2 34a_100000210790_100000234950 [0,0,0,0,0,1|3,0,0]=4 3493 B15R2.2196 c1ccc(cc1)COCc2ccon2 7a_100000210790_100000234950 [0,0,0,0,0,1|3,0,0]=4 3494 B15R2.2196 c1ccc(cc1)COCc2ccsc2 34a_100000210790_100011261437 [0,0,0,0,0,1|3,0,0]=4 3495 B15R2.2196 c1ccc(cc1)COCc2ccsc2 34a_100011215551_100015291786 [0,0,0,0,0,1|3,0,0]=4 3496 B15R2.2196 c1ccc(cc1)COCc2ccsc2 7a_100000210790_100011261437 [0,0,0,0,0,1|3,0,0]=4 3497 B15R2.2196 c1ccc(cc1)COCc2cncs2 34a_100000210790_100015185245 [0,0,0,0,0,1|2,0,1]=4 3498 B15R2.2196 c1ccc(cc1)COCc2cncs2 7a_100000210790_100015185245 [0,0,0,0,0,1|2,0,1]=4 3499 B15R2.2196 c1ccc(cc1)COCc2cscn2 34a_100000210790_100000205941 [0,0,0,0,0,1|2,0,0]=3 3500 B15R2.2196 c1ccc(cc1)COCc2cscn2 7a_100000210790_100000205941 [0,0,0,0,0,1|2,0,0]=3 3501 B15R2.2196 c1ccc(cc1)COCc2ncc[nH]2 34a_100000210790_100016991755 [0,0,0,0,0,1|3,0,0]=4 3502 B15R2.2196 c1ccc(cc1)COCc2ncc[nH]2 7a_100000210790_100000753453 [0,0,0,0,0,1|3,0,0]=4 3503 B15R2.2196 c1ccc(cc1)COCc2ncco2 34a_100000062594_100015291786 [0,0,0,0,0,1|3,0,0]=4 3504 B15R2.2196 c1ccc(cc1)COCc2ncco2 34a_100000210790_103436540062 [0,0,0,0,0,1|3,0,0]=4 3505 B15R2.2196 c1ccc(cc1)COCc2ncco2 7a_100000210790_103436540062 [0,0,0,0,0,1|3,0,0]=4 3506 B15R2.2196 c1ccc(cc1)COCc2nccs2 34a_100000210790_100015184050 [0,0,0,0,0,1|3,0,0]=4 3507 B15R2.2196 c1ccc(cc1)COCc2nccs2 7a_100000210790_100015184050 [0,0,0,0,0,1|3,0,0]=4 3508 B15R2.2196 c1ccc(cc1)COCc2ncon2 34a_100000210790_100000233494 [0,0,0,0,0,1|3,0,0]=4 3509 B15R2.2196 c1ccc(cc1)COCn2cccn2 34a_100000731028_100015291786 [0,0,0,0,0,1|3,0,0]=4 3510 B15R2.2196 c1ccc(cc1)COCn2cncn2 34a_100000210790_200020645497 [0,0,0,0,0,1|2,0,1]=4 3511 B15R2.2196 c1ccc(cc1)COCn2cncn2 7a_100000210790_200020645497 [0,0,0,0,0,1|2,0,1]=4 3512 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000211182_100000707719 [0,0,0,0,0,1|1,0,0]=2 3513 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100015291786 [0,0,0,0,0,1|1,0,0]=2 3514 B15R2.2196 c1ccc(cc1)CSCc2ccon2 62a_100000211182_100000234950 [0,0,0,0,0,1|3,0,0]=4 3515 B15R2.2196 c1ccc(cc1)CSCc2ccon2 62a_100000234950_100015291786 [0,0,0,0,0,1|3,0,0]=4 3516 B15R2.2196 c1ccc(cc1)CSCc2ccsc2 62a_100000211182_100011233845 [0,0,0,0,0,1|3,0,0]=4 3517 B15R2.2196 c1ccc(cc1)CSCc2ccsc2 62a_100011261437_100015291786 [0,0,0,0,0,1|3,0,0]=4 3518 B15R2.2196 c1ccc(cc1)CSCc2cncs2 62a_100000211182_100015185245 [0,0,0,0,0,1|2,0,1]=4 3519 B15R2.2196 c1ccc(cc1)CSCc2cncs2 62a_100015185245_100015291786 [0,0,0,0,0,1|2,0,1]=4 3520 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000205941_100015291786 [0,0,0,0,0,1|2,0,0]=3 3521 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000211182_100000205941 [0,0,0,0,0,1|2,0,0]=3 3522 B15R2.2196 c1ccc(cc1)CSCc2ncc[nH]2 62a_100000211182_100016991755 [0,0,0,0,0,1|3,0,0]=4 3523 B15R2.2196 c1ccc(cc1)CSCc2ncc[nH]2 62a_100016991755_100015291786 [0,0,0,0,0,1|3,0,0]=4 3524 B15R2.2196 c1ccc(cc1)CSCc2ncco2 62a_100000211182_103436540062 [0,0,0,0,0,1|3,0,0]=4 3525 B15R2.2196 c1ccc(cc1)CSCc2ncco2 62a_103436540062_100015291786 [0,0,0,0,0,1|3,0,0]=4 3526 B15R2.2196 c1ccc(cc1)CSCc2nccs2 62a_100000211182_100015184050 [0,0,0,0,0,1|3,0,0]=4 3527 B15R2.2196 c1ccc(cc1)CSCc2nccs2 62a_100015184050_100015291786 [0,0,0,0,0,1|3,0,0]=4 3528 B15R2.2196 c1ccc(cc1)CSCc2ncon2 62a_100000211182_100000233494 [0,0,0,0,0,1|3,0,0]=4 3529 B15R2.2196 c1ccc(cc1)CSCc2ncon2 62a_100000233494_100015291786 [0,0,0,0,0,1|3,0,0]=4 3530 B15R2.2196 c1ccc(cc1)CSCn2cncn2 62a_100000211182_200020645497 [0,0,0,0,0,1|2,0,1]=4 3531 B15R2.2196 c1ccc(cc1)CSCn2cncn2 62a_200020645497_100015291786 [0,0,0,0,0,1|2,0,1]=4 3532 B15R2.2196 c1ccc(cc1)NCCc2cccs2 34a_100000106764_100000748579 [0,0,0,0,0,1|2,0,0]=3 3533 B15R2.2196 c1ccc(cc1)NCCn2cccn2 34a_100000106764_100015204718 [0,0,0,0,0,1|2,0,0]=3 3534 B15R2.2196 c1ccc(cc1)NCCn2cncn2 34a_100000106764_200000749826 [0,0,0,0,0,1|1,0,1]=3 3535 B15R2.2196 c1ccc(cc1)OCCc2c[nH]cn2 7a_100000210340_100020628418 [0,0,0,0,0,1|1,0,0]=2 3536 B15R2.2196 c1ccc(cc1)OCCc2cccs2 34a_100000210340_100000748579 [0,0,0,0,0,1|3,0,0]=4 3537 B15R2.2196 c1ccc(cc1)OCCc2cccs2 7a_100000210340_100000748579 [0,0,0,0,0,1|3,0,0]=4 3538 B15R2.2196 c1ccc(cc1)OCCc2cn[nH]c2 7a_100000210340_100000743252 [0,0,0,0,0,1|3,0,0]=4 3539 B15R2.2196 c1ccc(cc1)OCCn2cccn2 34a_100000210340_100015204718 [0,0,0,0,0,1|3,0,0]=4 3540 B15R2.2196 c1ccc(cc1)OCCn2cccn2 7a_100000210340_100000685285 [0,0,0,0,0,1|3,0,0]=4 3541 B15R2.2196 c1ccc(cc1)OCCn2cncn2 34a_100000210340_200000749826 [0,0,0,0,0,1|2,0,1]=4 3542 B15R2.2196 c1ccc(cc1)OCCn2cncn2 7a_100000210340_100000731791 [0,0,0,0,0,1|2,0,1]=4 3543 B15R2.2196 c1ccc(cc1)SCCc2c[nH]cn2 62a_100000719477_100020628418 [0,0,0,0,0,1|1,0,0]=2 3544 B15R2.2196 c1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000041952 [0,0,0,0,0,1|1,0,0]=2 3545 B15R2.2196 c1ccc(cc1)SCCc2cccs2 62a_100000719477_100000748579 [0,0,0,0,0,1|3,0,0]=4 3546 B15R2.2196 c1ccc(cc1)SCCc2cccs2 62a_100000748579_100000041952 [0,0,0,0,0,1|3,0,0]=4 3547 B15R2.2196 c1ccc(cc1)SCCc2cn[nH]c2 62a_100000719477_100000743252 [0,0,0,0,0,1|3,0,0]=4 3548 B15R2.2196 c1ccc(cc1)SCCc2cn[nH]c2 62a_100000743252_100000041952 [0,0,0,0,0,1|3,0,0]=4 3549 B15R2.2196 c1ccc(cc1)SCCn2cccn2 62a_100000719477_100000685285 [0,0,0,0,0,1|3,0,0]=4 3550 B15R2.2196 c1ccc(cc1)SCCn2cccn2 62a_100015204718_100000041952 [0,0,0,0,0,1|3,0,0]=4 3551 B15R2.2196 c1ccc(cc1)SCCn2cncn2 62a_100000719477_100000731791 [0,0,0,0,0,1|2,0,1]=4 3552 B15R2.2196 c1ccc(cc1)SCCn2cncn2 62a_100000731791_100000041952 [0,0,0,0,0,1|2,0,1]=4 3553 B15R2.2196 c1ccc(cc1)SCSc2c[nH]cn2 62a_100000756875_100011218342 [0,0,0,0,0,1|1,0,0]=2 3554 B15R2.2196 c1ccc(cc1)SCSc2c[nH]cn2 62a_100011218342_100000756875 [0,0,0,0,0,1|1,0,0]=2 3555 B15R2.2196 c1ccc(cc1)SCSc2c[nH]nn2 62a_100009819707_100011218342 [0,0,0,0,0,1|2,0,0]=3 3556 B15R2.2196 c1ccc(cc1)SCSc2c[nH]nn2 62a_100011218342_100009819707 [0,0,0,0,0,1|2,0,0]=3 3557 B15R2.2196 c1ccc(cc1)SCSc2cc[nH]n2 62a_100000062575_100011218342 [0,0,0,0,0,1|3,0,0]=4 3558 B15R2.2196 c1ccc(cc1)SCSc2cc[nH]n2 62a_100011218342_100000062575 [0,0,0,0,0,1|3,0,0]=4 3559 B15R2.2196 c1ccc(cc1)SCSc2ccco2 62a_100009814098_100011218342 [0,0,0,0,0,1|3,0,0]=4 3560 B15R2.2196 c1ccc(cc1)SCSc2ccco2 62a_100011218342_100009814098 [0,0,0,0,0,1|3,0,0]=4 3561 B15R2.2196 c1ccc(cc1)SCSc2cccs2 62a_100011215356_100011218342 [0,0,0,0,0,1|3,0,0]=4 3562 B15R2.2196 c1ccc(cc1)SCSc2cccs2 62a_100011218342_100011215356 [0,0,0,0,0,1|3,0,0]=4 3563 B15R2.2196 c1ccc(cc1)SCSc2ccoc2 62a_100011215275_100011218342 [0,0,0,0,0,1|3,0,0]=4 3564 B15R2.2196 c1ccc(cc1)SCSc2ccoc2 62a_100011218342_100011215275 [0,0,0,0,0,1|3,0,0]=4 3565 B15R2.2196 c1ccc(cc1)SCSc2ccon2 62a_100009818083_100011218342 [0,0,0,0,0,1|3,0,0]=4 3566 B15R2.2196 c1ccc(cc1)SCSc2ccon2 62a_100011218342_100009818083 [0,0,0,0,0,1|3,0,0]=4 3567 B15R2.2196 c1ccc(cc1)SCSc2ccsc2 62a_100000738268_100011218342 [0,0,0,0,0,1|3,0,0]=4 3568 B15R2.2196 c1ccc(cc1)SCSc2ccsc2 62a_100011218342_100000738268 [0,0,0,0,0,1|3,0,0]=4 3569 B15R2.2196 c1ccc(cc1)SCSc2ccsn2 62a_100009818082_100011218342 [0,0,0,0,0,1|3,0,0]=4 3570 B15R2.2196 c1ccc(cc1)SCSc2ccsn2 62a_100011218342_100009818082 [0,0,0,0,0,1|3,0,0]=4 3571 B15R2.2196 c1ccc(cc1)SCSc2cn[nH]c2 62a_100000238712_100011218342 [0,0,0,0,0,1|3,0,0]=4 3572 B15R2.2196 c1ccc(cc1)SCSc2cn[nH]c2 62a_100011218342_100000238712 [0,0,0,0,0,1|3,0,0]=4 3573 B15R2.2196 c1ccc(cc1)SCSc2cnco2 62a_100011218342_100020591547 [0,0,0,0,0,1|2,0,1]=4 3574 B15R2.2196 c1ccc(cc1)SCSc2cnco2 62a_100020591547_100011218342 [0,0,0,0,0,1|2,0,1]=4 3575 B15R2.2196 c1ccc(cc1)SCSc2cncs2 62a_100011218342_100011934649 [0,0,0,0,0,1|2,0,1]=4 3576 B15R2.2196 c1ccc(cc1)SCSc2cncs2 62a_100011934649_100011218342 [0,0,0,0,0,1|2,0,1]=4 3577 B15R2.2196 c1ccc(cc1)SCSc2cscn2 62a_100000751502_100011218342 [0,0,0,0,0,1|2,0,0]=3 3578 B15R2.2196 c1ccc(cc1)SCSc2cscn2 62a_100011218342_100000751502 [0,0,0,0,0,1|2,0,0]=3 3579 B15R2.2196 c1ccc(cc1)SCSc2nc[nH]n2 62a_100000761765_100011218342 [0,0,0,0,0,1|2,0,0]=3 3580 B15R2.2196 c1ccc(cc1)SCSc2nc[nH]n2 62a_100011218342_100000761765 [0,0,0,0,0,1|2,0,0]=3 3581 B15R2.2196 c1ccc(cc1)SCSc2ncc[nH]2 62a_100011218342_100025796157 [0,0,0,0,0,1|3,0,0]=4 3582 B15R2.2196 c1ccc(cc1)SCSc2ncc[nH]2 62a_100025796157_100011218342 [0,0,0,0,0,1|3,0,0]=4 3583 B15R2.2196 c1ccc(cc1)SCSc2ncco2 62a_100011218342_100011787736 [0,0,0,0,0,1|3,0,0]=4 3584 B15R2.2196 c1ccc(cc1)SCSc2ncco2 62a_100011787736_100011218342 [0,0,0,0,0,1|3,0,0]=4 3585 B15R2.2196 c1ccc(cc1)SCSc2nccs2 62a_100000211983_100011218342 [0,0,0,0,0,1|3,0,0]=4 3586 B15R2.2196 c1ccc(cc1)SCSc2nccs2 62a_100011218342_100000211983 [0,0,0,0,0,1|3,0,0]=4 3587 B15R2.2196 c1ccc(cc1)SCSc2ncns2 62a_100000693119_100011218342 [0,0,0,0,0,1|2,0,1]=4 3588 B15R2.2196 c1ccc(cc1)SCSc2ncns2 62a_100011218342_100000693119 [0,0,0,0,0,1|2,0,1]=4 3589 B15R2.2196 c1ccc(nc1)CCSc2c[nH]cn2 62a_100000756875_100015183660 [0,0,0,0,0,1|2,0,0]=3 3590 B15R2.2196 c1ccc(nc1)CCSc2c[nH]cn2 62a_100015183660_100000756875 [0,0,0,0,0,1|2,0,0]=3 3591 B15R2.2196 c1ccc(nc1)CCSc2c[nH]nn2 62a_100009819707_100015183660 [0,0,0,0,0,1|3,0,0]=4 3592 B15R2.2196 c1ccc(nc1)CCSc2c[nH]nn2 62a_100015183660_100009819707 [0,0,0,0,0,1|3,0,0]=4 3593 B15R2.2196 c1ccc(nc1)CCSc2cscn2 62a_100000751502_100015183660 [0,0,0,0,0,1|3,0,0]=4 3594 B15R2.2196 c1ccc(nc1)CCSc2cscn2 62a_100015183660_100000751502 [0,0,0,0,0,1|3,0,0]=4 3595 B15R2.2196 c1ccc(nc1)CCSc2nc[nH]n2 62a_100000761765_100015183660 [0,0,0,0,0,1|3,0,0]=4 3596 B15R2.2196 c1ccc(nc1)CCSc2nc[nH]n2 62a_100015183660_100000761765 [0,0,0,0,0,1|3,0,0]=4 3597 B15R2.2196 c1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100000209966 [0,0,0,0,0,1|1,0,0]=2 3598 B15R2.2196 c1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100000209966 [0,0,0,0,0,1|2,0,0]=3 3599 B15R2.2196 c1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100000209966 [0,0,0,0,0,1|2,0,0]=3 3600 B15R2.2196 c1ccc(nc1)CNCc2cc[nH]n2 207a_100000739516_100000209966 [0,0,0,0,0,1|3,0,0]=4 3601 B15R2.2196 c1ccc(nc1)CNCc2cc[nH]n2 270004a_100000210449_100000738523 [0,0,0,0,0,1|3,0,0]=4 3602 B15R2.2196 c1ccc(nc1)CNCc2ccco2 207a_100000185738_100000209966 [0,0,0,0,0,1|3,0,0]=4 3603 B15R2.2196 c1ccc(nc1)CNCc2ccco2 2230a_100000185738_100000721315 [0,0,0,0,0,1|3,0,0]=4 3604 B15R2.2196 c1ccc(nc1)CNCc2ccco2 270004a_100000185738_100000209966 [0,0,0,0,0,1|3,0,0]=4 3605 B15R2.2196 c1ccc(nc1)CNCc2ccco2 270004a_100000210449_100000186105 [0,0,0,0,0,1|3,0,0]=4 3606 B15R2.2196 c1ccc(nc1)CNCc2ccco2 34a_100000185738_100000721315 [0,0,0,0,0,1|3,0,0]=4 3607 B15R2.2196 c1ccc(nc1)CNCc2cccs2 207a_100000211653_100000209966 [0,0,0,0,0,1|3,0,0]=4 3608 B15R2.2196 c1ccc(nc1)CNCc2cccs2 2230a_100000211653_100000721315 [0,0,0,0,0,1|3,0,0]=4 3609 B15R2.2196 c1ccc(nc1)CNCc2cccs2 270004a_100000210449_100000209959 [0,0,0,0,0,1|3,0,0]=4 3610 B15R2.2196 c1ccc(nc1)CNCc2cccs2 270004a_100000211653_100000209966 [0,0,0,0,0,1|3,0,0]=4 3611 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 207a_100015206860_100000209966 [0,0,0,0,0,1|3,0,0]=4 3612 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 2230a_100015206860_100000721315 [0,0,0,0,0,1|3,0,0]=4 3613 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 270004a_100000210449_100011215517 [0,0,0,0,0,1|3,0,0]=4 3614 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 270004a_100015206860_100000209966 [0,0,0,0,0,1|3,0,0]=4 3615 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 34a_100015206860_100000721315 [0,0,0,0,0,1|3,0,0]=4 3616 B15R2.2196 c1ccc(nc1)CNCc2ccon2 207a_100000688301_100000209966 [0,0,0,0,0,1|3,0,0]=4 3617 B15R2.2196 c1ccc(nc1)CNCc2ccon2 270004a_100000688301_100000209966 [0,0,0,0,0,1|3,0,0]=4 3618 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 207a_100000186416_100000209966 [0,0,0,0,0,1|3,0,0]=4 3619 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 2230a_100000186416_100000721315 [0,0,0,0,0,1|3,0,0]=4 3620 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 270004a_100000186416_100000209966 [0,0,0,0,0,1|3,0,0]=4 3621 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 270004a_100000210449_100000188534 [0,0,0,0,0,1|3,0,0]=4 3622 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 34a_100000186416_100000721315 [0,0,0,0,0,1|3,0,0]=4 3623 B15R2.2196 c1ccc(nc1)CNCc2cn[nH]c2 207a_100000737208_100000209966 [0,0,0,0,0,1|3,0,0]=4 3624 B15R2.2196 c1ccc(nc1)CNCc2cn[nH]c2 270004a_100000210449_100016992096 [0,0,0,0,0,1|3,0,0]=4 3625 B15R2.2196 c1ccc(nc1)CNCc2cn[nH]c2 270004a_100000737208_100000209966 [0,0,0,0,0,1|3,0,0]=4 3626 B15R2.2196 c1ccc(nc1)CNCc2cnco2 207a_100020634212_100000209966 [0,0,0,0,0,1|2,0,1]=4 3627 B15R2.2196 c1ccc(nc1)CNCc2cnco2 270004a_100000210449_100000064291 [0,0,0,0,0,1|2,0,1]=4 3628 B15R2.2196 c1ccc(nc1)CNCc2cnco2 270004a_100020634212_100000209966 [0,0,0,0,0,1|2,0,1]=4 3629 B15R2.2196 c1ccc(nc1)CNCc2cncs2 207a_100016987365_100000209966 [0,0,0,0,0,1|2,0,1]=4 3630 B15R2.2196 c1ccc(nc1)CNCc2cncs2 2230a_100016987365_100000721315 [0,0,0,0,0,1|2,0,1]=4 3631 B15R2.2196 c1ccc(nc1)CNCc2cncs2 270004a_100000210449_100000749870 [0,0,0,0,0,1|2,0,1]=4 3632 B15R2.2196 c1ccc(nc1)CNCc2cncs2 270004a_100016987365_100000209966 [0,0,0,0,0,1|2,0,1]=4 3633 B15R2.2196 c1ccc(nc1)CNCc2cocn2 207a_100015188801_100000209966 [0,0,0,0,0,1|2,0,0]=3 3634 B15R2.2196 c1ccc(nc1)CNCc2cocn2 270004a_100000210449_100000050382 [0,0,0,0,0,1|2,0,0]=3 3635 B15R2.2196 c1ccc(nc1)CNCc2cocn2 270004a_100015188801_100000209966 [0,0,0,0,0,1|2,0,0]=3 3636 B15R2.2196 c1ccc(nc1)CNCc2cscn2 207a_100015185402_100000209966 [0,0,0,0,0,1|2,0,0]=3 3637 B15R2.2196 c1ccc(nc1)CNCc2cscn2 2230a_100015185402_100000721315 [0,0,0,0,0,1|2,0,0]=3 3638 B15R2.2196 c1ccc(nc1)CNCc2cscn2 270004a_100000210449_100000743575 [0,0,0,0,0,1|2,0,0]=3 3639 B15R2.2196 c1ccc(nc1)CNCc2csnn2 270004a_100000210449_100000738508 [0,0,0,0,0,1|3,0,0]=4 3640 B15R2.2196 c1ccc(nc1)CNCc2ncc[nH]2 207a_100000754540_100000209966 [0,0,0,0,0,1|3,0,0]=4 3641 B15R2.2196 c1ccc(nc1)CNCc2ncc[nH]2 270004a_100000754540_100000209966 [0,0,0,0,0,1|3,0,0]=4 3642 B15R2.2196 c1ccc(nc1)CNCc2ncco2 207a_100016994969_100000209966 [0,0,0,0,0,1|3,0,0]=4 3643 B15R2.2196 c1ccc(nc1)CNCc2ncco2 2230a_100016994969_100000721315 [0,0,0,0,0,1|3,0,0]=4 3644 B15R2.2196 c1ccc(nc1)CNCc2ncco2 270004a_100000210449_100000064290 [0,0,0,0,0,1|3,0,0]=4 3645 B15R2.2196 c1ccc(nc1)CNCc2nccs2 207a_100000740555_100000209966 [0,0,0,0,0,1|3,0,0]=4 3646 B15R2.2196 c1ccc(nc1)CNCc2nccs2 2230a_100000740555_100000721315 [0,0,0,0,0,1|3,0,0]=4 3647 B15R2.2196 c1ccc(nc1)CNCc2nccs2 270004a_100000210449_100000750902 [0,0,0,0,0,1|3,0,0]=4 3648 B15R2.2196 c1ccc(nc1)CNCc2nccs2 270004a_100000740555_100000209966 [0,0,0,0,0,1|3,0,0]=4 3649 B15R2.2196 c1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000721315 [0,0,0,0,0,1|2,0,0]=3 3650 B15R2.2196 c1ccc(nc1)CSCc2c[nH]cn2 62a_100000721315_100000707719 [0,0,0,0,0,1|2,0,0]=3 3651 B15R2.2196 c1ccc(nc1)CSCc2cscn2 62a_100000205941_100000721315 [0,0,0,0,0,1|3,0,0]=4 3652 B15R2.2196 c1ccc(nc1)CSCc2cscn2 62a_100000721315_100000205941 [0,0,0,0,0,1|3,0,0]=4 3653 B15R2.2196 c1ccc(nc1)SCCc2c[nH]cn2 62a_100011216584_100020628418 [0,0,0,0,0,1|2,0,0]=3 3654 B15R2.2196 c1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100011216584 [0,0,0,0,0,1|2,0,0]=3 3655 B15R2.2196 c1cnc(cn1)CNCc2c[nH]nn2 270004a_100020620823_100000749867 [0,0,0,0,0,1|3,0,0]=4 3656 B15R2.2196 c1cnc(cn1)CNCc2cocn2 270004a_100015188801_100000749867 [0,0,0,0,0,1|3,0,0]=4 3657 B15R2.2196 c1cnc(cn1)CNCc2cscn2 2230a_100015185402_100016995436 [0,0,0,0,0,1|3,0,0]=4 3658 B15R2.2196 c1cnc(cn1)CSCc2c[nH]cn2 62a_100000707719_100016995436 [0,0,0,0,0,1|3,0,0]=4 3659 B15R2.2196 c1cnc(cn1)CSCc2c[nH]cn2 62a_100016995436_100000707719 [0,0,0,0,0,1|3,0,0]=4 3660 B15R2.2196 c1cnc(cn1)NCCc2c[nH]cn2 27a_100000755092_100000211759 [0,0,0,0,0,1|2,0,0]=3 3661 B15R2.2196 c1cnc(cn1)SCCc2c[nH]cn2 62a_100000211759_100020628418 [0,0,0,0,0,1|3,0,0]=4 3662 B15R2.2196 c1cnc(cn1)SCCc2c[nH]cn2 62a_100020628418_100000211759 [0,0,0,0,0,1|3,0,0]=4 3663 B15R2.2196 c1cnc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100011532527 [0,0,0,0,0,1|3,0,0]=4 3664 B15R2.2196 c1cnc(nc1)CNCc2cocn2 270004a_100015188801_100011532527 [0,0,0,0,0,1|3,0,0]=4 3665 B15R2.2196 c1cnc(nc1)CNCc2cscn2 2230a_100015185402_100000703007 [0,0,0,0,0,1|3,0,0]=4 3666 B15R2.2196 c1cnc(nc1)CSCc2c[nH]cn2 62a_100000703007_100000707719 [0,0,0,0,0,1|3,0,0]=4 3667 B15R2.2196 c1cnc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000703007 [0,0,0,0,0,1|3,0,0]=4 3668 B15R2.2196 c1cnc(nc1)NCCc2c[nH]cn2 27a_100000755092_100000211032 [0,0,0,0,0,1|2,0,0]=3 3669 B15R2.2196 c1cnc(nc1)SCCc2c[nH]cn2 62a_100000211032_100020628418 [0,0,0,0,0,1|3,0,0]=4 3670 B15R2.2196 c1cnc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000211032 [0,0,0,0,0,1|3,0,0]=4 3671 B15R2.2196 c1cncc(c1)CCSc2c[nH]cn2 62a_100000756875_200011713674 [0,0,0,0,0,1|2,0,0]=3 3672 B15R2.2196 c1cncc(c1)CCSc2c[nH]cn2 62a_200011713674_100000756875 [0,0,0,0,0,1|2,0,0]=3 3673 B15R2.2196 c1cncc(c1)CCSc2c[nH]nn2 62a_100009819707_200011713674 [0,0,0,0,0,1|3,0,0]=4 3674 B15R2.2196 c1cncc(c1)CCSc2c[nH]nn2 62a_200011713674_100009819707 [0,0,0,0,0,1|3,0,0]=4 3675 B15R2.2196 c1cncc(c1)CCSc2cscn2 62a_100000751502_200011713674 [0,0,0,0,0,1|3,0,0]=4 3676 B15R2.2196 c1cncc(c1)CCSc2cscn2 62a_200011713674_100000751502 [0,0,0,0,0,1|3,0,0]=4 3677 B15R2.2196 c1cncc(c1)CCSc2nc[nH]n2 62a_100000761765_200011713674 [0,0,0,0,0,1|3,0,0]=4 3678 B15R2.2196 c1cncc(c1)CCSc2nc[nH]n2 62a_200011713674_100000761765 [0,0,0,0,0,1|3,0,0]=4 3679 B15R2.2196 c1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100000209961 [0,0,0,0,0,1|1,0,0]=2 3680 B15R2.2196 c1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100000209961 [0,0,0,0,0,1|2,0,0]=3 3681 B15R2.2196 c1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000209961 [0,0,0,0,0,1|2,0,0]=3 3682 B15R2.2196 c1cncc(c1)CNCc2cc[nH]n2 207a_100000210453_100000738523 [0,0,0,0,0,1|3,0,0]=4 3683 B15R2.2196 c1cncc(c1)CNCc2cc[nH]n2 207a_100000739516_100000209961 [0,0,0,0,0,1|3,0,0]=4 3684 B15R2.2196 c1cncc(c1)CNCc2cc[nH]n2 270004a_100000210453_100000738523 [0,0,0,0,0,1|3,0,0]=4 3685 B15R2.2196 c1cncc(c1)CNCc2ccco2 207a_100000185738_100000209961 [0,0,0,0,0,1|3,0,0]=4 3686 B15R2.2196 c1cncc(c1)CNCc2ccco2 207a_100000210453_100000186105 [0,0,0,0,0,1|3,0,0]=4 3687 B15R2.2196 c1cncc(c1)CNCc2ccco2 2230a_100000185738_100000741622 [0,0,0,0,0,1|3,0,0]=4 3688 B15R2.2196 c1cncc(c1)CNCc2ccco2 270004a_100000185738_100000209961 [0,0,0,0,0,1|3,0,0]=4 3689 B15R2.2196 c1cncc(c1)CNCc2ccco2 270004a_100000210453_100000186105 [0,0,0,0,0,1|3,0,0]=4 3690 B15R2.2196 c1cncc(c1)CNCc2ccco2 34a_100000185738_100000733263 [0,0,0,0,0,1|3,0,0]=4 3691 B15R2.2196 c1cncc(c1)CNCc2cccs2 207a_100000210453_100000209959 [0,0,0,0,0,1|3,0,0]=4 3692 B15R2.2196 c1cncc(c1)CNCc2cccs2 207a_100000211653_100000209961 [0,0,0,0,0,1|3,0,0]=4 3693 B15R2.2196 c1cncc(c1)CNCc2cccs2 2230a_100000211653_100000741622 [0,0,0,0,0,1|3,0,0]=4 3694 B15R2.2196 c1cncc(c1)CNCc2cccs2 270004a_100000210453_100000209959 [0,0,0,0,0,1|3,0,0]=4 3695 B15R2.2196 c1cncc(c1)CNCc2cccs2 270004a_100000211653_100000209961 [0,0,0,0,0,1|3,0,0]=4 3696 B15R2.2196 c1cncc(c1)CNCc2ccoc2 207a_100000210453_100011215517 [0,0,0,0,0,1|3,0,0]=4 3697 B15R2.2196 c1cncc(c1)CNCc2ccoc2 207a_100015206860_100000209961 [0,0,0,0,0,1|3,0,0]=4 3698 B15R2.2196 c1cncc(c1)CNCc2ccoc2 2230a_100015206860_100000741622 [0,0,0,0,0,1|3,0,0]=4 3699 B15R2.2196 c1cncc(c1)CNCc2ccoc2 270004a_100000210453_100011215517 [0,0,0,0,0,1|3,0,0]=4 3700 B15R2.2196 c1cncc(c1)CNCc2ccoc2 270004a_100015206860_100000209961 [0,0,0,0,0,1|3,0,0]=4 3701 B15R2.2196 c1cncc(c1)CNCc2ccoc2 34a_100015206860_100000733263 [0,0,0,0,0,1|3,0,0]=4 3702 B15R2.2196 c1cncc(c1)CNCc2ccon2 207a_100000688301_100000209961 [0,0,0,0,0,1|3,0,0]=4 3703 B15R2.2196 c1cncc(c1)CNCc2ccon2 270004a_100000688301_100000209961 [0,0,0,0,0,1|3,0,0]=4 3704 B15R2.2196 c1cncc(c1)CNCc2ccsc2 207a_100000186416_100000209961 [0,0,0,0,0,1|3,0,0]=4 3705 B15R2.2196 c1cncc(c1)CNCc2ccsc2 207a_100000210453_100000188534 [0,0,0,0,0,1|3,0,0]=4 3706 B15R2.2196 c1cncc(c1)CNCc2ccsc2 2230a_100000186416_100000741622 [0,0,0,0,0,1|3,0,0]=4 3707 B15R2.2196 c1cncc(c1)CNCc2ccsc2 270004a_100000186416_100000209961 [0,0,0,0,0,1|3,0,0]=4 3708 B15R2.2196 c1cncc(c1)CNCc2ccsc2 270004a_100000210453_100000188534 [0,0,0,0,0,1|3,0,0]=4 3709 B15R2.2196 c1cncc(c1)CNCc2ccsc2 34a_100000186416_100000733263 [0,0,0,0,0,1|3,0,0]=4 3710 B15R2.2196 c1cncc(c1)CNCc2cn[nH]c2 207a_100000210453_100016992096 [0,0,0,0,0,1|3,0,0]=4 3711 B15R2.2196 c1cncc(c1)CNCc2cn[nH]c2 207a_100000737208_100000209961 [0,0,0,0,0,1|3,0,0]=4 3712 B15R2.2196 c1cncc(c1)CNCc2cn[nH]c2 270004a_100000210453_100016992096 [0,0,0,0,0,1|3,0,0]=4 3713 B15R2.2196 c1cncc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000209961 [0,0,0,0,0,1|3,0,0]=4 3714 B15R2.2196 c1cncc(c1)CNCc2cnc[nH]2 207a_100000210453_100000742939 [0,0,0,0,0,1|1,0,2]=4 3715 B15R2.2196 c1cncc(c1)CNCc2cnco2 207a_100020634212_100000209961 [0,0,0,0,0,1|2,0,1]=4 3716 B15R2.2196 c1cncc(c1)CNCc2cnco2 270004a_100000210453_100000064291 [0,0,0,0,0,1|2,0,1]=4 3717 B15R2.2196 c1cncc(c1)CNCc2cnco2 270004a_100020634212_100000209961 [0,0,0,0,0,1|2,0,1]=4 3718 B15R2.2196 c1cncc(c1)CNCc2cncs2 207a_100000210453_100000749870 [0,0,0,0,0,1|2,0,1]=4 3719 B15R2.2196 c1cncc(c1)CNCc2cncs2 207a_100016987365_100000209961 [0,0,0,0,0,1|2,0,1]=4 3720 B15R2.2196 c1cncc(c1)CNCc2cncs2 2230a_100016987365_100000741622 [0,0,0,0,0,1|2,0,1]=4 3721 B15R2.2196 c1cncc(c1)CNCc2cncs2 270004a_100000210453_100000749870 [0,0,0,0,0,1|2,0,1]=4 3722 B15R2.2196 c1cncc(c1)CNCc2cncs2 270004a_100016987365_100000209961 [0,0,0,0,0,1|2,0,1]=4 3723 B15R2.2196 c1cncc(c1)CNCc2cocn2 207a_100015188801_100000209961 [0,0,0,0,0,1|2,0,0]=3 3724 B15R2.2196 c1cncc(c1)CNCc2cocn2 270004a_100000210453_100000050382 [0,0,0,0,0,1|2,0,0]=3 3725 B15R2.2196 c1cncc(c1)CNCc2cocn2 270004a_100015188801_100000209961 [0,0,0,0,0,1|2,0,0]=3 3726 B15R2.2196 c1cncc(c1)CNCc2cscn2 207a_100000210453_100000743575 [0,0,0,0,0,1|2,0,0]=3 3727 B15R2.2196 c1cncc(c1)CNCc2cscn2 207a_100015185402_100000209961 [0,0,0,0,0,1|2,0,0]=3 3728 B15R2.2196 c1cncc(c1)CNCc2cscn2 2230a_100015185402_100000741622 [0,0,0,0,0,1|2,0,0]=3 3729 B15R2.2196 c1cncc(c1)CNCc2cscn2 270004a_100000210453_100000743575 [0,0,0,0,0,1|2,0,0]=3 3730 B15R2.2196 c1cncc(c1)CNCc2csnn2 270004a_100000210453_100000738508 [0,0,0,0,0,1|3,0,0]=4 3731 B15R2.2196 c1cncc(c1)CNCc2ncc[nH]2 207a_100000210453_100000743867 [0,0,0,0,0,1|3,0,0]=4 3732 B15R2.2196 c1cncc(c1)CNCc2ncc[nH]2 207a_100000754540_100000209961 [0,0,0,0,0,1|3,0,0]=4 3733 B15R2.2196 c1cncc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000209961 [0,0,0,0,0,1|3,0,0]=4 3734 B15R2.2196 c1cncc(c1)CNCc2ncco2 207a_100016994969_100000209961 [0,0,0,0,0,1|3,0,0]=4 3735 B15R2.2196 c1cncc(c1)CNCc2ncco2 2230a_100016994969_100000741622 [0,0,0,0,0,1|3,0,0]=4 3736 B15R2.2196 c1cncc(c1)CNCc2ncco2 270004a_100000210453_100000064290 [0,0,0,0,0,1|3,0,0]=4 3737 B15R2.2196 c1cncc(c1)CNCc2nccs2 207a_100000210453_100000750902 [0,0,0,0,0,1|3,0,0]=4 3738 B15R2.2196 c1cncc(c1)CNCc2nccs2 207a_100000740555_100000209961 [0,0,0,0,0,1|3,0,0]=4 3739 B15R2.2196 c1cncc(c1)CNCc2nccs2 2230a_100000740555_100000741622 [0,0,0,0,0,1|3,0,0]=4 3740 B15R2.2196 c1cncc(c1)CNCc2nccs2 270004a_100000210453_100000750902 [0,0,0,0,0,1|3,0,0]=4 3741 B15R2.2196 c1cncc(c1)CNCc2nccs2 270004a_100000740555_100000209961 [0,0,0,0,0,1|3,0,0]=4 3742 B15R2.2196 c1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100000741622 [0,0,0,0,0,1|2,0,0]=3 3743 B15R2.2196 c1cncc(c1)CSCc2c[nH]cn2 62a_100000741622_100000707719 [0,0,0,0,0,1|2,0,0]=3 3744 B15R2.2196 c1cncc(c1)CSCc2cscn2 62a_100000205941_100000741622 [0,0,0,0,0,1|3,0,0]=4 3745 B15R2.2196 c1cncc(c1)CSCc2cscn2 62a_100000741622_100000205941 [0,0,0,0,0,1|3,0,0]=4 3746 B15R2.2196 c1cncc(c1)OCCc2c[nH]cn2 7a_100000210849_100020628418 [0,0,0,0,0,1|2,0,0]=3 3747 B15R2.2196 c1cncc(c1)SCCc2c[nH]cn2 62a_100000210063_100020628418 [0,0,0,0,0,1|2,0,0]=3 3748 B15R2.2196 c1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000210063 [0,0,0,0,0,1|2,0,0]=3 3749 B15R2.2196 c1cnnc(c1)CNCc2c[nH]cn2 2230a_100159270163_100000707719 [0,0,0,0,0,1|2,0,0]=3 3750 B15R2.2196 c1cnnc(c1)CNCc2cscn2 2230a_100015185402_100016990269 [0,0,0,0,0,1|3,0,0]=4 3751 B15R2.2196 c1cnnc(c1)CNCc2cscn2 2230a_100159270163_100000205941 [0,0,0,0,0,1|3,0,0]=4 3752 B15R2.2196 c1cnnc(c1)CSCc2c[nH]cn2 62a_100000707719_100016990269 [0,0,0,0,0,1|3,0,0]=4 3753 B15R2.2196 c1cnnc(c1)CSCc2c[nH]cn2 62a_100016990269_100000707719 [0,0,0,0,0,1|3,0,0]=4 3754 B15R2.2196 c1cnnc(c1)NCCc2c[nH]cn2 27a_100000755092_100016991348 [0,0,0,0,0,1|2,0,0]=3 3755 B15R2.2196 c1cnnc(c1)SCCc2c[nH]cn2 62a_100016991348_100020628418 [0,0,0,0,0,1|3,0,0]=4 3756 B15R2.2196 c1cnnc(c1)SCCc2c[nH]cn2 62a_100020628418_100016991348 [0,0,0,0,0,1|3,0,0]=4 3757 B15R2.2196 c1coc(c1)CNCc2ccncc2 207a_100000185738_100000186114 [0,0,0,0,0,1|3,0,0]=4 3758 B15R2.2196 c1coc(c1)CNCc2ccncc2 2230a_100000185738_100015193705 [0,0,0,0,0,1|3,0,0]=4 3759 B15R2.2196 c1csc(c1)CNCc2ccncc2 207a_100000211653_100000186114 [0,0,0,0,0,1|3,0,0]=4 3760 B15R2.2196 c1csc(c1)CNCc2ccncc2 2230a_100000211653_100015193705 [0,0,0,0,0,1|3,0,0]=4 3761 B15R2.2196 c1ncc(cn1)CNCc2c[nH]cn2 2230a_100011243677_100000707719 [0,0,0,0,0,1|2,0,0]=3 3762 B15R2.2196 c1ncc(cn1)CNCc2c[nH]nn2 270004a_100020620823_100000749868 [0,0,0,0,0,1|3,0,0]=4 3763 B15R2.2196 c1ncc(cn1)CNCc2cocn2 270004a_100011243677_100000050382 [0,0,0,0,0,1|3,0,0]=4 3764 B15R2.2196 c1ncc(cn1)CNCc2cocn2 270004a_100015188801_100000749868 [0,0,0,0,0,1|3,0,0]=4 3765 B15R2.2196 c1ncc(cn1)CNCc2cscn2 207a_100011243677_100000743575 [0,0,0,0,0,1|3,0,0]=4 3766 B15R2.2196 c1ncc(cn1)CNCc2cscn2 2230a_100011243677_100000205941 [0,0,0,0,0,1|3,0,0]=4 3767 B15R2.2196 c1ncc(cn1)CNCc2cscn2 2230a_100015185402_100015196519 [0,0,0,0,0,1|3,0,0]=4 3768 B15R2.2196 c1ncc(cn1)CNCc2cscn2 270004a_100011243677_100000743575 [0,0,0,0,0,1|3,0,0]=4 3769 B15R2.2196 c1ncc(cn1)CSCc2c[nH]cn2 62a_100000707719_100015196519 [0,0,0,0,0,1|3,0,0]=4 3770 B15R2.2196 c1ncc(cn1)CSCc2c[nH]cn2 62a_100015196519_100000707719 [0,0,0,0,0,1|3,0,0]=4 3771 B15R2.2196 c1ncc(cn1)OCCc2c[nH]cn2 7a_100000754086_100020628418 [0,0,0,0,0,1|3,0,0]=4 3772 B15R2.2196 c1ncc(cn1)SCCc2c[nH]cn2 62a_100011206942_100020628418 [0,0,0,0,0,1|3,0,0]=4 3773 B15R2.2196 c1ncc(cn1)SCCc2c[nH]cn2 62a_100020628418_100011206942 [0,0,0,0,0,1|3,0,0]=4 3774 B12R1.8 C=CCCCNc1ccccc1 34a_100000106764_100000757094 [1,0,1,0,0,0|1,0,1]=4 3775 B12R1.8 C=COCCNc1ccccc1 34a_100000106764_100000039644 [1,0,1,0,0,0|1,0,1]=4 3776 B12R1.8 CC/C=C\CNc1ccccc1 34a_100000106764_100103147603 [1,0,1,0,0,0|1,0,1]=4 3777 B12R1.27 C=C(C#N)CNc1ccccc1 34a_100000106764_100000694840 [1,0,1,0,0,0|0,0,2]=4 3778 B12R1.27 C=CC(=NNc1ccccc1)C 4a_100015195140_200015361842 [1,0,1,0,0,0|2,0,0]=4 3779 B12R1.27 C=CC(=O)CCc1ccccc1 1458a_100000185746_100000765856 [1,0,1,0,0,0|2,0,0]=4 3780 B12R1.27 C=CC(=O)NNc1ccccc1 22a_100015195140_100000185746 [1,0,1,0,0,0|2,0,0]=4 3781 B12R1.27 C=CC(O)CNc1ccccc1 34a_100000106764_100000730141 [1,0,1,0,0,0|1,0,1]=4 3782 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [1,0,1,0,0,0|1,0,1]=4 3783 B12R1.51 C=CCC(=O)NCc1c[nH]cn1 11a_100000758547_100000210193 [1,0,1,0,0,0|1,0,1]=4 3784 B12R1.51 C=CCC(=O)NCc1c[nH]cn1 240690a_100000758547_100000210193 [1,0,1,0,0,0|1,0,1]=4 3785 B12R1.51 C=CCC(=O)NCc1c[nH]cn1 527a_100000758547_100000210193 [1,0,1,0,0,0|1,0,1]=4 3786 B12R1.51 CC=CC(=O)NCc1c[nH]cn1 11a_100000758547_100000210699 [1,0,1,0,0,0|1,0,1]=4 3787 B12R1.51 CC=CC(=O)NCc1c[nH]cn1 240690a_100000758547_100000210699 [1,0,1,0,0,0|1,0,1]=4 3788 B12R1.51 O=C(C=CBr)NCc1c[nH]cn1 240690a_100000758547_100016273825 [1,0,1,0,0,0|2,0,0]=4 3789 B12R1.51 O=C(C=CCl)NCc1c[nH]cn1 11a_100000758547_200016279998 [1,0,1,0,0,0|2,0,0]=4 3790 B12R1.51 O=C(C=CCl)NCc1c[nH]cn1 240690a_100000758547_200016279998 [1,0,1,0,0,0|2,0,0]=4 3791 B12R1.297 C=CC(C=C)OCc1c[nH]cn1 34a_100000033096_100000707719 [1,0,1,0,0,0|1,0,1]=4 3792 B14R1.86 C/C=C/C=CC(=O)CCc1c[nH]cn1 1458a_100000185730_100020628418 [0,1,1,0,0,0|1,0,1]=4 3793 B14R1.86 C/C=C/C=CC(=O)NCc1c[nH]cn1 11a_100000758547_100000185730 [0,1,1,0,0,0|0,0,1]=3 3794 B14R1.86 C/C=C/C=CC(=O)NCc1c[nH]cn1 240690a_100000758547_100000185730 [0,1,1,0,0,0|0,0,1]=3 3795 B14R1.86 C/C=C/C=CC(=O)NCc1c[nH]nn1 11a_100020620823_100000185730 [0,1,1,0,0,0|1,0,1]=4 3796 B14R1.86 C/C=C/C=CC(=O)NCc1c[nH]nn1 240690a_100020620823_100000185730 [0,1,1,0,0,0|1,0,1]=4 3797 B14R1.86 C/C=C/C=CC(=O)NCc1cocn1 11a_100015188801_100000185730 [0,1,1,0,0,0|1,0,1]=4 3798 B14R1.86 C/C=C/C=CC(=O)NCc1cocn1 240690a_100015188801_100000185730 [0,1,1,0,0,0|1,0,1]=4 3799 B14R1.86 C/C=C/C=CC(=O)NCc1cscn1 11a_100015185402_100000185730 [0,1,1,0,0,0|1,0,1]=4 3800 B14R1.86 C/C=C/C=CC(=O)NCc1cscn1 1626a_100015185402_100000185730 [0,1,1,0,0,0|1,0,1]=4 3801 B14R1.86 C/C=C/C=CC(=O)NCc1cscn1 240690a_100015185402_100000185730 [0,1,1,0,0,0|1,0,1]=4 3802 B14R1.155 C=CC=CC(=O)NCc1cn(cn1)C 1626a_100011834058_100016291481 [0,1,1,0,0,0|1,0,0]=3 3803 B14R1.155 C=CC=CC(=O)NCc1csc(n1)C 1626a_100000707933_100016291481 [0,1,1,0,0,0|2,0,0]=4 3804 B14R1.155 C=CC=CC(=O)NCc1ncn(n1)C 1626a_100000695864_100016291481 [0,1,1,0,0,0|2,0,0]=4 3805 B14R2.19 Cc1nc(c[nH]1)Sc2ccccc2 62a_100000719477_100009814057 [0,1,0,0,1,0|1,0,0]=3 3806 B14R2.19 Cc1nc(c[nH]1)Sc2ccccc2 62a_100009814057_100000041952 [0,1,0,0,1,0|1,0,0]=3 3807 B14R2.19 Cc1nc(c[nH]1)Sc2ccccn2 62a_100009814057_100011216584 [0,1,0,0,1,0|2,0,0]=4 3808 B14R2.19 Cc1nc(c[nH]1)Sc2ccccn2 62a_100011216584_100009814057 [0,1,0,0,1,0|2,0,0]=4 3809 B14R2.19 Cc1nc(c[nH]1)Sc2cccnc2 62a_100000210063_100009814057 [0,1,0,0,1,0|2,0,0]=4 3810 B14R2.19 Cc1nc(c[nH]1)Sc2cccnc2 62a_100009814057_100000210063 [0,1,0,0,1,0|2,0,0]=4 3811 B14R2.19 Cc1nc(c[nH]1)Sc2ccncc2 62a_100000728582_100009814057 [0,1,0,0,1,0|2,0,0]=4 3812 B14R2.19 Cc1nc(c[nH]1)Sc2ccncc2 62a_100009814057_100000728582 [0,1,0,0,1,0|2,0,0]=4 3813 B14R2.19 Cc1nc(cs1)Sc2ccccc2 62a_100000719477_100011934587 [0,1,0,0,1,0|2,0,0]=4 3814 B14R2.19 Cc1nc(cs1)Sc2ccccc2 62a_100011934587_100000041952 [0,1,0,0,1,0|2,0,0]=4 3815 B14R2.19 Cc1nc(n[nH]1)Sc2ccccc2 62a_100000719477_100000732540 [0,1,0,0,1,0|2,0,0]=4 3816 B14R2.19 Cc1nc(n[nH]1)Sc2ccccc2 62a_100000732540_100000041952 [0,1,0,0,1,0|2,0,0]=4 3817 B14R2.19 Cc1nc(no1)Nc2ccccc2 27a_100000106764_100012003639 [0,1,0,0,1,0|2,0,0]=4 3818 B14R2.19 Cc1nsc(n1)Nc2ccccc2 27a_100000106764_100000709739 [0,1,0,0,1,0|1,0,1]=4 3819 B14R2.19 Cn1cc(nn1)Cc2ccccc2 274090a_200000210301_100000039852 [0,1,0,0,1,0|1,0,0]=3 3820 B14R2.19 Cn1cc(nn1)Sc2ccccc2 62a_100000719477_100000760339 [0,1,0,0,1,0|2,0,0]=4 3821 B14R2.19 Cn1cc(nn1)Sc2ccccc2 62a_100000760339_100000041952 [0,1,0,0,1,0|2,0,0]=4 3822 B14R2.19 Cn1cnc(c1)Sc2ccccc2 62a_100000040308_100000041952 [0,1,0,0,1,0|1,0,0]=3 3823 B14R2.19 Cn1cnc(c1)Sc2ccccc2 62a_100000719477_100000040308 [0,1,0,0,1,0|1,0,0]=3 3824 B14R2.19 Cn1cnc(c1)Sc2ccccn2 62a_100000040308_100011216584 [0,1,0,0,1,0|2,0,0]=4 3825 B14R2.19 Cn1cnc(c1)Sc2ccccn2 62a_100011216584_100000040308 [0,1,0,0,1,0|2,0,0]=4 3826 B14R2.19 Cn1cnc(c1)Sc2cccnc2 62a_100000040308_100000210063 [0,1,0,0,1,0|2,0,0]=4 3827 B14R2.19 Cn1cnc(c1)Sc2cccnc2 62a_100000210063_100000040308 [0,1,0,0,1,0|2,0,0]=4 3828 B14R2.19 Cn1cnc(c1)Sc2ccncc2 62a_100000040308_100000728582 [0,1,0,0,1,0|2,0,0]=4 3829 B14R2.19 Cn1cnc(c1)Sc2ccncc2 62a_100000728582_100000040308 [0,1,0,0,1,0|2,0,0]=4 3830 B14R2.19 Cn1cnc(n1)Sc2ccccc2 62a_100000719477_100009819955 [0,1,0,0,1,0|2,0,0]=4 3831 B14R2.19 Cn1cnc(n1)Sc2ccccc2 62a_100009819955_100000041952 [0,1,0,0,1,0|2,0,0]=4 3832 B14R2.19 Nc1nc(cs1)Sc2ccccc2 62a_100000719477_100011998049 [0,1,0,0,1,0|2,0,0]=4 3833 B14R2.19 Nc1nc(cs1)Sc2ccccc2 62a_100011998049_100000041952 [0,1,0,0,1,0|2,0,0]=4 3834 B14R2.19 Nc1nc(n[nH]1)Sc2ccccc2 62a_100000719477_100015184587 [0,1,0,0,1,0|2,0,0]=4 3835 B14R2.19 Nc1nc(n[nH]1)Sc2ccccc2 62a_100015184587_100000041952 [0,1,0,0,1,0|2,0,0]=4 3836 B14R2.19 Oc1cnc(s1)Nc2ccccc2 271570a_203496583355_100012361658 [0,1,0,0,1,0|2,0,0]=4 3837 B14R2.19 Oc1cnn(c1)Cc2ccccc2 271570a_203496583355_100011356856 [0,1,0,0,1,0|2,0,0]=4 3838 B14R2.19 [13CH3]n1cc(nn1)Cc2ccccc2 274090a_200025704644_100000039852 [0,1,0,0,1,0|1,0,0]=3 3839 B14R2.30 Cc1[nH]cnc1Sc2ccccc2 62a_100000719477_100010186451 [0,1,0,0,1,0|1,0,0]=3 3840 B14R2.30 Cc1[nH]cnc1Sc2ccccc2 62a_100010186451_100000041952 [0,1,0,0,1,0|1,0,0]=3 3841 B14R2.30 Cc1[nH]cnc1Sc2ccccn2 62a_100010186451_100011216584 [0,1,0,0,1,0|2,0,0]=4 3842 B14R2.30 Cc1[nH]cnc1Sc2ccccn2 62a_100011216584_100010186451 [0,1,0,0,1,0|2,0,0]=4 3843 B14R2.30 Cc1[nH]cnc1Sc2cccnc2 62a_100000210063_100010186451 [0,1,0,0,1,0|2,0,0]=4 3844 B14R2.30 Cc1[nH]cnc1Sc2cccnc2 62a_100010186451_100000210063 [0,1,0,0,1,0|2,0,0]=4 3845 B14R2.30 Cc1[nH]cnc1Sc2ccncc2 62a_100000728582_100010186451 [0,1,0,0,1,0|2,0,0]=4 3846 B14R2.30 Cc1[nH]cnc1Sc2ccncc2 62a_100010186451_100000728582 [0,1,0,0,1,0|2,0,0]=4 3847 B14R2.30 Cc1scnc1Sc2ccccc2 62a_100000719477_100000732656 [0,1,0,0,1,0|2,0,0]=4 3848 B14R2.30 Cc1scnc1Sc2ccccc2 62a_100000732656_100000041952 [0,1,0,0,1,0|2,0,0]=4 3849 B14R2.30 Cn1ncnc1Nc2ccccc2 27a_100000106764_100000732653 [0,1,0,0,1,0|1,0,1]=4 3850 B14R2.50 Brc1ccccc1Sc2c[nH]cn2 62a_100000695589_100000756875 [0,1,0,0,1,0|1,0,0]=3 3851 B14R2.50 Brc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000695589 [0,1,0,0,1,0|1,0,0]=3 3852 B14R2.50 Brc1ccccc1Sc2c[nH]nn2 62a_100000695589_100009819707 [0,1,0,0,1,0|2,0,0]=4 3853 B14R2.50 Brc1ccccc1Sc2c[nH]nn2 62a_100009819707_100000695589 [0,1,0,0,1,0|2,0,0]=4 3854 B14R2.50 Brc1ccccc1Sc2cscn2 62a_100000695589_100000751502 [0,1,0,0,1,0|2,0,0]=4 3855 B14R2.50 Brc1ccccc1Sc2cscn2 62a_100000751502_100000695589 [0,1,0,0,1,0|2,0,0]=4 3856 B14R2.50 Brc1ccccc1Sc2nc[nH]n2 62a_100000695589_100000761765 [0,1,0,0,1,0|2,0,0]=4 3857 B14R2.50 Brc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000695589 [0,1,0,0,1,0|2,0,0]=4 3858 B14R2.50 Brc1cccnc1Sc2c[nH]cn2 62a_100000696092_100000756875 [0,1,0,0,1,0|2,0,0]=4 3859 B14R2.50 Brc1cccnc1Sc2c[nH]cn2 62a_100000756875_100000696092 [0,1,0,0,1,0|2,0,0]=4 3860 B14R2.50 Brc1ccncc1Sc2c[nH]cn2 62a_100000756875_100010138639 [0,1,0,0,1,0|2,0,0]=4 3861 B14R2.50 Brc1ccncc1Sc2c[nH]cn2 62a_100010138639_100000756875 [0,1,0,0,1,0|2,0,0]=4 3862 B14R2.50 Brc1cnccc1Sc2c[nH]cn2 62a_100000726257_100000756875 [0,1,0,0,1,0|2,0,0]=4 3863 B14R2.50 Brc1cnccc1Sc2c[nH]cn2 62a_100000756875_100000726257 [0,1,0,0,1,0|2,0,0]=4 3864 B14R2.50 Brc1ncccc1Sc2c[nH]cn2 62a_100000756875_100010202626 [0,1,0,0,1,0|2,0,0]=4 3865 B14R2.50 Brc1ncccc1Sc2c[nH]cn2 62a_100010202626_100000756875 [0,1,0,0,1,0|2,0,0]=4 3866 B14R2.50 C[n+]1ccccc1Sc2c[nH]cn2 62a_100000756875_100000212160 [0,1,0,0,1,0|2,0,0]=4 3867 B14R2.50 Cc1ccccc1Nc2ncns2 27a_100015192222_100000693119 [0,1,0,0,1,0|1,0,1]=4 3868 B14R2.50 Cc1ccccc1Sc2c[nH]cn2 62a_100000210755_100000756875 [0,1,0,0,1,0|1,0,0]=3 3869 B14R2.50 Cc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000210755 [0,1,0,0,1,0|1,0,0]=3 3870 B14R2.50 Cc1ccccc1Sc2c[nH]nn2 62a_100000210755_100009819707 [0,1,0,0,1,0|2,0,0]=4 3871 B14R2.50 Cc1ccccc1Sc2c[nH]nn2 62a_100009819707_100000210755 [0,1,0,0,1,0|2,0,0]=4 3872 B14R2.50 Cc1ccccc1Sc2cscn2 62a_100000210755_100000751502 [0,1,0,0,1,0|2,0,0]=4 3873 B14R2.50 Cc1ccccc1Sc2cscn2 62a_100000751502_100000210755 [0,1,0,0,1,0|2,0,0]=4 3874 B14R2.50 Cc1ccccc1Sc2nc[nH]n2 62a_100000210755_100000761765 [0,1,0,0,1,0|2,0,0]=4 3875 B14R2.50 Cc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000210755 [0,1,0,0,1,0|2,0,0]=4 3876 B14R2.50 Cc1cccnc1Sc2c[nH]cn2 62a_100000751373_100000756875 [0,1,0,0,1,0|2,0,0]=4 3877 B14R2.50 Cc1cccnc1Sc2c[nH]cn2 62a_100000756875_100000751373 [0,1,0,0,1,0|2,0,0]=4 3878 B14R2.50 Cc1ccncc1Sc2c[nH]cn2 62a_100000756875_100000761580 [0,1,0,0,1,0|2,0,0]=4 3879 B14R2.50 Cc1ccncc1Sc2c[nH]cn2 62a_100000761580_100000756875 [0,1,0,0,1,0|2,0,0]=4 3880 B14R2.50 Cc1cnccc1Sc2c[nH]cn2 62a_100000756875_100000765111 [0,1,0,0,1,0|2,0,0]=4 3881 B14R2.50 Cc1cnccc1Sc2c[nH]cn2 62a_100000765111_100000756875 [0,1,0,0,1,0|2,0,0]=4 3882 B14R2.50 Cc1ncccc1Sc2c[nH]cn2 62a_100000751574_100000756875 [0,1,0,0,1,0|2,0,0]=4 3883 B14R2.50 Cc1ncccc1Sc2c[nH]cn2 62a_100000756875_100000751574 [0,1,0,0,1,0|2,0,0]=4 3884 B14R2.50 Clc1ccccc1Nc2ncns2 27a_100000185783_100000693119 [0,1,0,0,1,0|1,0,1]=4 3885 B14R2.50 Clc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000764095 [0,1,0,0,1,0|1,0,0]=3 3886 B14R2.50 Clc1ccccc1Sc2c[nH]cn2 62a_100000764095_100000756875 [0,1,0,0,1,0|1,0,0]=3 3887 B14R2.50 Clc1ccccc1Sc2c[nH]nn2 62a_100000764095_100009819707 [0,1,0,0,1,0|2,0,0]=4 3888 B14R2.50 Clc1ccccc1Sc2c[nH]nn2 62a_100009819707_100000764095 [0,1,0,0,1,0|2,0,0]=4 3889 B14R2.50 Clc1ccccc1Sc2cscn2 62a_100000751502_100000764095 [0,1,0,0,1,0|2,0,0]=4 3890 B14R2.50 Clc1ccccc1Sc2cscn2 62a_100000764095_100000751502 [0,1,0,0,1,0|2,0,0]=4 3891 B14R2.50 Clc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000764095 [0,1,0,0,1,0|2,0,0]=4 3892 B14R2.50 Clc1ccccc1Sc2nc[nH]n2 62a_100000764095_100000761765 [0,1,0,0,1,0|2,0,0]=4 3893 B14R2.50 Clc1cccnc1Sc2c[nH]cn2 62a_100000756875_100011356963 [0,1,0,0,1,0|2,0,0]=4 3894 B14R2.50 Clc1cccnc1Sc2c[nH]cn2 62a_100011356963_100000756875 [0,1,0,0,1,0|2,0,0]=4 3895 B14R2.50 Clc1ccncc1Sc2c[nH]cn2 62a_100000756875_100009995489 [0,1,0,0,1,0|2,0,0]=4 3896 B14R2.50 Clc1ccncc1Sc2c[nH]cn2 62a_100009995489_100000756875 [0,1,0,0,1,0|2,0,0]=4 3897 B14R2.50 Clc1cnccc1Sc2c[nH]cn2 62a_100000708259_100000756875 [0,1,0,0,1,0|2,0,0]=4 3898 B14R2.50 Clc1cnccc1Sc2c[nH]cn2 62a_100000756875_100000708259 [0,1,0,0,1,0|2,0,0]=4 3899 B14R2.50 Clc1ncccc1Sc2c[nH]cn2 62a_100000036424_100000756875 [0,1,0,0,1,0|2,0,0]=4 3900 B14R2.50 Clc1ncccc1Sc2c[nH]cn2 62a_100000756875_100000036424 [0,1,0,0,1,0|2,0,0]=4 3901 B14R2.50 Fc1ccccc1Nc2ncns2 27a_100000210422_100000693119 [0,1,0,0,1,0|1,0,1]=4 3902 B14R2.50 Fc1ccccc1Sc2c[nH]cn2 62a_100000756875_100011215700 [0,1,0,0,1,0|1,0,0]=3 3903 B14R2.50 Fc1ccccc1Sc2c[nH]cn2 62a_100011215700_100000756875 [0,1,0,0,1,0|1,0,0]=3 3904 B14R2.50 Fc1ccccc1Sc2c[nH]nn2 62a_100009819707_100011215700 [0,1,0,0,1,0|2,0,0]=4 3905 B14R2.50 Fc1ccccc1Sc2c[nH]nn2 62a_100011215700_100009819707 [0,1,0,0,1,0|2,0,0]=4 3906 B14R2.50 Fc1ccccc1Sc2cscn2 62a_100000751502_100011215700 [0,1,0,0,1,0|2,0,0]=4 3907 B14R2.50 Fc1ccccc1Sc2cscn2 62a_100011215700_100000751502 [0,1,0,0,1,0|2,0,0]=4 3908 B14R2.50 Fc1ccccc1Sc2nc[nH]n2 62a_100000761765_100011215700 [0,1,0,0,1,0|2,0,0]=4 3909 B14R2.50 Fc1ccccc1Sc2nc[nH]n2 62a_100011215700_100000761765 [0,1,0,0,1,0|2,0,0]=4 3910 B14R2.50 Fc1cccnc1Sc2c[nH]cn2 62a_100000685392_100000756875 [0,1,0,0,1,0|2,0,0]=4 3911 B14R2.50 Fc1cccnc1Sc2c[nH]cn2 62a_100000756875_100000685392 [0,1,0,0,1,0|2,0,0]=4 3912 B14R2.50 Fc1ccncc1Sc2c[nH]cn2 62a_100000756875_100009820683 [0,1,0,0,1,0|2,0,0]=4 3913 B14R2.50 Fc1ccncc1Sc2c[nH]cn2 62a_100009820683_100000756875 [0,1,0,0,1,0|2,0,0]=4 3914 B14R2.50 Fc1cnccc1Sc2c[nH]cn2 62a_100000047030_100000756875 [0,1,0,0,1,0|2,0,0]=4 3915 B14R2.50 Fc1cnccc1Sc2c[nH]cn2 62a_100000756875_100000047030 [0,1,0,0,1,0|2,0,0]=4 3916 B14R2.50 Fc1ncccc1Sc2c[nH]cn2 62a_100000756875_100009816115 [0,1,0,0,1,0|2,0,0]=4 3917 B14R2.50 Fc1ncccc1Sc2c[nH]cn2 62a_100009816115_100000756875 [0,1,0,0,1,0|2,0,0]=4 3918 B14R2.50 Ic1ccccc1Nc2ncns2 27a_100000210053_100000693119 [0,1,0,0,1,0|1,0,1]=4 3919 B14R2.50 Nc1ccccc1Sc2c[nH]cn2 62a_100000210017_100000756875 [0,1,0,0,1,0|1,0,0]=3 3920 B14R2.50 Nc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000210017 [0,1,0,0,1,0|1,0,0]=3 3921 B14R2.50 Nc1ccccc1Sc2c[nH]nn2 62a_100000210017_100009819707 [0,1,0,0,1,0|2,0,0]=4 3922 B14R2.50 Nc1ccccc1Sc2c[nH]nn2 62a_100009819707_100000210017 [0,1,0,0,1,0|2,0,0]=4 3923 B14R2.50 Nc1ccccc1Sc2cscn2 62a_100000210017_100000751502 [0,1,0,0,1,0|2,0,0]=4 3924 B14R2.50 Nc1ccccc1Sc2cscn2 62a_100000751502_100000210017 [0,1,0,0,1,0|2,0,0]=4 3925 B14R2.50 Nc1ccccc1Sc2nc[nH]n2 62a_100000210017_100000761765 [0,1,0,0,1,0|2,0,0]=4 3926 B14R2.50 Nc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000210017 [0,1,0,0,1,0|2,0,0]=4 3927 B14R2.50 Nc1cccnc1Sc2c[nH]cn2 62a_100000688686_100000756875 [0,1,0,0,1,0|2,0,0]=4 3928 B14R2.50 Nc1cccnc1Sc2c[nH]cn2 62a_100000756875_100000688686 [0,1,0,0,1,0|2,0,0]=4 3929 B14R2.50 Nc1ccncc1Sc2c[nH]cn2 62a_100000047001_100000756875 [0,1,0,0,1,0|2,0,0]=4 3930 B14R2.50 Nc1ccncc1Sc2c[nH]cn2 62a_100000756875_100000047001 [0,1,0,0,1,0|2,0,0]=4 3931 B14R2.50 Nc1cnccc1Sc2c[nH]cn2 62a_100000756074_100000756875 [0,1,0,0,1,0|2,0,0]=4 3932 B14R2.50 Nc1cnccc1Sc2c[nH]cn2 62a_100000756875_100000756074 [0,1,0,0,1,0|2,0,0]=4 3933 B14R2.50 Nc1ncccc1Sc2c[nH]cn2 62a_100000045569_100000756875 [0,1,0,0,1,0|2,0,0]=4 3934 B14R2.50 Nc1ncccc1Sc2c[nH]cn2 62a_100000756875_100000045569 [0,1,0,0,1,0|2,0,0]=4 3935 B14R2.50 O=c1cc[nH]cc1Sc2c[nH]cn2 62a_100000756875_100009998708 [0,1,0,0,1,0|2,0,0]=4 3936 B14R2.50 O=c1cc[nH]cc1Sc2c[nH]cn2 62a_100009998708_100000756875 [0,1,0,0,1,0|2,0,0]=4 3937 B14R2.50 Oc1ccccc1Cn2cncn2 271570a_203496583355_100000049653 [0,1,0,0,1,0|1,0,1]=4 3938 B14R2.50 Oc1ccccc1Nc2ncns2 27a_100000185747_100000693119 [0,1,0,0,1,0|1,0,1]=4 3939 B14R2.50 Oc1ccccc1Sc2c[nH]cn2 62a_100000739446_100000756875 [0,1,0,0,1,0|1,0,0]=3 3940 B14R2.50 Oc1ccccc1Sc2c[nH]cn2 62a_100000756875_100000739446 [0,1,0,0,1,0|1,0,0]=3 3941 B14R2.50 Oc1ccccc1Sc2c[nH]nn2 62a_100000739446_100009819707 [0,1,0,0,1,0|2,0,0]=4 3942 B14R2.50 Oc1ccccc1Sc2c[nH]nn2 62a_100009819707_100000739446 [0,1,0,0,1,0|2,0,0]=4 3943 B14R2.50 Oc1ccccc1Sc2cscn2 62a_100000739446_100000751502 [0,1,0,0,1,0|2,0,0]=4 3944 B14R2.50 Oc1ccccc1Sc2cscn2 62a_100000751502_100000739446 [0,1,0,0,1,0|2,0,0]=4 3945 B14R2.50 Oc1ccccc1Sc2nc[nH]n2 62a_100000739446_100000761765 [0,1,0,0,1,0|2,0,0]=4 3946 B14R2.50 Oc1ccccc1Sc2nc[nH]n2 62a_100000761765_100000739446 [0,1,0,0,1,0|2,0,0]=4 3947 B14R2.50 Oc1cccnc1Sc2c[nH]cn2 62a_100000034122_100000756875 [0,1,0,0,1,0|2,0,0]=4 3948 B14R2.50 Oc1cccnc1Sc2c[nH]cn2 62a_100000756875_100000034122 [0,1,0,0,1,0|2,0,0]=4 3949 B14R2.50 Oc1cnccc1Sc2c[nH]cn2 62a_100000756875_100009817591 [0,1,0,0,1,0|2,0,0]=4 3950 B14R2.50 Oc1cnccc1Sc2c[nH]cn2 62a_100009817591_100000756875 [0,1,0,0,1,0|2,0,0]=4 3951 B14R2.50 Oc1ncccc1Sc2c[nH]cn2 62a_100000756875_100000760158 [0,1,0,0,1,0|2,0,0]=4 3952 B14R2.50 Oc1ncccc1Sc2c[nH]cn2 62a_100000760158_100000756875 [0,1,0,0,1,0|2,0,0]=4 3953 B14R2.50 S=c1cc[nH]cc1Sc2c[nH]cn2 62a_100000756875_200012280681 [0,1,0,0,1,0|2,0,0]=4 3954 B14R2.50 S=c1cc[nH]cc1Sc2c[nH]cn2 62a_200012280681_100000756875 [0,1,0,0,1,0|2,0,0]=4 3955 B14R2.50 [O-][n+]1ccccc1Sc2c[nH]cn2 62a_100000756875_200000042595 [0,1,0,0,1,0|2,0,0]=4 3956 B14R2.72 Brc1ccc(cc1)Nc2ncns2 27a_100000210018_100000693119 [0,1,0,0,1,0|1,0,1]=4 3957 B14R2.72 Brc1ccc(cc1)Sc2c[nH]cn2 62a_100000752885_100000756875 [0,1,0,0,1,0|1,0,0]=3 3958 B14R2.72 Brc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000752885 [0,1,0,0,1,0|1,0,0]=3 3959 B14R2.72 Brc1ccc(cc1)Sc2c[nH]nn2 62a_100000752885_100009819707 [0,1,0,0,1,0|2,0,0]=4 3960 B14R2.72 Brc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000752885 [0,1,0,0,1,0|2,0,0]=4 3961 B14R2.72 Brc1ccc(cc1)Sc2cscn2 62a_100000751502_100000752885 [0,1,0,0,1,0|2,0,0]=4 3962 B14R2.72 Brc1ccc(cc1)Sc2cscn2 62a_100000752885_100000751502 [0,1,0,0,1,0|2,0,0]=4 3963 B14R2.72 Brc1ccc(cc1)Sc2nc[nH]n2 62a_100000752885_100000761765 [0,1,0,0,1,0|2,0,0]=4 3964 B14R2.72 Brc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000752885 [0,1,0,0,1,0|2,0,0]=4 3965 B14R2.72 Brc1ccc(cn1)Sc2c[nH]cn2 62a_100000756875_100009814638 [0,1,0,0,1,0|2,0,0]=4 3966 B14R2.72 Brc1ccc(cn1)Sc2c[nH]cn2 62a_100009814638_100000756875 [0,1,0,0,1,0|2,0,0]=4 3967 B14R2.72 Brc1ccc(nc1)Sc2c[nH]cn2 62a_100000686858_100000756875 [0,1,0,0,1,0|2,0,0]=4 3968 B14R2.72 Brc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100000686858 [0,1,0,0,1,0|2,0,0]=4 3969 B14R2.72 Cc1ccc(cc1)Nc2ncns2 27a_100000124888_100000693119 [0,1,0,0,1,0|1,0,1]=4 3970 B14R2.72 Cc1ccc(cc1)Sc2c[nH]cn2 62a_100000186775_100000756875 [0,1,0,0,1,0|1,0,0]=3 3971 B14R2.72 Cc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000186775 [0,1,0,0,1,0|1,0,0]=3 3972 B14R2.72 Cc1ccc(cc1)Sc2c[nH]nn2 62a_100000186775_100009819707 [0,1,0,0,1,0|2,0,0]=4 3973 B14R2.72 Cc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000186775 [0,1,0,0,1,0|2,0,0]=4 3974 B14R2.72 Cc1ccc(cc1)Sc2cscn2 62a_100000186775_100000751502 [0,1,0,0,1,0|2,0,0]=4 3975 B14R2.72 Cc1ccc(cc1)Sc2cscn2 62a_100000751502_100000186775 [0,1,0,0,1,0|2,0,0]=4 3976 B14R2.72 Cc1ccc(cc1)Sc2nc[nH]n2 62a_100000186775_100000761765 [0,1,0,0,1,0|2,0,0]=4 3977 B14R2.72 Cc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000186775 [0,1,0,0,1,0|2,0,0]=4 3978 B14R2.72 Cc1ccc(cn1)Sc2c[nH]cn2 62a_100000751577_100000756875 [0,1,0,0,1,0|2,0,0]=4 3979 B14R2.72 Cc1ccc(cn1)Sc2c[nH]cn2 62a_100000756875_100000751577 [0,1,0,0,1,0|2,0,0]=4 3980 B14R2.72 Cc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100000754016 [0,1,0,0,1,0|2,0,0]=4 3981 B14R2.72 Cc1ccc(nc1)Sc2c[nH]cn2 62a_100011192072_100000756875 [0,1,0,0,1,0|2,0,0]=4 3982 B14R2.72 Clc1ccc(cc1)Nc2ncns2 27a_100000210052_100000693119 [0,1,0,0,1,0|1,0,1]=4 3983 B14R2.72 Clc1ccc(cc1)Sc2c[nH]cn2 62a_100000755918_100000756875 [0,1,0,0,1,0|1,0,0]=3 3984 B14R2.72 Clc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000755918 [0,1,0,0,1,0|1,0,0]=3 3985 B14R2.72 Clc1ccc(cc1)Sc2c[nH]nn2 62a_100000755918_100009819707 [0,1,0,0,1,0|2,0,0]=4 3986 B14R2.72 Clc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000755918 [0,1,0,0,1,0|2,0,0]=4 3987 B14R2.72 Clc1ccc(cc1)Sc2cscn2 62a_100000751502_100000755918 [0,1,0,0,1,0|2,0,0]=4 3988 B14R2.72 Clc1ccc(cc1)Sc2cscn2 62a_100000755918_100000751502 [0,1,0,0,1,0|2,0,0]=4 3989 B14R2.72 Clc1ccc(cc1)Sc2nc[nH]n2 62a_100000755918_100000761765 [0,1,0,0,1,0|2,0,0]=4 3990 B14R2.72 Clc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000755918 [0,1,0,0,1,0|2,0,0]=4 3991 B14R2.72 Clc1ccc(cn1)Sc2c[nH]cn2 62a_100000034144_100000756875 [0,1,0,0,1,0|2,0,0]=4 3992 B14R2.72 Clc1ccc(cn1)Sc2c[nH]cn2 62a_100000756875_100000034144 [0,1,0,0,1,0|2,0,0]=4 3993 B14R2.72 Clc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100011356976 [0,1,0,0,1,0|2,0,0]=4 3994 B14R2.72 Clc1ccc(nc1)Sc2c[nH]cn2 62a_100011356976_100000756875 [0,1,0,0,1,0|2,0,0]=4 3995 B14R2.72 Fc1ccc(cc1)Nc2ncns2 27a_100000185862_100000693119 [0,1,0,0,1,0|1,0,1]=4 3996 B14R2.72 Fc1ccc(cc1)Sc2c[nH]cn2 62a_100000211213_100000756875 [0,1,0,0,1,0|1,0,0]=3 3997 B14R2.72 Fc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000211213 [0,1,0,0,1,0|1,0,0]=3 3998 B14R2.72 Fc1ccc(cc1)Sc2c[nH]nn2 62a_100000211213_100009819707 [0,1,0,0,1,0|2,0,0]=4 3999 B14R2.72 Fc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000211213 [0,1,0,0,1,0|2,0,0]=4 4000 B14R2.72 Fc1ccc(cc1)Sc2cscn2 62a_100000211213_100000751502 [0,1,0,0,1,0|2,0,0]=4 4001 B14R2.72 Fc1ccc(cc1)Sc2cscn2 62a_100000751502_100000211213 [0,1,0,0,1,0|2,0,0]=4 4002 B14R2.72 Fc1ccc(cc1)Sc2nc[nH]n2 62a_100000211213_100000761765 [0,1,0,0,1,0|2,0,0]=4 4003 B14R2.72 Fc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000211213 [0,1,0,0,1,0|2,0,0]=4 4004 B14R2.72 Fc1ccc(cn1)Sc2c[nH]cn2 62a_100000042367_100000756875 [0,1,0,0,1,0|2,0,0]=4 4005 B14R2.72 Fc1ccc(cn1)Sc2c[nH]cn2 62a_100000756875_100000042367 [0,1,0,0,1,0|2,0,0]=4 4006 B14R2.72 Fc1ccc(nc1)Sc2c[nH]cn2 62a_100000744514_100000756875 [0,1,0,0,1,0|2,0,0]=4 4007 B14R2.72 Fc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100000744514 [0,1,0,0,1,0|2,0,0]=4 4008 B14R2.72 Ic1ccc(cc1)Nc2ncns2 27a_100000185761_100000693119 [0,1,0,0,1,0|1,0,1]=4 4009 B14R2.72 Nc1ccc(cc1)Sc2c[nH]cn2 62a_100000185761_100000756875 [0,1,0,0,1,0|1,0,0]=3 4010 B14R2.72 Nc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000185761 [0,1,0,0,1,0|1,0,0]=3 4011 B14R2.72 Nc1ccc(cc1)Sc2c[nH]nn2 62a_100000185761_100009819707 [0,1,0,0,1,0|2,0,0]=4 4012 B14R2.72 Nc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000185761 [0,1,0,0,1,0|2,0,0]=4 4013 B14R2.72 Nc1ccc(cc1)Sc2cscn2 62a_100000185761_100000751502 [0,1,0,0,1,0|2,0,0]=4 4014 B14R2.72 Nc1ccc(cc1)Sc2cscn2 62a_100000751502_100000185761 [0,1,0,0,1,0|2,0,0]=4 4015 B14R2.72 Nc1ccc(cc1)Sc2nc[nH]n2 62a_100000185761_100000761765 [0,1,0,0,1,0|2,0,0]=4 4016 B14R2.72 Nc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000185761 [0,1,0,0,1,0|2,0,0]=4 4017 B14R2.72 Nc1ccc(cn1)Sc2c[nH]cn2 62a_100000187370_100000756875 [0,1,0,0,1,0|2,0,0]=4 4018 B14R2.72 Nc1ccc(cn1)Sc2c[nH]cn2 62a_100000756875_100000187370 [0,1,0,0,1,0|2,0,0]=4 4019 B14R2.72 Nc1ccc(nc1)Sc2c[nH]cn2 62a_100000737798_100000756875 [0,1,0,0,1,0|2,0,0]=4 4020 B14R2.72 Nc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100000737798 [0,1,0,0,1,0|2,0,0]=4 4021 B14R2.72 O=c1ccc(c[nH]1)Sc2c[nH]cn2 62a_100000212171_100000756875 [0,1,0,0,1,0|2,0,0]=4 4022 B14R2.72 O=c1ccc(c[nH]1)Sc2c[nH]cn2 62a_100000756875_100000212171 [0,1,0,0,1,0|2,0,0]=4 4023 B14R2.72 Oc1ccc(cc1)Cn2cccn2 271570a_203496583355_100000751348 [0,1,0,0,1,0|2,0,0]=4 4024 B14R2.72 Oc1ccc(cc1)Nc2ncns2 27a_100000185829_100000693119 [0,1,0,0,1,0|1,0,1]=4 4025 B14R2.72 Oc1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000185759 [0,1,0,0,1,0|1,0,0]=3 4026 B14R2.72 Oc1ccc(cc1)Sc2c[nH]nn2 62a_100009819707_100000185759 [0,1,0,0,1,0|2,0,0]=4 4027 B14R2.72 Oc1ccc(cc1)Sc2cscn2 62a_100000751502_100000185759 [0,1,0,0,1,0|2,0,0]=4 4028 B14R2.72 Oc1ccc(cc1)Sc2nc[nH]n2 62a_100000761765_100000185759 [0,1,0,0,1,0|2,0,0]=4 4029 B14R2.72 Oc1ccc(nc1)Sc2c[nH]cn2 62a_100000685995_100000756875 [0,1,0,0,1,0|2,0,0]=4 4030 B14R2.72 Oc1ccc(nc1)Sc2c[nH]cn2 62a_100000756875_100000744096 [0,1,0,0,1,0|2,0,0]=4 4031 B14R2.72 [O-][n+]1ccc(cc1)Sc2c[nH]cn2 62a_100000756875_100000039755 [0,1,0,0,1,0|2,0,0]=4 4032 B14R2.114 C=C(c1ccccc1)c2c[nH]cn2 271570a_100000068269_100000756875 [0,1,0,0,1,0|0,0,1]=3 4033 B14R2.114 C=C(c1ccccc1)c2cscn2 271570a_100000068269_100000751502 [0,1,0,0,1,0|1,0,1]=4 4034 B14R2.114 C=C(c1ccccc1)c2nc[nH]n2 271570a_100000068269_100000761765 [0,1,0,0,1,0|1,0,1]=4 4035 B14R2.716 Brc1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100009814637 [0,1,0,0,1,0|2,0,0]=4 4036 B14R2.716 Brc1cc(ccn1)Sc2c[nH]cn2 62a_100009814637_100000756875 [0,1,0,0,1,0|2,0,0]=4 4037 B14R2.716 Brc1cccc(c1)Nc2ncns2 27a_100000210019_100000693119 [0,1,0,0,1,0|1,0,1]=4 4038 B14R2.716 Brc1cccc(c1)Sc2c[nH]cn2 62a_100000691529_100000756875 [0,1,0,0,1,0|1,0,0]=3 4039 B14R2.716 Brc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100000691529 [0,1,0,0,1,0|1,0,0]=3 4040 B14R2.716 Brc1cccc(c1)Sc2c[nH]nn2 62a_100000691529_100009819707 [0,1,0,0,1,0|2,0,0]=4 4041 B14R2.716 Brc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100000691529 [0,1,0,0,1,0|2,0,0]=4 4042 B14R2.716 Brc1cccc(c1)Sc2cscn2 62a_100000691529_100000751502 [0,1,0,0,1,0|2,0,0]=4 4043 B14R2.716 Brc1cccc(c1)Sc2cscn2 62a_100000751502_100000691529 [0,1,0,0,1,0|2,0,0]=4 4044 B14R2.716 Brc1cccc(c1)Sc2nc[nH]n2 62a_100000691529_100000761765 [0,1,0,0,1,0|2,0,0]=4 4045 B14R2.716 Brc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100000691529 [0,1,0,0,1,0|2,0,0]=4 4046 B14R2.716 Brc1cccc(n1)Sc2c[nH]cn2 62a_100000684672_100000756875 [0,1,0,0,1,0|2,0,0]=4 4047 B14R2.716 Brc1cccc(n1)Sc2c[nH]cn2 62a_100000756875_100000684672 [0,1,0,0,1,0|2,0,0]=4 4048 B14R2.716 Brc1cncc(c1)Sc2c[nH]cn2 62a_100000728054_100000756875 [0,1,0,0,1,0|2,0,0]=4 4049 B14R2.716 Brc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000728054 [0,1,0,0,1,0|2,0,0]=4 4050 B14R2.716 C[n+]1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100009996589 [0,1,0,0,1,0|2,0,0]=4 4051 B14R2.716 C[n+]1cccc(c1)Sc2c[nH]cn2 62a_100009996589_100000756875 [0,1,0,0,1,0|2,0,0]=4 4052 B14R2.716 Cc1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100000758586 [0,1,0,0,1,0|2,0,0]=4 4053 B14R2.716 Cc1cc(ccn1)Sc2c[nH]cn2 62a_100000758586_100000756875 [0,1,0,0,1,0|2,0,0]=4 4054 B14R2.716 Cc1cccc(c1)Nc2ncns2 27a_100000188690_100000693119 [0,1,0,0,1,0|1,0,1]=4 4055 B14R2.716 Cc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100011215228 [0,1,0,0,1,0|1,0,0]=3 4056 B14R2.716 Cc1cccc(c1)Sc2c[nH]cn2 62a_100011215228_100000756875 [0,1,0,0,1,0|1,0,0]=3 4057 B14R2.716 Cc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100011215228 [0,1,0,0,1,0|2,0,0]=4 4058 B14R2.716 Cc1cccc(c1)Sc2c[nH]nn2 62a_100011215228_100009819707 [0,1,0,0,1,0|2,0,0]=4 4059 B14R2.716 Cc1cccc(c1)Sc2cscn2 62a_100000751502_100011215228 [0,1,0,0,1,0|2,0,0]=4 4060 B14R2.716 Cc1cccc(c1)Sc2cscn2 62a_100011215228_100000751502 [0,1,0,0,1,0|2,0,0]=4 4061 B14R2.716 Cc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100011215228 [0,1,0,0,1,0|2,0,0]=4 4062 B14R2.716 Cc1cccc(c1)Sc2nc[nH]n2 62a_100011215228_100000761765 [0,1,0,0,1,0|2,0,0]=4 4063 B14R2.716 Cc1cccc(n1)Sc2c[nH]cn2 62a_100000742759_100000756875 [0,1,0,0,1,0|2,0,0]=4 4064 B14R2.716 Cc1cccc(n1)Sc2c[nH]cn2 62a_100000756875_100000742759 [0,1,0,0,1,0|2,0,0]=4 4065 B14R2.716 Cc1ccnc(c1)Sc2c[nH]cn2 62a_100000750283_100000756875 [0,1,0,0,1,0|2,0,0]=4 4066 B14R2.716 Cc1ccnc(c1)Sc2c[nH]cn2 62a_100000756875_100000750283 [0,1,0,0,1,0|2,0,0]=4 4067 B14R2.716 Cc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000760492 [0,1,0,0,1,0|2,0,0]=4 4068 B14R2.716 Cc1cncc(c1)Sc2c[nH]cn2 62a_100000760492_100000756875 [0,1,0,0,1,0|2,0,0]=4 4069 B14R2.716 Clc1cc(ccn1)Sc2c[nH]cn2 62a_100000035001_100000756875 [0,1,0,0,1,0|2,0,0]=4 4070 B14R2.716 Clc1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100000035001 [0,1,0,0,1,0|2,0,0]=4 4071 B14R2.716 Clc1cccc(c1)Nc2ncns2 27a_100000185859_100000693119 [0,1,0,0,1,0|1,0,1]=4 4072 B14R2.716 Clc1cccc(c1)Sc2c[nH]cn2 62a_100000699651_100000756875 [0,1,0,0,1,0|1,0,0]=3 4073 B14R2.716 Clc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100000699651 [0,1,0,0,1,0|1,0,0]=3 4074 B14R2.716 Clc1cccc(c1)Sc2c[nH]nn2 62a_100000699651_100009819707 [0,1,0,0,1,0|2,0,0]=4 4075 B14R2.716 Clc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100000699651 [0,1,0,0,1,0|2,0,0]=4 4076 B14R2.716 Clc1cccc(c1)Sc2cscn2 62a_100000699651_100000751502 [0,1,0,0,1,0|2,0,0]=4 4077 B14R2.716 Clc1cccc(c1)Sc2cscn2 62a_100000751502_100000699651 [0,1,0,0,1,0|2,0,0]=4 4078 B14R2.716 Clc1cccc(c1)Sc2nc[nH]n2 62a_100000699651_100000761765 [0,1,0,0,1,0|2,0,0]=4 4079 B14R2.716 Clc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100000699651 [0,1,0,0,1,0|2,0,0]=4 4080 B14R2.716 Clc1cccc(n1)Sc2c[nH]cn2 62a_100000051397_100000756875 [0,1,0,0,1,0|2,0,0]=4 4081 B14R2.716 Clc1cccc(n1)Sc2c[nH]cn2 62a_100000756875_100000051397 [0,1,0,0,1,0|2,0,0]=4 4082 B14R2.716 Clc1ccnc(c1)Sc2c[nH]cn2 62a_100000756875_100010167805 [0,1,0,0,1,0|2,0,0]=4 4083 B14R2.716 Clc1ccnc(c1)Sc2c[nH]cn2 62a_100010167805_100000756875 [0,1,0,0,1,0|2,0,0]=4 4084 B14R2.716 Clc1cncc(c1)Sc2c[nH]cn2 62a_100000049639_100000756875 [0,1,0,0,1,0|2,0,0]=4 4085 B14R2.716 Clc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000049639 [0,1,0,0,1,0|2,0,0]=4 4086 B14R2.716 Fc1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100009816116 [0,1,0,0,1,0|2,0,0]=4 4087 B14R2.716 Fc1cc(ccn1)Sc2c[nH]cn2 62a_100009816116_100000756875 [0,1,0,0,1,0|2,0,0]=4 4088 B14R2.716 Fc1cccc(c1)Nc2ncns2 27a_100000210047_100000693119 [0,1,0,0,1,0|1,0,1]=4 4089 B14R2.716 Fc1cccc(c1)Sc2c[nH]cn2 62a_100000685547_100000756875 [0,1,0,0,1,0|1,0,0]=3 4090 B14R2.716 Fc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100000685547 [0,1,0,0,1,0|1,0,0]=3 4091 B14R2.716 Fc1cccc(c1)Sc2c[nH]nn2 62a_100000685547_100009819707 [0,1,0,0,1,0|2,0,0]=4 4092 B14R2.716 Fc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100000685547 [0,1,0,0,1,0|2,0,0]=4 4093 B14R2.716 Fc1cccc(c1)Sc2cscn2 62a_100000685547_100000751502 [0,1,0,0,1,0|2,0,0]=4 4094 B14R2.716 Fc1cccc(c1)Sc2cscn2 62a_100000751502_100000685547 [0,1,0,0,1,0|2,0,0]=4 4095 B14R2.716 Fc1cccc(c1)Sc2nc[nH]n2 62a_100000685547_100000761765 [0,1,0,0,1,0|2,0,0]=4 4096 B14R2.716 Fc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100000685547 [0,1,0,0,1,0|2,0,0]=4 4097 B14R2.716 Fc1cccc(n1)Sc2c[nH]cn2 62a_100000756875_100009815982 [0,1,0,0,1,0|2,0,0]=4 4098 B14R2.716 Fc1cccc(n1)Sc2c[nH]cn2 62a_100009815982_100000756875 [0,1,0,0,1,0|2,0,0]=4 4099 B14R2.716 Fc1ccnc(c1)Sc2c[nH]cn2 62a_100000756875_100000764206 [0,1,0,0,1,0|2,0,0]=4 4100 B14R2.716 Fc1ccnc(c1)Sc2c[nH]cn2 62a_100000764206_100000756875 [0,1,0,0,1,0|2,0,0]=4 4101 B14R2.716 Fc1cncc(c1)Sc2c[nH]cn2 62a_100000744099_100000756875 [0,1,0,0,1,0|2,0,0]=4 4102 B14R2.716 Fc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000744099 [0,1,0,0,1,0|2,0,0]=4 4103 B14R2.716 Ic1cccc(c1)Nc2ncns2 27a_100000211102_100000693119 [0,1,0,0,1,0|1,0,1]=4 4104 B14R2.716 Nc1cc(ccn1)Sc2c[nH]cn2 62a_100000049665_100000756875 [0,1,0,0,1,0|2,0,0]=4 4105 B14R2.716 Nc1cc(ccn1)Sc2c[nH]cn2 62a_100000756875_100000049665 [0,1,0,0,1,0|2,0,0]=4 4106 B14R2.716 Nc1cccc(c1)Sc2c[nH]cn2 62a_100000210019_100000756875 [0,1,0,0,1,0|1,0,0]=3 4107 B14R2.716 Nc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100000210019 [0,1,0,0,1,0|1,0,0]=3 4108 B14R2.716 Nc1cccc(c1)Sc2c[nH]nn2 62a_100000210019_100009819707 [0,1,0,0,1,0|2,0,0]=4 4109 B14R2.716 Nc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100000210019 [0,1,0,0,1,0|2,0,0]=4 4110 B14R2.716 Nc1cccc(c1)Sc2cscn2 62a_100000210019_100000751502 [0,1,0,0,1,0|2,0,0]=4 4111 B14R2.716 Nc1cccc(c1)Sc2cscn2 62a_100000751502_100000210019 [0,1,0,0,1,0|2,0,0]=4 4112 B14R2.716 Nc1cccc(c1)Sc2nc[nH]n2 62a_100000210019_100000761765 [0,1,0,0,1,0|2,0,0]=4 4113 B14R2.716 Nc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100000210019 [0,1,0,0,1,0|2,0,0]=4 4114 B14R2.716 Nc1cccc(n1)Sc2c[nH]cn2 62a_100000740741_100000756875 [0,1,0,0,1,0|2,0,0]=4 4115 B14R2.716 Nc1cccc(n1)Sc2c[nH]cn2 62a_100000756875_100000740741 [0,1,0,0,1,0|2,0,0]=4 4116 B14R2.716 Nc1ccnc(c1)Sc2c[nH]cn2 62a_100000756875_100009814236 [0,1,0,0,1,0|2,0,0]=4 4117 B14R2.716 Nc1ccnc(c1)Sc2c[nH]cn2 62a_100009814236_100000756875 [0,1,0,0,1,0|2,0,0]=4 4118 B14R2.716 Nc1cncc(c1)Sc2c[nH]cn2 62a_100000687067_100000756875 [0,1,0,0,1,0|2,0,0]=4 4119 B14R2.716 Nc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000687067 [0,1,0,0,1,0|2,0,0]=4 4120 B14R2.716 O=c1cc(cc[nH]1)Sc2c[nH]cn2 62a_100000756875_100009816521 [0,1,0,0,1,0|2,0,0]=4 4121 B14R2.716 O=c1cc(cc[nH]1)Sc2c[nH]cn2 62a_100009816521_100000756875 [0,1,0,0,1,0|2,0,0]=4 4122 B14R2.716 O=c1cc[nH]c(c1)Sc2c[nH]cn2 62a_100009817434_100000756875 [0,1,0,0,1,0|2,0,0]=4 4123 B14R2.716 O=c1cccc([nH]1)Sc2c[nH]cn2 62a_100000756875_100000752884 [0,1,0,0,1,0|2,0,0]=4 4124 B14R2.716 Oc1cccc(c1)Nc2ncns2 27a_100000210217_100000693119 [0,1,0,0,1,0|1,0,1]=4 4125 B14R2.716 Oc1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100000211634 [0,1,0,0,1,0|1,0,0]=3 4126 B14R2.716 Oc1cccc(c1)Sc2c[nH]nn2 62a_100009819707_100000211634 [0,1,0,0,1,0|2,0,0]=4 4127 B14R2.716 Oc1cccc(c1)Sc2cscn2 62a_100000751502_100000211634 [0,1,0,0,1,0|2,0,0]=4 4128 B14R2.716 Oc1cccc(c1)Sc2nc[nH]n2 62a_100000761765_100000211634 [0,1,0,0,1,0|2,0,0]=4 4129 B14R2.716 Oc1ccnc(c1)Sc2c[nH]cn2 62a_100000756875_100000762945 [0,1,0,0,1,0|2,0,0]=4 4130 B14R2.716 Oc1cncc(c1)Sc2c[nH]cn2 62a_100000754920_100000756875 [0,1,0,0,1,0|2,0,0]=4 4131 B14R2.716 Oc1cncc(c1)Sc2c[nH]cn2 62a_100000756875_100000754920 [0,1,0,0,1,0|2,0,0]=4 4132 B14R2.716 [O-][n+]1cccc(c1)Sc2c[nH]cn2 62a_100000756875_100009815978 [0,1,0,0,1,0|2,0,0]=4 4133 B14R2.716 [S]c1cccc(c1)Sc2c[nH]cn2 62a_100000756875_114929384022 [0,1,0,0,1,0|1,0,0]=3 4134 B14R2.716 [S]c1cccc(c1)Sc2c[nH]cn2 62a_114929384022_100000756875 [0,1,0,0,1,0|1,0,0]=3 4135 B14R2.716 [S]c1cccc(c1)Sc2c[nH]nn2 62a_100009819707_114929384022 [0,1,0,0,1,0|2,0,0]=4 4136 B14R2.716 [S]c1cccc(c1)Sc2c[nH]nn2 62a_114929384022_100009819707 [0,1,0,0,1,0|2,0,0]=4 4137 B14R2.716 [S]c1cccc(c1)Sc2cscn2 62a_100000751502_114929384022 [0,1,0,0,1,0|2,0,0]=4 4138 B14R2.716 [S]c1cccc(c1)Sc2cscn2 62a_114929384022_100000751502 [0,1,0,0,1,0|2,0,0]=4 4139 B14R2.716 [S]c1cccc(c1)Sc2nc[nH]n2 62a_100000761765_114929384022 [0,1,0,0,1,0|2,0,0]=4 4140 B14R2.716 [S]c1cccc(c1)Sc2nc[nH]n2 62a_114929384022_100000761765 [0,1,0,0,1,0|2,0,0]=4 4141 B14R2.252 Brc1ccc(s1)SCc2c[nH]cn2 62a_100000707719_100010197418 [0,1,0,0,1,0|2,0,0]=4 4142 B14R2.252 Brc1ccc(s1)SCc2c[nH]cn2 62a_100010197418_100000707719 [0,1,0,0,1,0|2,0,0]=4 4143 B14R2.252 Cc1cc(cs1)SCc2c[nH]cn2 62a_100000707719_100000759034 [0,1,0,0,1,0|2,0,0]=4 4144 B14R2.252 Cc1cc(cs1)SCc2c[nH]cn2 62a_100000759034_100000707719 [0,1,0,0,1,0|2,0,0]=4 4145 B14R2.252 Cc1ccc(s1)SCc2c[nH]cn2 62a_100000031368_100000707719 [0,1,0,0,1,0|2,0,0]=4 4146 B14R2.252 Cc1ccc(s1)SCc2c[nH]cn2 62a_100000707719_100000031368 [0,1,0,0,1,0|2,0,0]=4 4147 B14R2.252 Cc1csc(c1)SCc2c[nH]cn2 62a_100000707719_100009876951 [0,1,0,0,1,0|2,0,0]=4 4148 B14R2.252 Cc1csc(c1)SCc2c[nH]cn2 62a_100009876951_100000707719 [0,1,0,0,1,0|2,0,0]=4 4149 B14R2.252 Cn1cnc(c1)COc2ccsc2 34a_100000106738_100000717665 [0,1,0,0,1,0|2,0,0]=4 4150 B14R2.252 Cn1cnc(c1)COc2ccsc2 7a_100000106738_100000717665 [0,1,0,0,1,0|2,0,0]=4 4151 B14R2.252 Cn1cnc(c1)CSc2ccco2 62a_100000717665_100009814098 [0,1,0,0,1,0|2,0,0]=4 4152 B14R2.252 Cn1cnc(c1)CSc2ccco2 62a_100009814098_100000717665 [0,1,0,0,1,0|2,0,0]=4 4153 B14R2.252 Cn1cnc(c1)CSc2cccs2 62a_100000717665_100011215356 [0,1,0,0,1,0|2,0,0]=4 4154 B14R2.252 Cn1cnc(c1)CSc2cccs2 62a_100011215356_100000717665 [0,1,0,0,1,0|2,0,0]=4 4155 B14R2.252 Cn1cnc(c1)CSc2ccoc2 62a_100000717665_100011215275 [0,1,0,0,1,0|2,0,0]=4 4156 B14R2.252 Cn1cnc(c1)CSc2ccoc2 62a_100011215275_100000717665 [0,1,0,0,1,0|2,0,0]=4 4157 B14R2.252 Cn1cnc(c1)CSc2ccsc2 62a_100000717665_100000738268 [0,1,0,0,1,0|2,0,0]=4 4158 B14R2.252 Cn1cnc(c1)CSc2ccsc2 62a_100000738268_100000717665 [0,1,0,0,1,0|2,0,0]=4 4159 B14R2.384 Brc1ccsc1SCc2c[nH]cn2 62a_100000707719_100012361411 [0,1,0,0,1,0|2,0,0]=4 4160 B14R2.384 Brc1ccsc1SCc2c[nH]cn2 62a_100012361411_100000707719 [0,1,0,0,1,0|2,0,0]=4 4161 B14R2.384 Brc1cscc1SCc2c[nH]cn2 62a_100000707719_100010143727 [0,1,0,0,1,0|2,0,0]=4 4162 B14R2.384 Brc1cscc1SCc2c[nH]cn2 62a_100010143727_100000707719 [0,1,0,0,1,0|2,0,0]=4 4163 B14R2.384 Cc1[nH]cnc1CSc2ccco2 62a_100000751220_100009814098 [0,1,0,0,1,0|2,0,0]=4 4164 B14R2.384 Cc1[nH]cnc1CSc2ccco2 62a_100009814098_100000751220 [0,1,0,0,1,0|2,0,0]=4 4165 B14R2.384 Cc1[nH]cnc1CSc2cccs2 62a_100000751220_100011215356 [0,1,0,0,1,0|2,0,0]=4 4166 B14R2.384 Cc1[nH]cnc1CSc2cccs2 62a_100011215356_100000751220 [0,1,0,0,1,0|2,0,0]=4 4167 B14R2.384 Cc1[nH]cnc1CSc2ccoc2 62a_100000751220_100011215275 [0,1,0,0,1,0|2,0,0]=4 4168 B14R2.384 Cc1[nH]cnc1CSc2ccoc2 62a_100011215275_100000751220 [0,1,0,0,1,0|2,0,0]=4 4169 B14R2.384 Cc1[nH]cnc1CSc2ccsc2 62a_100000738268_100000751220 [0,1,0,0,1,0|2,0,0]=4 4170 B14R2.384 Cc1[nH]cnc1CSc2ccsc2 62a_100000751220_100000738268 [0,1,0,0,1,0|2,0,0]=4 4171 B14R2.384 Cc1ccsc1SCc2c[nH]cn2 62a_100000707719_100010247149 [0,1,0,0,1,0|2,0,0]=4 4172 B14R2.384 Cc1ccsc1SCc2c[nH]cn2 62a_100010247149_100000707719 [0,1,0,0,1,0|2,0,0]=4 4173 B14R2.384 Cc1cscc1SCc2c[nH]cn2 62a_100000707719_100000759966 [0,1,0,0,1,0|2,0,0]=4 4174 B14R2.384 Cc1cscc1SCc2c[nH]cn2 62a_100000759966_100000707719 [0,1,0,0,1,0|2,0,0]=4 4175 B14R2.384 Cc1sccc1SCc2c[nH]cn2 62a_100000684487_100000707719 [0,1,0,0,1,0|2,0,0]=4 4176 B14R2.384 Cc1sccc1SCc2c[nH]cn2 62a_100000707719_100000684487 [0,1,0,0,1,0|2,0,0]=4 4177 B16R2.71 Brc1ccccc1CNc2ccccc2 207a_100000106764_100000211189 [0,1,0,0,0,1|2,0,0]=4 4178 B16R2.71 Brc1ccccc1CNc2ccccc2 270302a_100000106764_100000211189 [0,1,0,0,0,1|2,0,0]=4 4179 B16R2.71 Brc1ccccc1CNc2ccccc2 34a_100000106764_100000184730 [0,1,0,0,0,1|2,0,0]=4 4180 B16R2.71 Brc1ccccc1NCc2ccccc2 207a_100000210017_100015611070 [0,1,0,0,0,1|2,0,0]=4 4181 B16R2.71 Brc1ccccc1NCc2ccccc2 34a_100000210017_100015291786 [0,1,0,0,0,1|2,0,0]=4 4182 B16R2.71 Brc1ccccc1NCc2ccccn2 207a_100000210017_100000209966 [0,1,0,0,0,1|1,0,0]=3 4183 B16R2.71 Brc1ccccc1NCc2ccccn2 34a_100000210017_100000721315 [0,1,0,0,0,1|1,0,0]=3 4184 B16R2.71 Brc1ccccc1NCc2cccnc2 207a_100000210017_100000209961 [0,1,0,0,0,1|1,0,0]=3 4185 B16R2.71 Brc1ccccc1NCc2cccnc2 34a_100000210017_100000733263 [0,1,0,0,0,1|1,0,0]=3 4186 B16R2.71 Brc1ccccc1NCc2cccnn2 34a_100000210017_100016990269 [0,1,0,0,0,1|1,0,0]=3 4187 B16R2.71 Brc1ccccc1NCc2ccncc2 207a_100000210017_100000186114 [0,1,0,0,0,1|1,0,1]=4 4188 B16R2.71 Brc1ccccc1NCc2cnccn2 34a_100000210017_100016995436 [0,1,0,0,0,1|0,0,1]=3 4189 B16R2.71 Brc1ccccc1NCc2cncnc2 34a_100000210017_100015196519 [0,1,0,0,0,1|0,0,1]=3 4190 B16R2.71 Brc1ccccc1NCc2ncccn2 34a_100000210017_100000703007 [0,1,0,0,0,1|1,0,0]=3 4191 B16R2.71 Brc1ccccc1OCc2ccccn2 34a_100000181306_100000721315 [0,1,0,0,0,1|2,0,0]=4 4192 B16R2.71 Brc1ccccc1OCc2ccccn2 7a_100000181306_100000721315 [0,1,0,0,0,1|2,0,0]=4 4193 B16R2.71 Brc1ccccc1OCc2cccnc2 34a_100000181306_100000733263 [0,1,0,0,0,1|2,0,0]=4 4194 B16R2.71 Brc1ccccc1OCc2cccnc2 7a_100000181306_100000741622 [0,1,0,0,0,1|2,0,0]=4 4195 B16R2.71 Brc1ccccc1OCc2cccnn2 34a_100000181306_100016990269 [0,1,0,0,0,1|2,0,0]=4 4196 B16R2.71 Brc1ccccc1OCc2cccnn2 7a_100000181306_100016990269 [0,1,0,0,0,1|2,0,0]=4 4197 B16R2.71 Brc1ccccc1OCc2cnccn2 34a_100000181306_100016995436 [0,1,0,0,0,1|1,0,1]=4 4198 B16R2.71 Brc1ccccc1OCc2cnccn2 7a_100000181306_100016995436 [0,1,0,0,0,1|1,0,1]=4 4199 B16R2.71 Brc1ccccc1OCc2cncnc2 34a_100000181306_100015196519 [0,1,0,0,0,1|1,0,1]=4 4200 B16R2.71 Brc1ccccc1OCc2cncnc2 7a_100000181306_100015196519 [0,1,0,0,0,1|1,0,1]=4 4201 B16R2.71 Brc1ccccc1OCc2ncccn2 34a_100000181306_100000703007 [0,1,0,0,0,1|2,0,0]=4 4202 B16R2.71 Brc1ccccc1OCc2ncccn2 7a_100000181306_100000703007 [0,1,0,0,0,1|2,0,0]=4 4203 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000695589_100000721315 [0,1,0,0,0,1|2,0,0]=4 4204 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000721315_100000695589 [0,1,0,0,0,1|2,0,0]=4 4205 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000695589_100000741622 [0,1,0,0,0,1|2,0,0]=4 4206 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000741622_100000695589 [0,1,0,0,0,1|2,0,0]=4 4207 B16R2.71 Brc1ccccc1SCc2cccnn2 62a_100000695589_100016990269 [0,1,0,0,0,1|2,0,0]=4 4208 B16R2.71 Brc1ccccc1SCc2cccnn2 62a_100016990269_100000695589 [0,1,0,0,0,1|2,0,0]=4 4209 B16R2.71 Brc1ccccc1SCc2cnccn2 62a_100000695589_100016995436 [0,1,0,0,0,1|1,0,1]=4 4210 B16R2.71 Brc1ccccc1SCc2cnccn2 62a_100016995436_100000695589 [0,1,0,0,0,1|1,0,1]=4 4211 B16R2.71 Brc1ccccc1SCc2cncnc2 62a_100000695589_100015196519 [0,1,0,0,0,1|1,0,1]=4 4212 B16R2.71 Brc1ccccc1SCc2cncnc2 62a_100015196519_100000695589 [0,1,0,0,0,1|1,0,1]=4 4213 B16R2.71 Brc1ccccc1SCc2ncccn2 62a_100000695589_100000703007 [0,1,0,0,0,1|2,0,0]=4 4214 B16R2.71 Brc1ccccc1SCc2ncccn2 62a_100000703007_100000695589 [0,1,0,0,0,1|2,0,0]=4 4215 B16R2.71 Brc1cccnc1CNc2ccccc2 207a_100000106764_100011934733 [0,1,0,0,0,1|1,0,0]=3 4216 B16R2.71 Brc1cccnc1CNc2ccccc2 34a_100000106764_100025702911 [0,1,0,0,0,1|1,0,0]=3 4217 B16R2.71 Brc1cccnc1COc2ccccc2 34a_100000210340_100025702911 [0,1,0,0,0,1|2,0,0]=4 4218 B16R2.71 Brc1cccnc1COc2ccccc2 7a_100000210340_100025702911 [0,1,0,0,0,1|2,0,0]=4 4219 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100000719477_100025702911 [0,1,0,0,0,1|2,0,0]=4 4220 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100025702911_100000041952 [0,1,0,0,0,1|2,0,0]=4 4221 B16R2.71 Brc1cccnc1NCc2ccccn2 27a_100000210449_100000696092 [0,1,0,0,0,1|2,0,0]=4 4222 B16R2.71 Brc1cccnc1NCc2cccnc2 27a_100000210453_100000696092 [0,1,0,0,0,1|2,0,0]=4 4223 B16R2.71 Brc1cccnc1NCc2cccnn2 27a_100159270163_100000696092 [0,1,0,0,0,1|2,0,0]=4 4224 B16R2.71 Brc1cccnc1NCc2ccncn2 27a_100000736019_100000696092 [0,1,0,0,0,1|1,0,1]=4 4225 B16R2.71 Brc1cccnc1NCc2cnccn2 27a_100000737960_100000696092 [0,1,0,0,0,1|1,0,1]=4 4226 B16R2.71 Brc1cccnc1NCc2cncnc2 27a_100011243677_100000696092 [0,1,0,0,0,1|1,0,1]=4 4227 B16R2.71 Brc1cccnc1NCc2ncccn2 27a_100015189908_100000696092 [0,1,0,0,0,1|2,0,0]=4 4228 B16R2.71 Brc1cnccc1NCc2ccccn2 27a_100000210449_100000726257 [0,1,0,0,0,1|2,0,0]=4 4229 B16R2.71 Brc1cnccc1NCc2cccnc2 27a_100000210453_100000726257 [0,1,0,0,0,1|2,0,0]=4 4230 B16R2.71 Brc1cnccc1NCc2cccnn2 27a_100159270163_100000726257 [0,1,0,0,0,1|2,0,0]=4 4231 B16R2.71 Brc1cnccc1NCc2ccncn2 27a_100000736019_100000726257 [0,1,0,0,0,1|1,0,1]=4 4232 B16R2.71 Brc1cnccc1NCc2cnccn2 27a_100000737960_100000726257 [0,1,0,0,0,1|1,0,1]=4 4233 B16R2.71 Brc1cnccc1NCc2cncnc2 27a_100011243677_100000726257 [0,1,0,0,0,1|1,0,1]=4 4234 B16R2.71 Brc1cnccc1NCc2ncccn2 27a_100015189908_100000726257 [0,1,0,0,0,1|2,0,0]=4 4235 B16R2.71 Brc1ncccc1CNc2ccccc2 34a_100000106764_100010140945 [0,1,0,0,0,1|1,0,0]=3 4236 B16R2.71 Brc1ncccc1COc2ccccc2 34a_100000210340_100010140945 [0,1,0,0,0,1|2,0,0]=4 4237 B16R2.71 Brc1ncccc1COc2ccccc2 7a_100000210340_100010140945 [0,1,0,0,0,1|2,0,0]=4 4238 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100000719477_100010140945 [0,1,0,0,0,1|2,0,0]=4 4239 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100010140945_100000041952 [0,1,0,0,0,1|2,0,0]=4 4240 B16R2.71 Cc1ccccc1CNc2ccccc2 207a_100000106764_100000211143 [0,1,0,0,0,1|2,0,0]=4 4241 B16R2.71 Cc1ccccc1CNc2ccccc2 270302a_100000106764_100000211143 [0,1,0,0,0,1|2,0,0]=4 4242 B16R2.71 Cc1ccccc1CNc2ccccc2 34a_100000106764_100000211839 [0,1,0,0,0,1|2,0,0]=4 4243 B16R2.71 Cc1ccccc1NCc2ccccc2 207a_100015192222_100015611070 [0,1,0,0,0,1|2,0,0]=4 4244 B16R2.71 Cc1ccccc1NCc2ccccc2 270302a_100015192222_100015611070 [0,1,0,0,0,1|2,0,0]=4 4245 B16R2.71 Cc1ccccc1NCc2ccccc2 34a_100015192222_100015291786 [0,1,0,0,0,1|2,0,0]=4 4246 B16R2.71 Cc1ccccc1NCc2ccccn2 207a_100015192222_100000209966 [0,1,0,0,0,1|1,0,0]=3 4247 B16R2.71 Cc1ccccc1NCc2ccccn2 270302a_100015192222_100000209966 [0,1,0,0,0,1|1,0,0]=3 4248 B16R2.71 Cc1ccccc1NCc2ccccn2 34a_100015192222_100000721315 [0,1,0,0,0,1|1,0,0]=3 4249 B16R2.71 Cc1ccccc1NCc2cccnc2 207a_100015192222_100000209961 [0,1,0,0,0,1|1,0,0]=3 4250 B16R2.71 Cc1ccccc1NCc2cccnc2 270302a_100015192222_100000209961 [0,1,0,0,0,1|1,0,0]=3 4251 B16R2.71 Cc1ccccc1NCc2cccnc2 34a_100015192222_100000733263 [0,1,0,0,0,1|1,0,0]=3 4252 B16R2.71 Cc1ccccc1NCc2cccnn2 34a_100015192222_100016990269 [0,1,0,0,0,1|1,0,0]=3 4253 B16R2.71 Cc1ccccc1NCc2ccncc2 207a_100015192222_100000186114 [0,1,0,0,0,1|1,0,1]=4 4254 B16R2.71 Cc1ccccc1NCc2ccnnc2 270302a_100015192222_100011934578 [0,1,0,0,0,1|1,0,1]=4 4255 B16R2.71 Cc1ccccc1NCc2cnccn2 34a_100015192222_100016995436 [0,1,0,0,0,1|0,0,1]=3 4256 B16R2.71 Cc1ccccc1NCc2cncnc2 270302a_100015192222_100000749868 [0,1,0,0,0,1|0,0,1]=3 4257 B16R2.71 Cc1ccccc1NCc2cncnc2 34a_100015192222_100015196519 [0,1,0,0,0,1|0,0,1]=3 4258 B16R2.71 Cc1ccccc1NCc2ncccn2 34a_100015192222_100000703007 [0,1,0,0,0,1|1,0,0]=3 4259 B16R2.71 Cc1ccccc1OCc2ccccn2 34a_100000210338_100000721315 [0,1,0,0,0,1|2,0,0]=4 4260 B16R2.71 Cc1ccccc1OCc2ccccn2 7a_100000210338_100000721315 [0,1,0,0,0,1|2,0,0]=4 4261 B16R2.71 Cc1ccccc1OCc2cccnc2 34a_100000210338_100000733263 [0,1,0,0,0,1|2,0,0]=4 4262 B16R2.71 Cc1ccccc1OCc2cccnc2 7a_100000210338_100000741622 [0,1,0,0,0,1|2,0,0]=4 4263 B16R2.71 Cc1ccccc1OCc2cccnn2 34a_100000210338_100016990269 [0,1,0,0,0,1|2,0,0]=4 4264 B16R2.71 Cc1ccccc1OCc2cccnn2 7a_100000210338_100016990269 [0,1,0,0,0,1|2,0,0]=4 4265 B16R2.71 Cc1ccccc1OCc2cnccn2 34a_100000210338_100016995436 [0,1,0,0,0,1|1,0,1]=4 4266 B16R2.71 Cc1ccccc1OCc2cnccn2 7a_100000210338_100016995436 [0,1,0,0,0,1|1,0,1]=4 4267 B16R2.71 Cc1ccccc1OCc2cncnc2 34a_100000210338_100015196519 [0,1,0,0,0,1|1,0,1]=4 4268 B16R2.71 Cc1ccccc1OCc2cncnc2 7a_100000210338_100015196519 [0,1,0,0,0,1|1,0,1]=4 4269 B16R2.71 Cc1ccccc1OCc2ncccn2 34a_100000210338_100000703007 [0,1,0,0,0,1|2,0,0]=4 4270 B16R2.71 Cc1ccccc1OCc2ncccn2 7a_100000210338_100000703007 [0,1,0,0,0,1|2,0,0]=4 4271 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000210755_100000721315 [0,1,0,0,0,1|2,0,0]=4 4272 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000721315_100000210755 [0,1,0,0,0,1|2,0,0]=4 4273 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000210755_100000741622 [0,1,0,0,0,1|2,0,0]=4 4274 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000741622_100000210755 [0,1,0,0,0,1|2,0,0]=4 4275 B16R2.71 Cc1ccccc1SCc2cccnn2 62a_100000210755_100016990269 [0,1,0,0,0,1|2,0,0]=4 4276 B16R2.71 Cc1ccccc1SCc2cccnn2 62a_100016990269_100000210755 [0,1,0,0,0,1|2,0,0]=4 4277 B16R2.71 Cc1ccccc1SCc2cnccn2 62a_100000210755_100016995436 [0,1,0,0,0,1|1,0,1]=4 4278 B16R2.71 Cc1ccccc1SCc2cnccn2 62a_100016995436_100000210755 [0,1,0,0,0,1|1,0,1]=4 4279 B16R2.71 Cc1ccccc1SCc2cncnc2 62a_100000210755_100015196519 [0,1,0,0,0,1|1,0,1]=4 4280 B16R2.71 Cc1ccccc1SCc2cncnc2 62a_100015196519_100000210755 [0,1,0,0,0,1|1,0,1]=4 4281 B16R2.71 Cc1ccccc1SCc2ncccn2 62a_100000210755_100000703007 [0,1,0,0,0,1|2,0,0]=4 4282 B16R2.71 Cc1ccccc1SCc2ncccn2 62a_100000703007_100000210755 [0,1,0,0,0,1|2,0,0]=4 4283 B16R2.71 Cc1cccnc1CNc2ccccc2 207a_100000106764_100000698913 [0,1,0,0,0,1|1,0,0]=3 4284 B16R2.71 Cc1cccnc1CNc2ccccc2 34a_100000106764_100000696600 [0,1,0,0,0,1|1,0,0]=3 4285 B16R2.71 Cc1cccnc1COc2ccccc2 34a_100000210340_100000696600 [0,1,0,0,0,1|2,0,0]=4 4286 B16R2.71 Cc1cccnc1COc2ccccc2 7a_100000210340_100000696600 [0,1,0,0,0,1|2,0,0]=4 4287 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000696600_100000041952 [0,1,0,0,0,1|2,0,0]=4 4288 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000719477_100000696600 [0,1,0,0,0,1|2,0,0]=4 4289 B16R2.71 Cc1ccncc1CNc2ccccc2 207a_100000106764_100000685662 [0,1,0,0,0,1|1,0,0]=3 4290 B16R2.71 Cc1ccncc1CNc2ccccc2 34a_100000106764_100000690890 [0,1,0,0,0,1|1,0,0]=3 4291 B16R2.71 Cc1ccncc1COc2ccccc2 34a_100000210340_100000690890 [0,1,0,0,0,1|2,0,0]=4 4292 B16R2.71 Cc1ccncc1COc2ccccc2 7a_100000210340_100000690890 [0,1,0,0,0,1|2,0,0]=4 4293 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000690890_100000041952 [0,1,0,0,0,1|2,0,0]=4 4294 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000719477_100000690890 [0,1,0,0,0,1|2,0,0]=4 4295 B16R2.71 Cc1cnccc1CNc2ccccc2 34a_100000106764_100020672809 [0,1,0,0,0,1|1,0,1]=4 4296 B16R2.71 Cc1cnccc1NCc2ccccn2 27a_100000210449_100000765111 [0,1,0,0,0,1|2,0,0]=4 4297 B16R2.71 Cc1cnccc1NCc2cccnc2 27a_100000210453_100000765111 [0,1,0,0,0,1|2,0,0]=4 4298 B16R2.71 Cc1cnccc1NCc2cccnn2 27a_100159270163_100000765111 [0,1,0,0,0,1|2,0,0]=4 4299 B16R2.71 Cc1cnccc1NCc2ccncn2 27a_100000736019_100000765111 [0,1,0,0,0,1|1,0,1]=4 4300 B16R2.71 Cc1cnccc1NCc2cnccn2 27a_100000737960_100000765111 [0,1,0,0,0,1|1,0,1]=4 4301 B16R2.71 Cc1cnccc1NCc2cncnc2 27a_100011243677_100000765111 [0,1,0,0,0,1|1,0,1]=4 4302 B16R2.71 Cc1cnccc1NCc2ncccn2 27a_100015189908_100000765111 [0,1,0,0,0,1|2,0,0]=4 4303 B16R2.71 Cc1ncccc1CNc2ccccc2 207a_100000106764_100000751968 [0,1,0,0,0,1|1,0,0]=3 4304 B16R2.71 Cc1ncccc1CNc2ccccc2 34a_100000106764_100000732876 [0,1,0,0,0,1|1,0,0]=3 4305 B16R2.71 Cc1ncccc1COc2ccccc2 34a_100000210340_100000732876 [0,1,0,0,0,1|2,0,0]=4 4306 B16R2.71 Cc1ncccc1COc2ccccc2 7a_100000210340_100000732876 [0,1,0,0,0,1|2,0,0]=4 4307 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000719477_100000732876 [0,1,0,0,0,1|2,0,0]=4 4308 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000732876_100000041952 [0,1,0,0,0,1|2,0,0]=4 4309 B16R2.71 Clc1ccccc1CNc2ccccc2 207a_100000106764_100000210073 [0,1,0,0,0,1|2,0,0]=4 4310 B16R2.71 Clc1ccccc1CNc2ccccc2 270302a_100000106764_100000210073 [0,1,0,0,0,1|2,0,0]=4 4311 B16R2.71 Clc1ccccc1CNc2ccccc2 34a_100000106764_100000187162 [0,1,0,0,0,1|2,0,0]=4 4312 B16R2.71 Clc1ccccc1NCc2ccccc2 207a_100000185783_100015611070 [0,1,0,0,0,1|2,0,0]=4 4313 B16R2.71 Clc1ccccc1NCc2ccccc2 34a_100000185783_100015291786 [0,1,0,0,0,1|2,0,0]=4 4314 B16R2.71 Clc1ccccc1NCc2ccccn2 207a_100000185783_100000209966 [0,1,0,0,0,1|1,0,0]=3 4315 B16R2.71 Clc1ccccc1NCc2ccccn2 34a_100000185783_100000721315 [0,1,0,0,0,1|1,0,0]=3 4316 B16R2.71 Clc1ccccc1NCc2cccnc2 207a_100000185783_100000209961 [0,1,0,0,0,1|1,0,0]=3 4317 B16R2.71 Clc1ccccc1NCc2cccnc2 34a_100000185783_100000733263 [0,1,0,0,0,1|1,0,0]=3 4318 B16R2.71 Clc1ccccc1NCc2cccnn2 34a_100000185783_100016990269 [0,1,0,0,0,1|1,0,0]=3 4319 B16R2.71 Clc1ccccc1NCc2ccncc2 207a_100000185783_100000186114 [0,1,0,0,0,1|1,0,1]=4 4320 B16R2.71 Clc1ccccc1NCc2cnccn2 34a_100000185783_100016995436 [0,1,0,0,0,1|0,0,1]=3 4321 B16R2.71 Clc1ccccc1NCc2cncnc2 34a_100000185783_100015196519 [0,1,0,0,0,1|0,0,1]=3 4322 B16R2.71 Clc1ccccc1NCc2ncccn2 34a_100000185783_100000703007 [0,1,0,0,0,1|1,0,0]=3 4323 B16R2.71 Clc1ccccc1OCc2ccccn2 34a_100000210172_100000721315 [0,1,0,0,0,1|2,0,0]=4 4324 B16R2.71 Clc1ccccc1OCc2ccccn2 7a_100000210172_100000721315 [0,1,0,0,0,1|2,0,0]=4 4325 B16R2.71 Clc1ccccc1OCc2cccnc2 34a_100000210172_100000733263 [0,1,0,0,0,1|2,0,0]=4 4326 B16R2.71 Clc1ccccc1OCc2cccnc2 7a_100000210172_100000741622 [0,1,0,0,0,1|2,0,0]=4 4327 B16R2.71 Clc1ccccc1OCc2cccnn2 34a_100000210172_100016990269 [0,1,0,0,0,1|2,0,0]=4 4328 B16R2.71 Clc1ccccc1OCc2cccnn2 7a_100000210172_100016990269 [0,1,0,0,0,1|2,0,0]=4 4329 B16R2.71 Clc1ccccc1OCc2cnccn2 34a_100000210172_100016995436 [0,1,0,0,0,1|1,0,1]=4 4330 B16R2.71 Clc1ccccc1OCc2cnccn2 7a_100000210172_100016995436 [0,1,0,0,0,1|1,0,1]=4 4331 B16R2.71 Clc1ccccc1OCc2cncnc2 34a_100000210172_100015196519 [0,1,0,0,0,1|1,0,1]=4 4332 B16R2.71 Clc1ccccc1OCc2cncnc2 7a_100000210172_100015196519 [0,1,0,0,0,1|1,0,1]=4 4333 B16R2.71 Clc1ccccc1OCc2ncccn2 34a_100000210172_100000703007 [0,1,0,0,0,1|2,0,0]=4 4334 B16R2.71 Clc1ccccc1OCc2ncccn2 7a_100000210172_100000703007 [0,1,0,0,0,1|2,0,0]=4 4335 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000721315_100000764095 [0,1,0,0,0,1|2,0,0]=4 4336 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000764095_100000721315 [0,1,0,0,0,1|2,0,0]=4 4337 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000741622_100000764095 [0,1,0,0,0,1|2,0,0]=4 4338 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000764095_100000741622 [0,1,0,0,0,1|2,0,0]=4 4339 B16R2.71 Clc1ccccc1SCc2cccnn2 62a_100000764095_100016990269 [0,1,0,0,0,1|2,0,0]=4 4340 B16R2.71 Clc1ccccc1SCc2cccnn2 62a_100016990269_100000764095 [0,1,0,0,0,1|2,0,0]=4 4341 B16R2.71 Clc1ccccc1SCc2cnccn2 62a_100000764095_100016995436 [0,1,0,0,0,1|1,0,1]=4 4342 B16R2.71 Clc1ccccc1SCc2cnccn2 62a_100016995436_100000764095 [0,1,0,0,0,1|1,0,1]=4 4343 B16R2.71 Clc1ccccc1SCc2cncnc2 62a_100000764095_100015196519 [0,1,0,0,0,1|1,0,1]=4 4344 B16R2.71 Clc1ccccc1SCc2cncnc2 62a_100015196519_100000764095 [0,1,0,0,0,1|1,0,1]=4 4345 B16R2.71 Clc1ccccc1SCc2ncccn2 62a_100000703007_100000764095 [0,1,0,0,0,1|2,0,0]=4 4346 B16R2.71 Clc1ccccc1SCc2ncccn2 62a_100000764095_100000703007 [0,1,0,0,0,1|2,0,0]=4 4347 B16R2.71 Clc1cccnc1CNc2ccccc2 207a_100000106764_100012001307 [0,1,0,0,0,1|1,0,0]=3 4348 B16R2.71 Clc1cccnc1COc2ccccc2 7a_100000210340_100000099807 [0,1,0,0,0,1|2,0,0]=4 4349 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000099807_100000041952 [0,1,0,0,0,1|2,0,0]=4 4350 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000719477_100000099807 [0,1,0,0,0,1|2,0,0]=4 4351 B16R2.71 Clc1cnccc1CNc2ccccc2 207a_100000106764_100011934409 [0,1,0,0,0,1|1,0,1]=4 4352 B16R2.71 Clc1ncccc1CNc2ccccc2 34a_100000106764_100000045678 [0,1,0,0,0,1|1,0,0]=3 4353 B16R2.71 Clc1ncccc1COc2ccccc2 34a_100000210340_100000045678 [0,1,0,0,0,1|2,0,0]=4 4354 B16R2.71 Clc1ncccc1COc2ccccc2 7a_100000210340_100000045678 [0,1,0,0,0,1|2,0,0]=4 4355 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000045678_100000041952 [0,1,0,0,0,1|2,0,0]=4 4356 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000719477_100000045678 [0,1,0,0,0,1|2,0,0]=4 4357 B16R2.71 Fc1ccccc1CNc2ccccc2 207a_100000106764_100000210811 [0,1,0,0,0,1|2,0,0]=4 4358 B16R2.71 Fc1ccccc1CNc2ccccc2 270302a_100000106764_100000210811 [0,1,0,0,0,1|2,0,0]=4 4359 B16R2.71 Fc1ccccc1CNc2ccccc2 34a_100000106764_100000211605 [0,1,0,0,0,1|2,0,0]=4 4360 B16R2.71 Fc1ccccc1NCc2ccccc2 207a_100000210422_100015611070 [0,1,0,0,0,1|2,0,0]=4 4361 B16R2.71 Fc1ccccc1NCc2ccccc2 34a_100000210422_100015291786 [0,1,0,0,0,1|2,0,0]=4 4362 B16R2.71 Fc1ccccc1NCc2ccccn2 207a_100000210422_100000209966 [0,1,0,0,0,1|1,0,0]=3 4363 B16R2.71 Fc1ccccc1NCc2ccccn2 34a_100000210422_100000721315 [0,1,0,0,0,1|1,0,0]=3 4364 B16R2.71 Fc1ccccc1NCc2cccnc2 207a_100000210422_100000209961 [0,1,0,0,0,1|1,0,0]=3 4365 B16R2.71 Fc1ccccc1NCc2cccnc2 34a_100000210422_100000733263 [0,1,0,0,0,1|1,0,0]=3 4366 B16R2.71 Fc1ccccc1NCc2cccnn2 34a_100000210422_100016990269 [0,1,0,0,0,1|1,0,0]=3 4367 B16R2.71 Fc1ccccc1NCc2ccncc2 207a_100000210422_100000186114 [0,1,0,0,0,1|1,0,1]=4 4368 B16R2.71 Fc1ccccc1NCc2cnccn2 34a_100000210422_100016995436 [0,1,0,0,0,1|0,0,1]=3 4369 B16R2.71 Fc1ccccc1NCc2cncnc2 34a_100000210422_100015196519 [0,1,0,0,0,1|0,0,1]=3 4370 B16R2.71 Fc1ccccc1NCc2ncccn2 34a_100000210422_100000703007 [0,1,0,0,0,1|1,0,0]=3 4371 B16R2.71 Fc1ccccc1OCc2ccccn2 34a_100000210171_100000721315 [0,1,0,0,0,1|2,0,0]=4 4372 B16R2.71 Fc1ccccc1OCc2ccccn2 7a_100000210171_100000721315 [0,1,0,0,0,1|2,0,0]=4 4373 B16R2.71 Fc1ccccc1OCc2cccnc2 34a_100000210171_100000733263 [0,1,0,0,0,1|2,0,0]=4 4374 B16R2.71 Fc1ccccc1OCc2cccnc2 7a_100000210171_100000741622 [0,1,0,0,0,1|2,0,0]=4 4375 B16R2.71 Fc1ccccc1OCc2cccnn2 34a_100000210171_100016990269 [0,1,0,0,0,1|2,0,0]=4 4376 B16R2.71 Fc1ccccc1OCc2cccnn2 7a_100000210171_100016990269 [0,1,0,0,0,1|2,0,0]=4 4377 B16R2.71 Fc1ccccc1OCc2cnccn2 34a_100000210171_100016995436 [0,1,0,0,0,1|1,0,1]=4 4378 B16R2.71 Fc1ccccc1OCc2cnccn2 7a_100000210171_100016995436 [0,1,0,0,0,1|1,0,1]=4 4379 B16R2.71 Fc1ccccc1OCc2cncnc2 34a_100000210171_100015196519 [0,1,0,0,0,1|1,0,1]=4 4380 B16R2.71 Fc1ccccc1OCc2cncnc2 7a_100000210171_100015196519 [0,1,0,0,0,1|1,0,1]=4 4381 B16R2.71 Fc1ccccc1OCc2ncccn2 34a_100000210171_100000703007 [0,1,0,0,0,1|2,0,0]=4 4382 B16R2.71 Fc1ccccc1OCc2ncccn2 7a_100000210171_100000703007 [0,1,0,0,0,1|2,0,0]=4 4383 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100000721315_100011215700 [0,1,0,0,0,1|2,0,0]=4 4384 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100011215700_100000721315 [0,1,0,0,0,1|2,0,0]=4 4385 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100000741622_100011215700 [0,1,0,0,0,1|2,0,0]=4 4386 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100011215700_100000741622 [0,1,0,0,0,1|2,0,0]=4 4387 B16R2.71 Fc1ccccc1SCc2cccnn2 62a_100011215700_100016990269 [0,1,0,0,0,1|2,0,0]=4 4388 B16R2.71 Fc1ccccc1SCc2cccnn2 62a_100016990269_100011215700 [0,1,0,0,0,1|2,0,0]=4 4389 B16R2.71 Fc1ccccc1SCc2cnccn2 62a_100011215700_100016995436 [0,1,0,0,0,1|1,0,1]=4 4390 B16R2.71 Fc1ccccc1SCc2cnccn2 62a_100016995436_100011215700 [0,1,0,0,0,1|1,0,1]=4 4391 B16R2.71 Fc1ccccc1SCc2cncnc2 62a_100011215700_100015196519 [0,1,0,0,0,1|1,0,1]=4 4392 B16R2.71 Fc1ccccc1SCc2cncnc2 62a_100015196519_100011215700 [0,1,0,0,0,1|1,0,1]=4 4393 B16R2.71 Fc1ccccc1SCc2ncccn2 62a_100000703007_100011215700 [0,1,0,0,0,1|2,0,0]=4 4394 B16R2.71 Fc1ccccc1SCc2ncccn2 62a_100011215700_100000703007 [0,1,0,0,0,1|2,0,0]=4 4395 B16R2.71 Fc1cccnc1CNc2ccccc2 207a_100000106764_100011934734 [0,1,0,0,0,1|1,0,0]=3 4396 B16R2.71 Fc1cccnc1CNc2ccccc2 34a_100000106764_100000104219 [0,1,0,0,0,1|1,0,0]=3 4397 B16R2.71 Fc1cccnc1COc2ccccc2 34a_100000210340_100000104219 [0,1,0,0,0,1|2,0,0]=4 4398 B16R2.71 Fc1cccnc1COc2ccccc2 7a_100000210340_100000104219 [0,1,0,0,0,1|2,0,0]=4 4399 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000104219_100000041952 [0,1,0,0,0,1|2,0,0]=4 4400 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000719477_100000104219 [0,1,0,0,0,1|2,0,0]=4 4401 B16R2.71 Fc1cnccc1NCc2ccccn2 27a_100000210449_100000035921 [0,1,0,0,0,1|2,0,0]=4 4402 B16R2.71 Fc1cnccc1NCc2cccnc2 27a_100000210453_100000035921 [0,1,0,0,0,1|2,0,0]=4 4403 B16R2.71 Fc1cnccc1NCc2cccnn2 27a_100159270163_100000035921 [0,1,0,0,0,1|2,0,0]=4 4404 B16R2.71 Fc1cnccc1NCc2ccncn2 27a_100000736019_100000035921 [0,1,0,0,0,1|1,0,1]=4 4405 B16R2.71 Fc1cnccc1NCc2cnccn2 27a_100000737960_100000035921 [0,1,0,0,0,1|1,0,1]=4 4406 B16R2.71 Fc1cnccc1NCc2cncnc2 27a_100011243677_100000035921 [0,1,0,0,0,1|1,0,1]=4 4407 B16R2.71 Fc1cnccc1NCc2ncccn2 27a_100015189908_100000035921 [0,1,0,0,0,1|2,0,0]=4 4408 B16R2.71 Fc1ncccc1CNc2ccccc2 34a_100000106764_100000099810 [0,1,0,0,0,1|1,0,0]=3 4409 B16R2.71 Fc1ncccc1COc2ccccc2 34a_100000210340_100000099810 [0,1,0,0,0,1|2,0,0]=4 4410 B16R2.71 Fc1ncccc1COc2ccccc2 7a_100000210340_100000099810 [0,1,0,0,0,1|2,0,0]=4 4411 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000099810_100000041952 [0,1,0,0,0,1|2,0,0]=4 4412 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000719477_100000099810 [0,1,0,0,0,1|2,0,0]=4 4413 B16R2.71 Ic1ccccc1CNc2ccccc2 207a_100000106764_100000010305 [0,1,0,0,0,1|2,0,0]=4 4414 B16R2.71 Ic1ccccc1CNc2ccccc2 34a_100000106764_100011215278 [0,1,0,0,0,1|2,0,0]=4 4415 B16R2.71 Ic1ccccc1NCc2ccccc2 207a_100000210053_100015611070 [0,1,0,0,0,1|2,0,0]=4 4416 B16R2.71 Ic1ccccc1NCc2ccccc2 34a_100000210053_100015291786 [0,1,0,0,0,1|2,0,0]=4 4417 B16R2.71 Ic1ccccc1NCc2ccccn2 207a_100000210053_100000209966 [0,1,0,0,0,1|1,0,0]=3 4418 B16R2.71 Ic1ccccc1NCc2ccccn2 34a_100000210053_100000721315 [0,1,0,0,0,1|1,0,0]=3 4419 B16R2.71 Ic1ccccc1NCc2cccnc2 207a_100000210053_100000209961 [0,1,0,0,0,1|1,0,0]=3 4420 B16R2.71 Ic1ccccc1NCc2cccnc2 34a_100000210053_100000733263 [0,1,0,0,0,1|1,0,0]=3 4421 B16R2.71 Ic1ccccc1NCc2cccnn2 34a_100000210053_100016990269 [0,1,0,0,0,1|1,0,0]=3 4422 B16R2.71 Ic1ccccc1NCc2ccncc2 207a_100000210053_100000186114 [0,1,0,0,0,1|1,0,1]=4 4423 B16R2.71 Ic1ccccc1NCc2cnccn2 34a_100000210053_100016995436 [0,1,0,0,0,1|0,0,1]=3 4424 B16R2.71 Ic1ccccc1NCc2cncnc2 34a_100000210053_100015196519 [0,1,0,0,0,1|0,0,1]=3 4425 B16R2.71 Ic1ccccc1NCc2ncccn2 34a_100000210053_100000703007 [0,1,0,0,0,1|1,0,0]=3 4426 B16R2.71 Ic1ccccc1OCc2ccccn2 34a_100000739446_100000721315 [0,1,0,0,0,1|2,0,0]=4 4427 B16R2.71 Ic1ccccc1OCc2ccccn2 7a_100000739446_100000721315 [0,1,0,0,0,1|2,0,0]=4 4428 B16R2.71 Ic1ccccc1OCc2cccnc2 34a_100000739446_100000733263 [0,1,0,0,0,1|2,0,0]=4 4429 B16R2.71 Ic1ccccc1OCc2cccnc2 7a_100000739446_100000741622 [0,1,0,0,0,1|2,0,0]=4 4430 B16R2.71 Ic1ccccc1OCc2cccnn2 34a_100000739446_100016990269 [0,1,0,0,0,1|2,0,0]=4 4431 B16R2.71 Ic1ccccc1OCc2cccnn2 7a_100000739446_100016990269 [0,1,0,0,0,1|2,0,0]=4 4432 B16R2.71 Ic1ccccc1OCc2cnccn2 34a_100000739446_100016995436 [0,1,0,0,0,1|1,0,1]=4 4433 B16R2.71 Ic1ccccc1OCc2cnccn2 7a_100000739446_100016995436 [0,1,0,0,0,1|1,0,1]=4 4434 B16R2.71 Ic1ccccc1OCc2cncnc2 34a_100000739446_100015196519 [0,1,0,0,0,1|1,0,1]=4 4435 B16R2.71 Ic1ccccc1OCc2cncnc2 7a_100000739446_100015196519 [0,1,0,0,0,1|1,0,1]=4 4436 B16R2.71 Ic1ccccc1OCc2ncccn2 34a_100000739446_100000703007 [0,1,0,0,0,1|2,0,0]=4 4437 B16R2.71 Ic1ccccc1OCc2ncccn2 7a_100000739446_100000703007 [0,1,0,0,0,1|2,0,0]=4 4438 B16R2.71 Nc1ccccc1OCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,0,1|2,0,0]=4 4439 B16R2.71 Nc1ccccc1OCc2ccccn2 7a_100000185747_100000721315 [0,1,0,0,0,1|2,0,0]=4 4440 B16R2.71 Nc1ccccc1OCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,0,1|2,0,0]=4 4441 B16R2.71 Nc1ccccc1OCc2cccnc2 7a_100000185747_100000741622 [0,1,0,0,0,1|2,0,0]=4 4442 B16R2.71 Nc1ccccc1OCc2cccnn2 34a_100000185747_100016990269 [0,1,0,0,0,1|2,0,0]=4 4443 B16R2.71 Nc1ccccc1OCc2cccnn2 7a_100000185747_100016990269 [0,1,0,0,0,1|2,0,0]=4 4444 B16R2.71 Nc1ccccc1OCc2cnccn2 34a_100000185747_100016995436 [0,1,0,0,0,1|1,0,1]=4 4445 B16R2.71 Nc1ccccc1OCc2cnccn2 7a_100000185747_100016995436 [0,1,0,0,0,1|1,0,1]=4 4446 B16R2.71 Nc1ccccc1OCc2cncnc2 34a_100000185747_100015196519 [0,1,0,0,0,1|1,0,1]=4 4447 B16R2.71 Nc1ccccc1OCc2cncnc2 7a_100000185747_100015196519 [0,1,0,0,0,1|1,0,1]=4 4448 B16R2.71 Nc1ccccc1OCc2ncccn2 34a_100000185747_100000703007 [0,1,0,0,0,1|2,0,0]=4 4449 B16R2.71 Nc1ccccc1OCc2ncccn2 7a_100000185747_100000703007 [0,1,0,0,0,1|2,0,0]=4 4450 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000210017_100000721315 [0,1,0,0,0,1|2,0,0]=4 4451 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000721315_100000210017 [0,1,0,0,0,1|2,0,0]=4 4452 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000210017_100000741622 [0,1,0,0,0,1|2,0,0]=4 4453 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000741622_100000210017 [0,1,0,0,0,1|2,0,0]=4 4454 B16R2.71 Nc1ccccc1SCc2cccnn2 62a_100000210017_100016990269 [0,1,0,0,0,1|2,0,0]=4 4455 B16R2.71 Nc1ccccc1SCc2cccnn2 62a_100016990269_100000210017 [0,1,0,0,0,1|2,0,0]=4 4456 B16R2.71 Nc1ccccc1SCc2cnccn2 62a_100000210017_100016995436 [0,1,0,0,0,1|1,0,1]=4 4457 B16R2.71 Nc1ccccc1SCc2cnccn2 62a_100016995436_100000210017 [0,1,0,0,0,1|1,0,1]=4 4458 B16R2.71 Nc1ccccc1SCc2cncnc2 62a_100000210017_100015196519 [0,1,0,0,0,1|1,0,1]=4 4459 B16R2.71 Nc1ccccc1SCc2cncnc2 62a_100015196519_100000210017 [0,1,0,0,0,1|1,0,1]=4 4460 B16R2.71 Nc1ccccc1SCc2ncccn2 62a_100000210017_100000703007 [0,1,0,0,0,1|2,0,0]=4 4461 B16R2.71 Nc1ccccc1SCc2ncccn2 62a_100000703007_100000210017 [0,1,0,0,0,1|2,0,0]=4 4462 B16R2.71 O=c1[nH]ccnc1C#Cc2ccccc2 271570a_100000069678_100000763361 [0,1,0,0,0,1|1,0,1]=4 4463 B16R2.71 O=c1[nH]ccnc1C=Cc2ccccc2 271570a_100102527694_100000763361 [0,1,0,0,0,1|1,0,1]=4 4464 B16R2.71 O=c1[nH]ccnc1SCc2ccccc2 62a_100000211182_100000763361 [0,1,0,0,0,1|2,0,0]=4 4465 B16R2.71 Oc1ccccc1CNc2ccccc2 270302a_100000106764_100000185834 [0,1,0,0,0,1|2,0,0]=4 4466 B16R2.71 Oc1ccccc1NCc2ccccc2 34a_100000185747_100015291786 [0,1,0,0,0,1|2,0,0]=4 4467 B16R2.71 Oc1ccccc1NCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,0,1|1,0,0]=3 4468 B16R2.71 Oc1ccccc1NCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,0,1|1,0,0]=3 4469 B16R2.71 Oc1ccccc1NCc2cccnn2 34a_100000185747_100016990269 [0,1,0,0,0,1|1,0,0]=3 4470 B16R2.71 Oc1ccccc1NCc2cnccn2 34a_100000185747_100016995436 [0,1,0,0,0,1|0,0,1]=3 4471 B16R2.71 Oc1ccccc1NCc2cncnc2 34a_100000185747_100015196519 [0,1,0,0,0,1|0,0,1]=3 4472 B16R2.71 Oc1ccccc1NCc2ncccn2 34a_100000185747_100000703007 [0,1,0,0,0,1|1,0,0]=3 4473 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000721315_100000739446 [0,1,0,0,0,1|2,0,0]=4 4474 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000739446_100000721315 [0,1,0,0,0,1|2,0,0]=4 4475 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000739446_100000741622 [0,1,0,0,0,1|2,0,0]=4 4476 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000741622_100000739446 [0,1,0,0,0,1|2,0,0]=4 4477 B16R2.71 Oc1ccccc1SCc2cccnn2 62a_100000739446_100016990269 [0,1,0,0,0,1|2,0,0]=4 4478 B16R2.71 Oc1ccccc1SCc2cccnn2 62a_100016990269_100000739446 [0,1,0,0,0,1|2,0,0]=4 4479 B16R2.71 Oc1ccccc1SCc2cnccn2 62a_100000739446_100016995436 [0,1,0,0,0,1|1,0,1]=4 4480 B16R2.71 Oc1ccccc1SCc2cnccn2 62a_100016995436_100000739446 [0,1,0,0,0,1|1,0,1]=4 4481 B16R2.71 Oc1ccccc1SCc2cncnc2 62a_100000739446_100015196519 [0,1,0,0,0,1|1,0,1]=4 4482 B16R2.71 Oc1ccccc1SCc2cncnc2 62a_100015196519_100000739446 [0,1,0,0,0,1|1,0,1]=4 4483 B16R2.71 Oc1ccccc1SCc2ncccn2 62a_100000703007_100000739446 [0,1,0,0,0,1|2,0,0]=4 4484 B16R2.71 Oc1ccccc1SCc2ncccn2 62a_100000739446_100000703007 [0,1,0,0,0,1|2,0,0]=4 4485 B16R2.71 Oc1cccnc1CNc2ccccc2 34a_100000106764_200020655725 [0,1,0,0,0,1|1,0,0]=3 4486 B16R2.71 Oc1cccnc1COc2ccccc2 34a_100000210340_200020655725 [0,1,0,0,0,1|2,0,0]=4 4487 B16R2.71 Oc1cccnc1COc2ccccc2 7a_100000210340_200020655725 [0,1,0,0,0,1|2,0,0]=4 4488 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_100000719477_200020655725 [0,1,0,0,0,1|2,0,0]=4 4489 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_200020655725_100000041952 [0,1,0,0,0,1|2,0,0]=4 4490 B16R2.71 Oc1ncccc1CNc2ccccc2 207a_100000106764_100011998315 [0,1,0,0,0,1|1,0,0]=3 4491 B16R2.71 Oc1ncccc1CNc2ccccc2 270302a_100000106764_100011998315 [0,1,0,0,0,1|1,0,0]=3 4492 B16R2.88 CC(Cc1ccccn1)c2ccccc2 271570a_100000062452_100011216584 [0,1,0,0,0,1|2,0,0]=4 4493 B16R2.88 CC(Cc1cccnc1)c2ccccc2 271570a_100000062452_100000752921 [0,1,0,0,0,1|2,0,0]=4 4494 B16R2.88 CC(Cc1cccnn1)c2ccccc2 271570a_100000062452_100016991348 [0,1,0,0,0,1|2,0,0]=4 4495 B16R2.88 CC(Cc1ccncn1)c2ccccc2 271570a_100000062452_100000703185 [0,1,0,0,0,1|1,0,1]=4 4496 B16R2.88 CC(Cc1cnccn1)c2ccccc2 271570a_100000062452_100000758340 [0,1,0,0,0,1|1,0,1]=4 4497 B16R2.88 CC(Cc1cncnc1)c2ccccc2 271570a_100000062452_100011206942 [0,1,0,0,0,1|1,0,1]=4 4498 B16R2.88 CC(Cc1ncccn1)c2ccccc2 271570a_100000062452_100000211032 [0,1,0,0,0,1|2,0,0]=4 4499 B16R2.88 CC(Nc1ccccc1)c2ccccc2 34a_100000106764_100000211855 [0,1,0,0,0,1|2,0,0]=4 4500 B16R2.88 CC(Oc1ccccc1)c2cnccn2 7a_100000210340_200000703233 [0,1,0,0,0,1|1,0,1]=4 4501 B16R2.88 CC(Sc1ccccc1)c2cnccn2 62a_100000719477_200000703233 [0,1,0,0,0,1|1,0,1]=4 4502 B16R2.88 CC(Sc1ccccc1)c2cnccn2 62a_200000703233_100000041952 [0,1,0,0,0,1|1,0,1]=4 4503 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_200000210301 [0,1,0,0,0,1|2,0,0]=4 4504 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000210012_100015291786 [0,1,0,0,0,1|2,0,0]=4 4505 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_200000210301 [0,1,0,0,0,1|2,0,0]=4 4506 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000210012_100000211182 [0,1,0,0,0,1|2,0,0]=4 4507 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000188819_200000210301 [0,1,0,0,0,1|2,0,0]=4 4508 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000210012_100015291786 [0,1,0,0,0,1|2,0,0]=4 4509 B16R2.88 CN(Cc1ccccn1)c2ccccc2 2230a_100000210012_100000721315 [0,1,0,0,0,1|1,0,0]=3 4510 B16R2.88 CN(Cc1ccccn1)c2ccccc2 269982a_100000210012_100000721315 [0,1,0,0,0,1|1,0,0]=3 4511 B16R2.88 CN(Cc1ccccn1)c2ccccc2 34a_100000210012_100000721315 [0,1,0,0,0,1|1,0,0]=3 4512 B16R2.88 CN(Cc1cccnc1)c2ccccc2 2230a_100000210012_100000741622 [0,1,0,0,0,1|1,0,0]=3 4513 B16R2.88 CN(Cc1cccnc1)c2ccccc2 269982a_100000210012_100000733263 [0,1,0,0,0,1|1,0,0]=3 4514 B16R2.88 CN(Cc1cccnc1)c2ccccc2 34a_100000210012_100000733263 [0,1,0,0,0,1|1,0,0]=3 4515 B16R2.88 CN(Cc1cccnn1)c2ccccc2 2230a_100000210012_100016990269 [0,1,0,0,0,1|1,0,0]=3 4516 B16R2.88 CN(Cc1cccnn1)c2ccccc2 34a_100000210012_100016990269 [0,1,0,0,0,1|1,0,0]=3 4517 B16R2.88 CN(Cc1ccncc1)c2ccccc2 2230a_100000210012_100015193705 [0,1,0,0,0,1|1,0,1]=4 4518 B16R2.88 CN(Cc1ccncc1)c2ccccc2 269982a_100000210012_100015193705 [0,1,0,0,0,1|1,0,1]=4 4519 B16R2.88 CN(Cc1cnccn1)c2ccccc2 2230a_100000210012_100016995436 [0,1,0,0,0,1|0,0,1]=3 4520 B16R2.88 CN(Cc1cnccn1)c2ccccc2 269982a_100000210012_100016995436 [0,1,0,0,0,1|0,0,1]=3 4521 B16R2.88 CN(Cc1cnccn1)c2ccccc2 34a_100000210012_100016995436 [0,1,0,0,0,1|0,0,1]=3 4522 B16R2.88 CN(Cc1cncnc1)c2ccccc2 2230a_100000210012_100015196519 [0,1,0,0,0,1|0,0,1]=3 4523 B16R2.88 CN(Cc1cncnc1)c2ccccc2 269982a_100000210012_100016991940 [0,1,0,0,0,1|0,0,1]=3 4524 B16R2.88 CN(Cc1cncnc1)c2ccccc2 34a_100000210012_100015196519 [0,1,0,0,0,1|0,0,1]=3 4525 B16R2.88 CN(Cc1ncccn1)c2ccccc2 2230a_100000210012_100000703007 [0,1,0,0,0,1|1,0,0]=3 4526 B16R2.88 CN(Cc1ncccn1)c2ccccc2 269982a_100000210012_100000703007 [0,1,0,0,0,1|1,0,0]=3 4527 B16R2.88 CN(Cc1ncccn1)c2ccccc2 34a_100000210012_100000703007 [0,1,0,0,0,1|1,0,0]=3 4528 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 1458a_100000185807_100000721315 [0,1,0,0,0,1|2,0,0]=4 4529 B16R2.88 O=C(Cc1cccnc1)c2ccccc2 1458a_100000185807_100000733263 [0,1,0,0,0,1|2,0,0]=4 4530 B16R2.88 O=C(Cc1cccnn1)c2ccccc2 1458a_100000185807_100016990269 [0,1,0,0,0,1|2,0,0]=4 4531 B16R2.88 O=C(Cc1cnccn1)c2ccccc2 1458a_100000185807_100016995436 [0,1,0,0,0,1|1,0,1]=4 4532 B16R2.88 O=C(Cc1cncnc1)c2ccccc2 1458a_100000185807_100015196519 [0,1,0,0,0,1|1,0,1]=4 4533 B16R2.88 O=C(Cc1ncccn1)c2ccccc2 1458a_100000185807_100000703007 [0,1,0,0,0,1|2,0,0]=4 4534 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 2230a_100000188819_200025704644 [0,1,0,0,0,1|2,0,0]=4 4535 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 269982a_100000188819_200025704644 [0,1,0,0,0,1|2,0,0]=4 4536 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 34a_100000188819_200025704644 [0,1,0,0,0,1|2,0,0]=4 4537 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000186029 [0,1,0,0,0,1|2,0,0]=4 4538 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000186029 [0,1,0,0,0,1|2,0,0]=4 4539 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189115 [0,1,0,0,0,1|2,0,0]=4 4540 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 207a_100000210018_100015611070 [0,1,0,0,0,1|2,0,0]=4 4541 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 2230a_100000210018_100015291786 [0,1,0,0,0,1|2,0,0]=4 4542 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 270302a_100000210018_100015611070 [0,1,0,0,0,1|2,0,0]=4 4543 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 34a_100000210018_100015291786 [0,1,0,0,0,1|2,0,0]=4 4544 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 207a_100000210018_100000209966 [0,1,0,0,0,1|1,0,0]=3 4545 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 2230a_100000210018_100000721315 [0,1,0,0,0,1|1,0,0]=3 4546 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 270302a_100000210018_100000209966 [0,1,0,0,0,1|1,0,0]=3 4547 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 34a_100000210018_100000721315 [0,1,0,0,0,1|1,0,0]=3 4548 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 207a_100000210018_100000209961 [0,1,0,0,0,1|1,0,0]=3 4549 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 2230a_100000210018_100000741622 [0,1,0,0,0,1|1,0,0]=3 4550 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 270302a_100000210018_100000209961 [0,1,0,0,0,1|1,0,0]=3 4551 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 34a_100000210018_100000733263 [0,1,0,0,0,1|1,0,0]=3 4552 B16R2.132 Brc1ccc(cc1)NCc2cccnn2 2230a_100000210018_100016990269 [0,1,0,0,0,1|1,0,0]=3 4553 B16R2.132 Brc1ccc(cc1)NCc2cccnn2 34a_100000210018_100016990269 [0,1,0,0,0,1|1,0,0]=3 4554 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 207a_100000210018_100000186114 [0,1,0,0,0,1|1,0,1]=4 4555 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 2230a_100000210018_100015193705 [0,1,0,0,0,1|1,0,1]=4 4556 B16R2.132 Brc1ccc(cc1)NCc2ccnnc2 270302a_100000210018_100011934578 [0,1,0,0,0,1|1,0,1]=4 4557 B16R2.132 Brc1ccc(cc1)NCc2cnccn2 2230a_100000210018_100016995436 [0,1,0,0,0,1|0,0,1]=3 4558 B16R2.132 Brc1ccc(cc1)NCc2cnccn2 34a_100000210018_100016995436 [0,1,0,0,0,1|0,0,1]=3 4559 B16R2.132 Brc1ccc(cc1)NCc2cncnc2 2230a_100000210018_100015196519 [0,1,0,0,0,1|0,0,1]=3 4560 B16R2.132 Brc1ccc(cc1)NCc2cncnc2 270302a_100000210018_100000749868 [0,1,0,0,0,1|0,0,1]=3 4561 B16R2.132 Brc1ccc(cc1)NCc2cncnc2 34a_100000210018_100015196519 [0,1,0,0,0,1|0,0,1]=3 4562 B16R2.132 Brc1ccc(cc1)NCc2ncccn2 2230a_100000210018_100000703007 [0,1,0,0,0,1|1,0,0]=3 4563 B16R2.132 Brc1ccc(cc1)NCc2ncccn2 34a_100000210018_100000703007 [0,1,0,0,0,1|1,0,0]=3 4564 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 34a_100000185759_100000721315 [0,1,0,0,0,1|2,0,0]=4 4565 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 7a_100000185759_100000721315 [0,1,0,0,0,1|2,0,0]=4 4566 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 34a_100000185759_100000733263 [0,1,0,0,0,1|2,0,0]=4 4567 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 7a_100000185759_100000741622 [0,1,0,0,0,1|2,0,0]=4 4568 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 34a_100000185759_100016990269 [0,1,0,0,0,1|2,0,0]=4 4569 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 7a_100000185759_100016990269 [0,1,0,0,0,1|2,0,0]=4 4570 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 34a_100000185759_100016995436 [0,1,0,0,0,1|1,0,1]=4 4571 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 7a_100000185759_100016995436 [0,1,0,0,0,1|1,0,1]=4 4572 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 34a_100000185759_100015196519 [0,1,0,0,0,1|1,0,1]=4 4573 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 7a_100000185759_100015196519 [0,1,0,0,0,1|1,0,1]=4 4574 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 34a_100000185759_100000703007 [0,1,0,0,0,1|2,0,0]=4 4575 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 7a_100000185759_100000703007 [0,1,0,0,0,1|2,0,0]=4 4576 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000752885 [0,1,0,0,0,1|2,0,0]=4 4577 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000752885_100000721315 [0,1,0,0,0,1|2,0,0]=4 4578 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000752885 [0,1,0,0,0,1|2,0,0]=4 4579 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000752885_100000741622 [0,1,0,0,0,1|2,0,0]=4 4580 B16R2.132 Brc1ccc(cc1)SCc2cccnn2 62a_100000752885_100016990269 [0,1,0,0,0,1|2,0,0]=4 4581 B16R2.132 Brc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000752885 [0,1,0,0,0,1|2,0,0]=4 4582 B16R2.132 Brc1ccc(cc1)SCc2cnccn2 62a_100000752885_100016995436 [0,1,0,0,0,1|1,0,1]=4 4583 B16R2.132 Brc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000752885 [0,1,0,0,0,1|1,0,1]=4 4584 B16R2.132 Brc1ccc(cc1)SCc2cncnc2 62a_100000752885_100015196519 [0,1,0,0,0,1|1,0,1]=4 4585 B16R2.132 Brc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000752885 [0,1,0,0,0,1|1,0,1]=4 4586 B16R2.132 Brc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000752885 [0,1,0,0,0,1|2,0,0]=4 4587 B16R2.132 Brc1ccc(cc1)SCc2ncccn2 62a_100000752885_100000703007 [0,1,0,0,0,1|2,0,0]=4 4588 B16R2.132 Brc1ccc(cn1)CNc2ccccc2 34a_100000106764_100009831999 [0,1,0,0,0,1|1,0,0]=3 4589 B16R2.132 Brc1ccc(cn1)COc2ccccc2 34a_100000210340_100009831999 [0,1,0,0,0,1|2,0,0]=4 4590 B16R2.132 Brc1ccc(cn1)COc2ccccc2 7a_100000210340_100009831999 [0,1,0,0,0,1|2,0,0]=4 4591 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100000719477_100009831999 [0,1,0,0,0,1|2,0,0]=4 4592 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100009831999_100000041952 [0,1,0,0,0,1|2,0,0]=4 4593 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000754260 [0,1,0,0,0,1|1,0,0]=3 4594 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100000754260 [0,1,0,0,0,1|1,0,0]=3 4595 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000702658 [0,1,0,0,0,1|1,0,0]=3 4596 B16R2.132 Brc1ccc(nc1)COc2ccccc2 34a_100000210340_100000702658 [0,1,0,0,0,1|2,0,0]=4 4597 B16R2.132 Brc1ccc(nc1)COc2ccccc2 7a_100000210340_100000702658 [0,1,0,0,0,1|2,0,0]=4 4598 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000702658_100000041952 [0,1,0,0,0,1|2,0,0]=4 4599 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000702658 [0,1,0,0,0,1|2,0,0]=4 4600 B16R2.132 Brc1ccc(nc1)NCc2ccccn2 27a_100000210449_100000686858 [0,1,0,0,0,1|2,0,0]=4 4601 B16R2.132 Brc1ccc(nc1)NCc2cccnc2 27a_100000210453_100000686858 [0,1,0,0,0,1|2,0,0]=4 4602 B16R2.132 Brc1ccc(nc1)NCc2cccnn2 27a_100159270163_100000686858 [0,1,0,0,0,1|2,0,0]=4 4603 B16R2.132 Brc1ccc(nc1)NCc2ccncn2 27a_100000736019_100000686858 [0,1,0,0,0,1|1,0,1]=4 4604 B16R2.132 Brc1ccc(nc1)NCc2cnccn2 27a_100000737960_100000686858 [0,1,0,0,0,1|1,0,1]=4 4605 B16R2.132 Brc1ccc(nc1)NCc2cncnc2 27a_100011243677_100000686858 [0,1,0,0,0,1|1,0,1]=4 4606 B16R2.132 Brc1ccc(nc1)NCc2ncccn2 27a_100015189908_100000686858 [0,1,0,0,0,1|2,0,0]=4 4607 B16R2.132 Brc1cnc(nc1)CNc2ccccc2 34a_100000106764_100010064664 [0,1,0,0,0,1|1,0,0]=3 4608 B16R2.132 Brc1cnc(nc1)COc2ccccc2 34a_100000210340_100010064664 [0,1,0,0,0,1|2,0,0]=4 4609 B16R2.132 Brc1cnc(nc1)COc2ccccc2 7a_100000210340_100010064664 [0,1,0,0,0,1|2,0,0]=4 4610 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100000719477_100010064664 [0,1,0,0,0,1|2,0,0]=4 4611 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100010064664_100000041952 [0,1,0,0,0,1|2,0,0]=4 4612 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000211033 [0,1,0,0,0,1|2,0,0]=4 4613 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000211033 [0,1,0,0,0,1|2,0,0]=4 4614 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000210814 [0,1,0,0,0,1|2,0,0]=4 4615 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 207a_100000124888_100015611070 [0,1,0,0,0,1|2,0,0]=4 4616 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 270302a_100000124888_100015611070 [0,1,0,0,0,1|2,0,0]=4 4617 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 34a_100000124888_100015291786 [0,1,0,0,0,1|2,0,0]=4 4618 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 207a_100000124888_100000209966 [0,1,0,0,0,1|1,0,0]=3 4619 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 270302a_100000124888_100000209966 [0,1,0,0,0,1|1,0,0]=3 4620 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 34a_100000124888_100000721315 [0,1,0,0,0,1|1,0,0]=3 4621 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 207a_100000124888_100000209961 [0,1,0,0,0,1|1,0,0]=3 4622 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 270302a_100000124888_100000209961 [0,1,0,0,0,1|1,0,0]=3 4623 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 34a_100000124888_100000733263 [0,1,0,0,0,1|1,0,0]=3 4624 B16R2.132 Cc1ccc(cc1)NCc2cccnn2 34a_100000124888_100016990269 [0,1,0,0,0,1|1,0,0]=3 4625 B16R2.132 Cc1ccc(cc1)NCc2ccncc2 207a_100000124888_100000186114 [0,1,0,0,0,1|1,0,1]=4 4626 B16R2.132 Cc1ccc(cc1)NCc2ccnnc2 270302a_100000124888_100011934578 [0,1,0,0,0,1|1,0,1]=4 4627 B16R2.132 Cc1ccc(cc1)NCc2cnccn2 34a_100000124888_100016995436 [0,1,0,0,0,1|0,0,1]=3 4628 B16R2.132 Cc1ccc(cc1)NCc2cncnc2 270302a_100000124888_100000749868 [0,1,0,0,0,1|0,0,1]=3 4629 B16R2.132 Cc1ccc(cc1)NCc2cncnc2 34a_100000124888_100015196519 [0,1,0,0,0,1|0,0,1]=3 4630 B16R2.132 Cc1ccc(cc1)NCc2ncccn2 34a_100000124888_100000703007 [0,1,0,0,0,1|1,0,0]=3 4631 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 34a_100000210336_100000721315 [0,1,0,0,0,1|2,0,0]=4 4632 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 7a_100000210336_100000721315 [0,1,0,0,0,1|2,0,0]=4 4633 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 34a_100000210336_100000733263 [0,1,0,0,0,1|2,0,0]=4 4634 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 7a_100000210336_100000741622 [0,1,0,0,0,1|2,0,0]=4 4635 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 34a_100000210336_100016990269 [0,1,0,0,0,1|2,0,0]=4 4636 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 7a_100000210336_100016990269 [0,1,0,0,0,1|2,0,0]=4 4637 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 34a_100000210336_100016995436 [0,1,0,0,0,1|1,0,1]=4 4638 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 7a_100000210336_100016995436 [0,1,0,0,0,1|1,0,1]=4 4639 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 34a_100000210336_100015196519 [0,1,0,0,0,1|1,0,1]=4 4640 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 7a_100000210336_100015196519 [0,1,0,0,0,1|1,0,1]=4 4641 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 34a_100000210336_100000703007 [0,1,0,0,0,1|2,0,0]=4 4642 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 7a_100000210336_100000703007 [0,1,0,0,0,1|2,0,0]=4 4643 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000186775_100000721315 [0,1,0,0,0,1|2,0,0]=4 4644 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000186775 [0,1,0,0,0,1|2,0,0]=4 4645 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000186775_100000741622 [0,1,0,0,0,1|2,0,0]=4 4646 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000186775 [0,1,0,0,0,1|2,0,0]=4 4647 B16R2.132 Cc1ccc(cc1)SCc2cccnn2 62a_100000186775_100016990269 [0,1,0,0,0,1|2,0,0]=4 4648 B16R2.132 Cc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000186775 [0,1,0,0,0,1|2,0,0]=4 4649 B16R2.132 Cc1ccc(cc1)SCc2cnccn2 62a_100000186775_100016995436 [0,1,0,0,0,1|1,0,1]=4 4650 B16R2.132 Cc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000186775 [0,1,0,0,0,1|1,0,1]=4 4651 B16R2.132 Cc1ccc(cc1)SCc2cncnc2 62a_100000186775_100015196519 [0,1,0,0,0,1|1,0,1]=4 4652 B16R2.132 Cc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000186775 [0,1,0,0,0,1|1,0,1]=4 4653 B16R2.132 Cc1ccc(cc1)SCc2ncccn2 62a_100000186775_100000703007 [0,1,0,0,0,1|2,0,0]=4 4654 B16R2.132 Cc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000186775 [0,1,0,0,0,1|2,0,0]=4 4655 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000743784 [0,1,0,0,0,1|1,0,0]=3 4656 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 34a_100000106764_100016987292 [0,1,0,0,0,1|1,0,0]=3 4657 B16R2.132 Cc1ccc(cn1)COc2ccccc2 34a_100000210340_100016987292 [0,1,0,0,0,1|2,0,0]=4 4658 B16R2.132 Cc1ccc(cn1)COc2ccccc2 7a_100000210340_100016987292 [0,1,0,0,0,1|2,0,0]=4 4659 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100000719477_100016987292 [0,1,0,0,0,1|2,0,0]=4 4660 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100016987292_100000041952 [0,1,0,0,0,1|2,0,0]=4 4661 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000050478 [0,1,0,0,0,1|1,0,0]=3 4662 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000691093 [0,1,0,0,0,1|1,0,0]=3 4663 B16R2.132 Cc1ccc(nc1)COc2ccccc2 34a_100000210340_100000691093 [0,1,0,0,0,1|2,0,0]=4 4664 B16R2.132 Cc1ccc(nc1)COc2ccccc2 7a_100000210340_100000691093 [0,1,0,0,0,1|2,0,0]=4 4665 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000691093_100000041952 [0,1,0,0,0,1|2,0,0]=4 4666 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000691093 [0,1,0,0,0,1|2,0,0]=4 4667 B16R2.132 Cc1cnc(cn1)COc2ccccc2 7a_100000210340_100000752025 [0,1,0,0,0,1|1,0,1]=4 4668 B16R2.132 Cc1cnc(cn1)CSc2ccccc2 62a_100000719477_100000752025 [0,1,0,0,0,1|1,0,1]=4 4669 B16R2.132 Cc1cnc(cn1)CSc2ccccc2 62a_100000752025_100000041952 [0,1,0,0,0,1|1,0,1]=4 4670 B16R2.132 Cc1cnc(nc1)CNc2ccccc2 34a_100000106764_100000685645 [0,1,0,0,0,1|1,0,0]=3 4671 B16R2.132 Cc1cnc(nc1)COc2ccccc2 34a_100000210340_100000685645 [0,1,0,0,0,1|2,0,0]=4 4672 B16R2.132 Cc1cnc(nc1)COc2ccccc2 7a_100000210340_100000685645 [0,1,0,0,0,1|2,0,0]=4 4673 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000685645_100000041952 [0,1,0,0,0,1|2,0,0]=4 4674 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000719477_100000685645 [0,1,0,0,0,1|2,0,0]=4 4675 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000189385 [0,1,0,0,0,1|2,0,0]=4 4676 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000189385 [0,1,0,0,0,1|2,0,0]=4 4677 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000694040 [0,1,0,0,0,1|2,0,0]=4 4678 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 207a_100000210052_100015611070 [0,1,0,0,0,1|2,0,0]=4 4679 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 2230a_100000210052_100015291786 [0,1,0,0,0,1|2,0,0]=4 4680 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 270302a_100000210052_100015611070 [0,1,0,0,0,1|2,0,0]=4 4681 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 34a_100000210052_100015291786 [0,1,0,0,0,1|2,0,0]=4 4682 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 207a_100000210052_100000209966 [0,1,0,0,0,1|1,0,0]=3 4683 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 2230a_100000210052_100000721315 [0,1,0,0,0,1|1,0,0]=3 4684 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 270302a_100000210052_100000209966 [0,1,0,0,0,1|1,0,0]=3 4685 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 34a_100000210052_100000721315 [0,1,0,0,0,1|1,0,0]=3 4686 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 207a_100000210052_100000209961 [0,1,0,0,0,1|1,0,0]=3 4687 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 2230a_100000210052_100000741622 [0,1,0,0,0,1|1,0,0]=3 4688 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 270302a_100000210052_100000209961 [0,1,0,0,0,1|1,0,0]=3 4689 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 34a_100000210052_100000733263 [0,1,0,0,0,1|1,0,0]=3 4690 B16R2.132 Clc1ccc(cc1)NCc2cccnn2 2230a_100000210052_100016990269 [0,1,0,0,0,1|1,0,0]=3 4691 B16R2.132 Clc1ccc(cc1)NCc2cccnn2 34a_100000210052_100016990269 [0,1,0,0,0,1|1,0,0]=3 4692 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 207a_100000210052_100000186114 [0,1,0,0,0,1|1,0,1]=4 4693 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 2230a_100000210052_100015193705 [0,1,0,0,0,1|1,0,1]=4 4694 B16R2.132 Clc1ccc(cc1)NCc2ccnnc2 270302a_100000210052_100011934578 [0,1,0,0,0,1|1,0,1]=4 4695 B16R2.132 Clc1ccc(cc1)NCc2cnccn2 2230a_100000210052_100016995436 [0,1,0,0,0,1|0,0,1]=3 4696 B16R2.132 Clc1ccc(cc1)NCc2cnccn2 34a_100000210052_100016995436 [0,1,0,0,0,1|0,0,1]=3 4697 B16R2.132 Clc1ccc(cc1)NCc2cncnc2 2230a_100000210052_100015196519 [0,1,0,0,0,1|0,0,1]=3 4698 B16R2.132 Clc1ccc(cc1)NCc2cncnc2 270302a_100000210052_100000749868 [0,1,0,0,0,1|0,0,1]=3 4699 B16R2.132 Clc1ccc(cc1)NCc2cncnc2 34a_100000210052_100015196519 [0,1,0,0,0,1|0,0,1]=3 4700 B16R2.132 Clc1ccc(cc1)NCc2ncccn2 2230a_100000210052_100000703007 [0,1,0,0,0,1|1,0,0]=3 4701 B16R2.132 Clc1ccc(cc1)NCc2ncccn2 34a_100000210052_100000703007 [0,1,0,0,0,1|1,0,0]=3 4702 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 34a_100000210216_100000721315 [0,1,0,0,0,1|2,0,0]=4 4703 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 7a_100000210216_100000721315 [0,1,0,0,0,1|2,0,0]=4 4704 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 34a_100000210216_100000733263 [0,1,0,0,0,1|2,0,0]=4 4705 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 7a_100000210216_100000741622 [0,1,0,0,0,1|2,0,0]=4 4706 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 34a_100000210216_100016990269 [0,1,0,0,0,1|2,0,0]=4 4707 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 7a_100000210216_100016990269 [0,1,0,0,0,1|2,0,0]=4 4708 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 34a_100000210216_100016995436 [0,1,0,0,0,1|1,0,1]=4 4709 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 7a_100000210216_100016995436 [0,1,0,0,0,1|1,0,1]=4 4710 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 34a_100000210216_100015196519 [0,1,0,0,0,1|1,0,1]=4 4711 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 7a_100000210216_100015196519 [0,1,0,0,0,1|1,0,1]=4 4712 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 34a_100000210216_100000703007 [0,1,0,0,0,1|2,0,0]=4 4713 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 7a_100000210216_100000703007 [0,1,0,0,0,1|2,0,0]=4 4714 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000755918 [0,1,0,0,0,1|2,0,0]=4 4715 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000755918_100000721315 [0,1,0,0,0,1|2,0,0]=4 4716 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000755918 [0,1,0,0,0,1|2,0,0]=4 4717 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000755918_100000741622 [0,1,0,0,0,1|2,0,0]=4 4718 B16R2.132 Clc1ccc(cc1)SCc2cccnn2 62a_100000755918_100016990269 [0,1,0,0,0,1|2,0,0]=4 4719 B16R2.132 Clc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000755918 [0,1,0,0,0,1|2,0,0]=4 4720 B16R2.132 Clc1ccc(cc1)SCc2cnccn2 62a_100000755918_100016995436 [0,1,0,0,0,1|1,0,1]=4 4721 B16R2.132 Clc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000755918 [0,1,0,0,0,1|1,0,1]=4 4722 B16R2.132 Clc1ccc(cc1)SCc2cncnc2 62a_100000755918_100015196519 [0,1,0,0,0,1|1,0,1]=4 4723 B16R2.132 Clc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000755918 [0,1,0,0,0,1|1,0,1]=4 4724 B16R2.132 Clc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000755918 [0,1,0,0,0,1|2,0,0]=4 4725 B16R2.132 Clc1ccc(cc1)SCc2ncccn2 62a_100000755918_100000703007 [0,1,0,0,0,1|2,0,0]=4 4726 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000766901 [0,1,0,0,0,1|1,0,0]=3 4727 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000735431 [0,1,0,0,0,1|1,0,0]=3 4728 B16R2.132 Clc1ccc(cn1)COc2ccccc2 34a_100000210340_100000735431 [0,1,0,0,0,1|2,0,0]=4 4729 B16R2.132 Clc1ccc(cn1)COc2ccccc2 7a_100000210340_100000735431 [0,1,0,0,0,1|2,0,0]=4 4730 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000735431 [0,1,0,0,0,1|2,0,0]=4 4731 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000735431_100000041952 [0,1,0,0,0,1|2,0,0]=4 4732 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011361569 [0,1,0,0,0,1|1,0,0]=3 4733 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100011361569 [0,1,0,0,0,1|1,0,0]=3 4734 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 34a_100000106764_100012066911 [0,1,0,0,0,1|1,0,0]=3 4735 B16R2.132 Clc1ccc(nc1)COc2ccccc2 34a_100000210340_100012066911 [0,1,0,0,0,1|2,0,0]=4 4736 B16R2.132 Clc1ccc(nc1)COc2ccccc2 7a_100000210340_100012066911 [0,1,0,0,0,1|2,0,0]=4 4737 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000697101 [0,1,0,0,0,1|2,0,0]=4 4738 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100012066911_100000041952 [0,1,0,0,0,1|2,0,0]=4 4739 B16R2.132 Clc1ccc(nn1)CNc2ccccc2 34a_100000106764_100016992710 [0,1,0,0,0,1|1,0,0]=3 4740 B16R2.132 Clc1ccc(nn1)COc2ccccc2 34a_100000210340_100016992710 [0,1,0,0,0,1|2,0,0]=4 4741 B16R2.132 Clc1ccc(nn1)COc2ccccc2 7a_100000210340_100016992710 [0,1,0,0,0,1|2,0,0]=4 4742 B16R2.132 Clc1ccc(nn1)CSc2ccccc2 62a_100000719477_100016992710 [0,1,0,0,0,1|2,0,0]=4 4743 B16R2.132 Clc1ccc(nn1)CSc2ccccc2 62a_100016992710_100000041952 [0,1,0,0,0,1|2,0,0]=4 4744 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000210084 [0,1,0,0,0,1|2,0,0]=4 4745 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000210084 [0,1,0,0,0,1|2,0,0]=4 4746 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000198546 [0,1,0,0,0,1|2,0,0]=4 4747 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 207a_100000185862_100015611070 [0,1,0,0,0,1|2,0,0]=4 4748 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 270302a_100000185862_100015611070 [0,1,0,0,0,1|2,0,0]=4 4749 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 34a_100000185862_100015291786 [0,1,0,0,0,1|2,0,0]=4 4750 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 207a_100000185862_100000209966 [0,1,0,0,0,1|1,0,0]=3 4751 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 270302a_100000185862_100000209966 [0,1,0,0,0,1|1,0,0]=3 4752 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 34a_100000185862_100000721315 [0,1,0,0,0,1|1,0,0]=3 4753 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 207a_100000185862_100000209961 [0,1,0,0,0,1|1,0,0]=3 4754 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 270302a_100000185862_100000209961 [0,1,0,0,0,1|1,0,0]=3 4755 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 34a_100000185862_100000733263 [0,1,0,0,0,1|1,0,0]=3 4756 B16R2.132 Fc1ccc(cc1)NCc2cccnn2 34a_100000185862_100016990269 [0,1,0,0,0,1|1,0,0]=3 4757 B16R2.132 Fc1ccc(cc1)NCc2ccncc2 207a_100000185862_100000186114 [0,1,0,0,0,1|1,0,1]=4 4758 B16R2.132 Fc1ccc(cc1)NCc2ccnnc2 270302a_100000185862_100011934578 [0,1,0,0,0,1|1,0,1]=4 4759 B16R2.132 Fc1ccc(cc1)NCc2cnccn2 34a_100000185862_100016995436 [0,1,0,0,0,1|0,0,1]=3 4760 B16R2.132 Fc1ccc(cc1)NCc2cncnc2 270302a_100000185862_100000749868 [0,1,0,0,0,1|0,0,1]=3 4761 B16R2.132 Fc1ccc(cc1)NCc2cncnc2 34a_100000185862_100015196519 [0,1,0,0,0,1|0,0,1]=3 4762 B16R2.132 Fc1ccc(cc1)NCc2ncccn2 34a_100000185862_100000703007 [0,1,0,0,0,1|1,0,0]=3 4763 B16R2.132 Fc1ccc(cc1)OCc2ccccn2 34a_100000210339_100000721315 [0,1,0,0,0,1|2,0,0]=4 4764 B16R2.132 Fc1ccc(cc1)OCc2cccnc2 34a_100000210339_100000733263 [0,1,0,0,0,1|2,0,0]=4 4765 B16R2.132 Fc1ccc(cc1)OCc2cccnn2 34a_100000210339_100016990269 [0,1,0,0,0,1|2,0,0]=4 4766 B16R2.132 Fc1ccc(cc1)OCc2cnccn2 34a_100000210339_100016995436 [0,1,0,0,0,1|1,0,1]=4 4767 B16R2.132 Fc1ccc(cc1)OCc2cncnc2 34a_100000210339_100015196519 [0,1,0,0,0,1|1,0,1]=4 4768 B16R2.132 Fc1ccc(cc1)OCc2ncccn2 34a_100000210339_100000703007 [0,1,0,0,0,1|2,0,0]=4 4769 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000211213_100000721315 [0,1,0,0,0,1|2,0,0]=4 4770 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000211213 [0,1,0,0,0,1|2,0,0]=4 4771 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000211213_100000741622 [0,1,0,0,0,1|2,0,0]=4 4772 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000211213 [0,1,0,0,0,1|2,0,0]=4 4773 B16R2.132 Fc1ccc(cc1)SCc2cccnn2 62a_100000211213_100016990269 [0,1,0,0,0,1|2,0,0]=4 4774 B16R2.132 Fc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000211213 [0,1,0,0,0,1|2,0,0]=4 4775 B16R2.132 Fc1ccc(cc1)SCc2cnccn2 62a_100000211213_100016995436 [0,1,0,0,0,1|1,0,1]=4 4776 B16R2.132 Fc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000211213 [0,1,0,0,0,1|1,0,1]=4 4777 B16R2.132 Fc1ccc(cc1)SCc2cncnc2 62a_100000211213_100015196519 [0,1,0,0,0,1|1,0,1]=4 4778 B16R2.132 Fc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000211213 [0,1,0,0,0,1|1,0,1]=4 4779 B16R2.132 Fc1ccc(cc1)SCc2ncccn2 62a_100000211213_100000703007 [0,1,0,0,0,1|2,0,0]=4 4780 B16R2.132 Fc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000211213 [0,1,0,0,0,1|2,0,0]=4 4781 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000068566 [0,1,0,0,0,1|1,0,0]=3 4782 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000099788 [0,1,0,0,0,1|1,0,0]=3 4783 B16R2.132 Fc1ccc(cn1)COc2ccccc2 34a_100000210340_100000099788 [0,1,0,0,0,1|2,0,0]=4 4784 B16R2.132 Fc1ccc(cn1)COc2ccccc2 7a_100000210340_100009820150 [0,1,0,0,0,1|2,0,0]=4 4785 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000099788 [0,1,0,0,0,1|2,0,0]=4 4786 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100009820150_100000041952 [0,1,0,0,0,1|2,0,0]=4 4787 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011934744 [0,1,0,0,0,1|1,0,0]=3 4788 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000703193 [0,1,0,0,0,1|1,0,0]=3 4789 B16R2.132 Fc1ccc(nc1)COc2ccccc2 34a_100000210340_100000703193 [0,1,0,0,0,1|2,0,0]=4 4790 B16R2.132 Fc1ccc(nc1)COc2ccccc2 7a_100000210340_100000703193 [0,1,0,0,0,1|2,0,0]=4 4791 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000703193_100000041952 [0,1,0,0,0,1|2,0,0]=4 4792 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000703193 [0,1,0,0,0,1|2,0,0]=4 4793 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 207a_100000106764_100000188517 [0,1,0,0,0,1|2,0,0]=4 4794 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000188517 [0,1,0,0,0,1|2,0,0]=4 4795 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189116 [0,1,0,0,0,1|2,0,0]=4 4796 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 207a_100000185761_100015611070 [0,1,0,0,0,1|2,0,0]=4 4797 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 270302a_100000185761_100015611070 [0,1,0,0,0,1|2,0,0]=4 4798 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 34a_100000185761_100015291786 [0,1,0,0,0,1|2,0,0]=4 4799 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 207a_100000185761_100000209966 [0,1,0,0,0,1|1,0,0]=3 4800 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 270302a_100000185761_100000209966 [0,1,0,0,0,1|1,0,0]=3 4801 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 34a_100000185761_100000721315 [0,1,0,0,0,1|1,0,0]=3 4802 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 207a_100000185761_100000209961 [0,1,0,0,0,1|1,0,0]=3 4803 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 270302a_100000185761_100000209961 [0,1,0,0,0,1|1,0,0]=3 4804 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 34a_100000185761_100000733263 [0,1,0,0,0,1|1,0,0]=3 4805 B16R2.132 Ic1ccc(cc1)NCc2cccnn2 34a_100000185761_100016990269 [0,1,0,0,0,1|1,0,0]=3 4806 B16R2.132 Ic1ccc(cc1)NCc2ccncc2 207a_100000185761_100000186114 [0,1,0,0,0,1|1,0,1]=4 4807 B16R2.132 Ic1ccc(cc1)NCc2ccnnc2 270302a_100000185761_100011934578 [0,1,0,0,0,1|1,0,1]=4 4808 B16R2.132 Ic1ccc(cc1)NCc2cnccn2 34a_100000185761_100016995436 [0,1,0,0,0,1|0,0,1]=3 4809 B16R2.132 Ic1ccc(cc1)NCc2cncnc2 270302a_100000185761_100000749868 [0,1,0,0,0,1|0,0,1]=3 4810 B16R2.132 Ic1ccc(cc1)NCc2cncnc2 34a_100000185761_100015196519 [0,1,0,0,0,1|0,0,1]=3 4811 B16R2.132 Ic1ccc(cc1)NCc2ncccn2 34a_100000185761_100000703007 [0,1,0,0,0,1|1,0,0]=3 4812 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 34a_100000212066_100000721315 [0,1,0,0,0,1|2,0,0]=4 4813 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 7a_100000212066_100000721315 [0,1,0,0,0,1|2,0,0]=4 4814 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 34a_100000212066_100000733263 [0,1,0,0,0,1|2,0,0]=4 4815 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 7a_100000212066_100000741622 [0,1,0,0,0,1|2,0,0]=4 4816 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 34a_100000212066_100016990269 [0,1,0,0,0,1|2,0,0]=4 4817 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 7a_100000212066_100016990269 [0,1,0,0,0,1|2,0,0]=4 4818 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 34a_100000212066_100016995436 [0,1,0,0,0,1|1,0,1]=4 4819 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 7a_100000212066_100016995436 [0,1,0,0,0,1|1,0,1]=4 4820 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 34a_100000212066_100015196519 [0,1,0,0,0,1|1,0,1]=4 4821 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 7a_100000212066_100015196519 [0,1,0,0,0,1|1,0,1]=4 4822 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 34a_100000212066_100000703007 [0,1,0,0,0,1|2,0,0]=4 4823 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 7a_100000212066_100000703007 [0,1,0,0,0,1|2,0,0]=4 4824 B16R2.132 Nc1ccc(cc1)OCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,0,1|2,0,0]=4 4825 B16R2.132 Nc1ccc(cc1)OCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,0,1|2,0,0]=4 4826 B16R2.132 Nc1ccc(cc1)OCc2cccnn2 34a_100000185829_100016990269 [0,1,0,0,0,1|2,0,0]=4 4827 B16R2.132 Nc1ccc(cc1)OCc2cnccn2 34a_100000185829_100016995436 [0,1,0,0,0,1|1,0,1]=4 4828 B16R2.132 Nc1ccc(cc1)OCc2cncnc2 34a_100000185829_100015196519 [0,1,0,0,0,1|1,0,1]=4 4829 B16R2.132 Nc1ccc(cc1)OCc2ncccn2 34a_100000185829_100000703007 [0,1,0,0,0,1|2,0,0]=4 4830 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000185761_100000721315 [0,1,0,0,0,1|2,0,0]=4 4831 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185761 [0,1,0,0,0,1|2,0,0]=4 4832 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000185761_100000741622 [0,1,0,0,0,1|2,0,0]=4 4833 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185761 [0,1,0,0,0,1|2,0,0]=4 4834 B16R2.132 Nc1ccc(cc1)SCc2cccnn2 62a_100000185761_100016990269 [0,1,0,0,0,1|2,0,0]=4 4835 B16R2.132 Nc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000185761 [0,1,0,0,0,1|2,0,0]=4 4836 B16R2.132 Nc1ccc(cc1)SCc2cnccn2 62a_100000185761_100016995436 [0,1,0,0,0,1|1,0,1]=4 4837 B16R2.132 Nc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000185761 [0,1,0,0,0,1|1,0,1]=4 4838 B16R2.132 Nc1ccc(cc1)SCc2cncnc2 62a_100000185761_100015196519 [0,1,0,0,0,1|1,0,1]=4 4839 B16R2.132 Nc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000185761 [0,1,0,0,0,1|1,0,1]=4 4840 B16R2.132 Nc1ccc(cc1)SCc2ncccn2 62a_100000185761_100000703007 [0,1,0,0,0,1|2,0,0]=4 4841 B16R2.132 Nc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000185761 [0,1,0,0,0,1|2,0,0]=4 4842 B16R2.132 O=c1ccc(n[nH]1)CNc2ccccc2 207a_100000106764_100011361533 [0,1,0,0,0,1|1,0,0]=3 4843 B16R2.132 O=c1ncc(c[nH]1)C#Cc2ccccc2 271570a_100000069678_102495366499 [0,1,0,0,0,1|1,0,1]=4 4844 B16R2.132 O=c1ncc(c[nH]1)C=Cc2ccccc2 271570a_100102527694_102495366499 [0,1,0,0,0,1|1,0,1]=4 4845 B16R2.132 O=c1ncc(c[nH]1)SCc2ccccc2 62a_100000211182_102495366499 [0,1,0,0,0,1|2,0,0]=4 4846 B16R2.132 O=c1ncc(c[nH]1)SCc2ccccc2 62a_102495366499_100015291786 [0,1,0,0,0,1|2,0,0]=4 4847 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 270302a_100000185829_100015611070 [0,1,0,0,0,1|2,0,0]=4 4848 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 271570a_203496583355_100000187040 [0,1,0,0,0,1|2,0,0]=4 4849 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 34a_100000185829_100015291786 [0,1,0,0,0,1|2,0,0]=4 4850 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 270302a_100000185829_100000209966 [0,1,0,0,0,1|1,0,0]=3 4851 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 271570a_203496583355_100000238286 [0,1,0,0,0,1|1,0,0]=3 4852 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,0,1|1,0,0]=3 4853 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 270302a_100000185829_100000209961 [0,1,0,0,0,1|1,0,0]=3 4854 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 271570a_203496583355_100000189165 [0,1,0,0,0,1|1,0,0]=3 4855 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,0,1|1,0,0]=3 4856 B16R2.132 Oc1ccc(cc1)NCc2cccnn2 34a_100000185829_100016990269 [0,1,0,0,0,1|1,0,0]=3 4857 B16R2.132 Oc1ccc(cc1)NCc2ccnnc2 270302a_100000185829_100011934578 [0,1,0,0,0,1|1,0,1]=4 4858 B16R2.132 Oc1ccc(cc1)NCc2cnccn2 34a_100000185829_100016995436 [0,1,0,0,0,1|0,0,1]=3 4859 B16R2.132 Oc1ccc(cc1)NCc2cncnc2 270302a_100000185829_100000749868 [0,1,0,0,0,1|0,0,1]=3 4860 B16R2.132 Oc1ccc(cc1)NCc2cncnc2 34a_100000185829_100015196519 [0,1,0,0,0,1|0,0,1]=3 4861 B16R2.132 Oc1ccc(cc1)NCc2ncccn2 34a_100000185829_100000703007 [0,1,0,0,0,1|1,0,0]=3 4862 B16R2.132 Oc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185759 [0,1,0,0,0,1|2,0,0]=4 4863 B16R2.132 Oc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185759 [0,1,0,0,0,1|2,0,0]=4 4864 B16R2.132 Oc1ccc(cc1)SCc2cccnn2 62a_100016990269_100000185759 [0,1,0,0,0,1|2,0,0]=4 4865 B16R2.132 Oc1ccc(cc1)SCc2cnccn2 62a_100016995436_100000185759 [0,1,0,0,0,1|1,0,1]=4 4866 B16R2.132 Oc1ccc(cc1)SCc2cncnc2 62a_100015196519_100000185759 [0,1,0,0,0,1|1,0,1]=4 4867 B16R2.132 Oc1ccc(cc1)SCc2ncccn2 62a_100000703007_100000185759 [0,1,0,0,0,1|2,0,0]=4 4868 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 207a_100000106764_100011361521 [0,1,0,0,0,1|1,0,0]=3 4869 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100011361521 [0,1,0,0,0,1|1,0,0]=3 4870 B16R2.252 Brc1cc(ccn1)CNc2ccccc2 34a_100000106764_100010243470 [0,1,0,0,0,1|1,0,1]=4 4871 B16R2.252 Brc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210085 [0,1,0,0,0,1|2,0,0]=4 4872 B16R2.252 Brc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210085 [0,1,0,0,0,1|2,0,0]=4 4873 B16R2.252 Brc1cccc(c1)CNc2ccccc2 34a_100000106764_100000698116 [0,1,0,0,0,1|2,0,0]=4 4874 B16R2.252 Brc1cccc(c1)NCc2ccccc2 207a_100000210019_100015611070 [0,1,0,0,0,1|2,0,0]=4 4875 B16R2.252 Brc1cccc(c1)NCc2ccccc2 270302a_100000210019_100015611070 [0,1,0,0,0,1|2,0,0]=4 4876 B16R2.252 Brc1cccc(c1)NCc2ccccc2 34a_100000210019_100015291786 [0,1,0,0,0,1|2,0,0]=4 4877 B16R2.252 Brc1cccc(c1)NCc2ccccn2 207a_100000210019_100000209966 [0,1,0,0,0,1|1,0,0]=3 4878 B16R2.252 Brc1cccc(c1)NCc2ccccn2 270302a_100000210019_100000209966 [0,1,0,0,0,1|1,0,0]=3 4879 B16R2.252 Brc1cccc(c1)NCc2ccccn2 34a_100000210019_100000721315 [0,1,0,0,0,1|1,0,0]=3 4880 B16R2.252 Brc1cccc(c1)NCc2cccnc2 207a_100000210019_100000209961 [0,1,0,0,0,1|1,0,0]=3 4881 B16R2.252 Brc1cccc(c1)NCc2cccnc2 270302a_100000210019_100000209961 [0,1,0,0,0,1|1,0,0]=3 4882 B16R2.252 Brc1cccc(c1)NCc2cccnc2 34a_100000210019_100000733263 [0,1,0,0,0,1|1,0,0]=3 4883 B16R2.252 Brc1cccc(c1)NCc2cccnn2 34a_100000210019_100016990269 [0,1,0,0,0,1|1,0,0]=3 4884 B16R2.252 Brc1cccc(c1)NCc2ccncc2 207a_100000210019_100000186114 [0,1,0,0,0,1|1,0,1]=4 4885 B16R2.252 Brc1cccc(c1)NCc2ccnnc2 270302a_100000210019_100011934578 [0,1,0,0,0,1|1,0,1]=4 4886 B16R2.252 Brc1cccc(c1)NCc2cnccn2 34a_100000210019_100016995436 [0,1,0,0,0,1|0,0,1]=3 4887 B16R2.252 Brc1cccc(c1)NCc2cncnc2 270302a_100000210019_100000749868 [0,1,0,0,0,1|0,0,1]=3 4888 B16R2.252 Brc1cccc(c1)NCc2cncnc2 34a_100000210019_100015196519 [0,1,0,0,0,1|0,0,1]=3 4889 B16R2.252 Brc1cccc(c1)NCc2ncccn2 34a_100000210019_100000703007 [0,1,0,0,0,1|1,0,0]=3 4890 B16R2.252 Brc1cccc(c1)OCc2ccccn2 34a_100000210342_100000721315 [0,1,0,0,0,1|2,0,0]=4 4891 B16R2.252 Brc1cccc(c1)OCc2ccccn2 7a_100000210342_100000721315 [0,1,0,0,0,1|2,0,0]=4 4892 B16R2.252 Brc1cccc(c1)OCc2cccnc2 34a_100000210342_100000733263 [0,1,0,0,0,1|2,0,0]=4 4893 B16R2.252 Brc1cccc(c1)OCc2cccnc2 7a_100000210342_100000741622 [0,1,0,0,0,1|2,0,0]=4 4894 B16R2.252 Brc1cccc(c1)OCc2cccnn2 34a_100000210342_100016990269 [0,1,0,0,0,1|2,0,0]=4 4895 B16R2.252 Brc1cccc(c1)OCc2cccnn2 7a_100000210342_100016990269 [0,1,0,0,0,1|2,0,0]=4 4896 B16R2.252 Brc1cccc(c1)OCc2cnccn2 34a_100000210342_100016995436 [0,1,0,0,0,1|1,0,1]=4 4897 B16R2.252 Brc1cccc(c1)OCc2cnccn2 7a_100000210342_100016995436 [0,1,0,0,0,1|1,0,1]=4 4898 B16R2.252 Brc1cccc(c1)OCc2cncnc2 34a_100000210342_100015196519 [0,1,0,0,0,1|1,0,1]=4 4899 B16R2.252 Brc1cccc(c1)OCc2cncnc2 7a_100000210342_100015196519 [0,1,0,0,0,1|1,0,1]=4 4900 B16R2.252 Brc1cccc(c1)OCc2ncccn2 34a_100000210342_100000703007 [0,1,0,0,0,1|2,0,0]=4 4901 B16R2.252 Brc1cccc(c1)OCc2ncccn2 7a_100000210342_100000703007 [0,1,0,0,0,1|2,0,0]=4 4902 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000691529_100000721315 [0,1,0,0,0,1|2,0,0]=4 4903 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000721315_100000691529 [0,1,0,0,0,1|2,0,0]=4 4904 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000691529_100000741622 [0,1,0,0,0,1|2,0,0]=4 4905 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000741622_100000691529 [0,1,0,0,0,1|2,0,0]=4 4906 B16R2.252 Brc1cccc(c1)SCc2cccnn2 62a_100000691529_100016990269 [0,1,0,0,0,1|2,0,0]=4 4907 B16R2.252 Brc1cccc(c1)SCc2cccnn2 62a_100016990269_100000691529 [0,1,0,0,0,1|2,0,0]=4 4908 B16R2.252 Brc1cccc(c1)SCc2cnccn2 62a_100000691529_100016995436 [0,1,0,0,0,1|1,0,1]=4 4909 B16R2.252 Brc1cccc(c1)SCc2cnccn2 62a_100016995436_100000691529 [0,1,0,0,0,1|1,0,1]=4 4910 B16R2.252 Brc1cccc(c1)SCc2cncnc2 62a_100000691529_100015196519 [0,1,0,0,0,1|1,0,1]=4 4911 B16R2.252 Brc1cccc(c1)SCc2cncnc2 62a_100015196519_100000691529 [0,1,0,0,0,1|1,0,1]=4 4912 B16R2.252 Brc1cccc(c1)SCc2ncccn2 62a_100000691529_100000703007 [0,1,0,0,0,1|2,0,0]=4 4913 B16R2.252 Brc1cccc(c1)SCc2ncccn2 62a_100000703007_100000691529 [0,1,0,0,0,1|2,0,0]=4 4914 B16R2.252 Brc1cccc(n1)CNc2ccccc2 34a_100000106764_100009889011 [0,1,0,0,0,1|1,0,0]=3 4915 B16R2.252 Brc1cccc(n1)COc2ccccc2 34a_100000210340_100009889011 [0,1,0,0,0,1|2,0,0]=4 4916 B16R2.252 Brc1cccc(n1)COc2ccccc2 7a_100000210340_100009889011 [0,1,0,0,0,1|2,0,0]=4 4917 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100000719477_100009889011 [0,1,0,0,0,1|2,0,0]=4 4918 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100009889011_100000041952 [0,1,0,0,0,1|2,0,0]=4 4919 B16R2.252 Brc1ccnc(c1)CNc2ccccc2 34a_100000106764_100010173614 [0,1,0,0,0,1|1,0,0]=3 4920 B16R2.252 Brc1ccnc(c1)COc2ccccc2 34a_100000210340_100010173614 [0,1,0,0,0,1|2,0,0]=4 4921 B16R2.252 Brc1ccnc(c1)COc2ccccc2 7a_100000210340_100010173614 [0,1,0,0,0,1|2,0,0]=4 4922 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100000719477_100010173614 [0,1,0,0,0,1|2,0,0]=4 4923 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100010173614_100000041952 [0,1,0,0,0,1|2,0,0]=4 4924 B16R2.252 Brc1cncc(c1)CNc2ccccc2 207a_100000106764_100000687066 [0,1,0,0,0,1|1,0,0]=3 4925 B16R2.252 Brc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000687066 [0,1,0,0,0,1|1,0,0]=3 4926 B16R2.252 Brc1cncc(c1)CNc2ccccc2 34a_100000106764_100000738771 [0,1,0,0,0,1|1,0,0]=3 4927 B16R2.252 Brc1cncc(c1)COc2ccccc2 34a_100000210340_100000738771 [0,1,0,0,0,1|2,0,0]=4 4928 B16R2.252 Brc1cncc(c1)COc2ccccc2 7a_100000210340_100000738771 [0,1,0,0,0,1|2,0,0]=4 4929 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000719477_100000738771 [0,1,0,0,0,1|2,0,0]=4 4930 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000738771_100000041952 [0,1,0,0,0,1|2,0,0]=4 4931 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 207a_100000106764_100011361630 [0,1,0,0,0,1|1,0,1]=4 4932 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 34a_100000106764_200020672517 [0,1,0,0,0,1|1,0,1]=4 4933 B16R2.252 Cc1cc(ccn1)NCc2ccccn2 27a_100000210449_100000758586 [0,1,0,0,0,1|2,0,0]=4 4934 B16R2.252 Cc1cc(ccn1)NCc2cccnc2 27a_100000210453_100000758586 [0,1,0,0,0,1|2,0,0]=4 4935 B16R2.252 Cc1cc(ccn1)NCc2cccnn2 27a_100159270163_100000758586 [0,1,0,0,0,1|2,0,0]=4 4936 B16R2.252 Cc1cc(ccn1)NCc2ccncn2 27a_100000736019_100000758586 [0,1,0,0,0,1|1,0,1]=4 4937 B16R2.252 Cc1cc(ccn1)NCc2cnccn2 27a_100000737960_100000758586 [0,1,0,0,0,1|1,0,1]=4 4938 B16R2.252 Cc1cc(ccn1)NCc2cncnc2 27a_100011243677_100000758586 [0,1,0,0,0,1|1,0,1]=4 4939 B16R2.252 Cc1cc(ccn1)NCc2ncccn2 27a_100015189908_100000758586 [0,1,0,0,0,1|2,0,0]=4 4940 B16R2.252 Cc1cccc(c1)CNc2ccccc2 207a_100000106764_100000211157 [0,1,0,0,0,1|2,0,0]=4 4941 B16R2.252 Cc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000211157 [0,1,0,0,0,1|2,0,0]=4 4942 B16R2.252 Cc1cccc(c1)CNc2ccccc2 34a_100000106764_100000211840 [0,1,0,0,0,1|2,0,0]=4 4943 B16R2.252 Cc1cccc(c1)NCc2ccccc2 207a_100000188690_100015611070 [0,1,0,0,0,1|2,0,0]=4 4944 B16R2.252 Cc1cccc(c1)NCc2ccccc2 2230a_100000188690_100015291786 [0,1,0,0,0,1|2,0,0]=4 4945 B16R2.252 Cc1cccc(c1)NCc2ccccc2 270302a_100000188690_100015611070 [0,1,0,0,0,1|2,0,0]=4 4946 B16R2.252 Cc1cccc(c1)NCc2ccccc2 34a_100000188690_100015291786 [0,1,0,0,0,1|2,0,0]=4 4947 B16R2.252 Cc1cccc(c1)NCc2ccccn2 207a_100000188690_100000209966 [0,1,0,0,0,1|1,0,0]=3 4948 B16R2.252 Cc1cccc(c1)NCc2ccccn2 2230a_100000188690_100000721315 [0,1,0,0,0,1|1,0,0]=3 4949 B16R2.252 Cc1cccc(c1)NCc2ccccn2 270302a_100000188690_100000209966 [0,1,0,0,0,1|1,0,0]=3 4950 B16R2.252 Cc1cccc(c1)NCc2ccccn2 34a_100000188690_100000721315 [0,1,0,0,0,1|1,0,0]=3 4951 B16R2.252 Cc1cccc(c1)NCc2cccnc2 207a_100000188690_100000209961 [0,1,0,0,0,1|1,0,0]=3 4952 B16R2.252 Cc1cccc(c1)NCc2cccnc2 2230a_100000188690_100000741622 [0,1,0,0,0,1|1,0,0]=3 4953 B16R2.252 Cc1cccc(c1)NCc2cccnc2 270302a_100000188690_100000209961 [0,1,0,0,0,1|1,0,0]=3 4954 B16R2.252 Cc1cccc(c1)NCc2cccnc2 34a_100000188690_100000733263 [0,1,0,0,0,1|1,0,0]=3 4955 B16R2.252 Cc1cccc(c1)NCc2cccnn2 2230a_100000188690_100016990269 [0,1,0,0,0,1|1,0,0]=3 4956 B16R2.252 Cc1cccc(c1)NCc2cccnn2 34a_100000188690_100016990269 [0,1,0,0,0,1|1,0,0]=3 4957 B16R2.252 Cc1cccc(c1)NCc2ccncc2 207a_100000188690_100000186114 [0,1,0,0,0,1|1,0,1]=4 4958 B16R2.252 Cc1cccc(c1)NCc2ccncc2 2230a_100000188690_100015193705 [0,1,0,0,0,1|1,0,1]=4 4959 B16R2.252 Cc1cccc(c1)NCc2ccnnc2 270302a_100000188690_100011934578 [0,1,0,0,0,1|1,0,1]=4 4960 B16R2.252 Cc1cccc(c1)NCc2cnccn2 2230a_100000188690_100016995436 [0,1,0,0,0,1|0,0,1]=3 4961 B16R2.252 Cc1cccc(c1)NCc2cnccn2 34a_100000188690_100016995436 [0,1,0,0,0,1|0,0,1]=3 4962 B16R2.252 Cc1cccc(c1)NCc2cncnc2 2230a_100000188690_100015196519 [0,1,0,0,0,1|0,0,1]=3 4963 B16R2.252 Cc1cccc(c1)NCc2cncnc2 270302a_100000188690_100000749868 [0,1,0,0,0,1|0,0,1]=3 4964 B16R2.252 Cc1cccc(c1)NCc2cncnc2 34a_100000188690_100015196519 [0,1,0,0,0,1|0,0,1]=3 4965 B16R2.252 Cc1cccc(c1)NCc2ncccn2 2230a_100000188690_100000703007 [0,1,0,0,0,1|1,0,0]=3 4966 B16R2.252 Cc1cccc(c1)NCc2ncccn2 34a_100000188690_100000703007 [0,1,0,0,0,1|1,0,0]=3 4967 B16R2.252 Cc1cccc(c1)OCc2ccccn2 34a_100000210337_100000721315 [0,1,0,0,0,1|2,0,0]=4 4968 B16R2.252 Cc1cccc(c1)OCc2ccccn2 7a_100000210337_100000721315 [0,1,0,0,0,1|2,0,0]=4 4969 B16R2.252 Cc1cccc(c1)OCc2cccnc2 34a_100000210337_100000733263 [0,1,0,0,0,1|2,0,0]=4 4970 B16R2.252 Cc1cccc(c1)OCc2cccnc2 7a_100000210337_100000741622 [0,1,0,0,0,1|2,0,0]=4 4971 B16R2.252 Cc1cccc(c1)OCc2cccnn2 34a_100000210337_100016990269 [0,1,0,0,0,1|2,0,0]=4 4972 B16R2.252 Cc1cccc(c1)OCc2cccnn2 7a_100000210337_100016990269 [0,1,0,0,0,1|2,0,0]=4 4973 B16R2.252 Cc1cccc(c1)OCc2cnccn2 34a_100000210337_100016995436 [0,1,0,0,0,1|1,0,1]=4 4974 B16R2.252 Cc1cccc(c1)OCc2cnccn2 7a_100000210337_100016995436 [0,1,0,0,0,1|1,0,1]=4 4975 B16R2.252 Cc1cccc(c1)OCc2cncnc2 34a_100000210337_100015196519 [0,1,0,0,0,1|1,0,1]=4 4976 B16R2.252 Cc1cccc(c1)OCc2cncnc2 7a_100000210337_100015196519 [0,1,0,0,0,1|1,0,1]=4 4977 B16R2.252 Cc1cccc(c1)OCc2ncccn2 34a_100000210337_100000703007 [0,1,0,0,0,1|2,0,0]=4 4978 B16R2.252 Cc1cccc(c1)OCc2ncccn2 7a_100000210337_100000703007 [0,1,0,0,0,1|2,0,0]=4 4979 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100000721315_100011215228 [0,1,0,0,0,1|2,0,0]=4 4980 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100011215228_100000721315 [0,1,0,0,0,1|2,0,0]=4 4981 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100000741622_100011215228 [0,1,0,0,0,1|2,0,0]=4 4982 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100011215228_100000741622 [0,1,0,0,0,1|2,0,0]=4 4983 B16R2.252 Cc1cccc(c1)SCc2cccnn2 62a_100011215228_100016990269 [0,1,0,0,0,1|2,0,0]=4 4984 B16R2.252 Cc1cccc(c1)SCc2cccnn2 62a_100016990269_100011215228 [0,1,0,0,0,1|2,0,0]=4 4985 B16R2.252 Cc1cccc(c1)SCc2cnccn2 62a_100011215228_100016995436 [0,1,0,0,0,1|1,0,1]=4 4986 B16R2.252 Cc1cccc(c1)SCc2cnccn2 62a_100016995436_100011215228 [0,1,0,0,0,1|1,0,1]=4 4987 B16R2.252 Cc1cccc(c1)SCc2cncnc2 62a_100011215228_100015196519 [0,1,0,0,0,1|1,0,1]=4 4988 B16R2.252 Cc1cccc(c1)SCc2cncnc2 62a_100015196519_100011215228 [0,1,0,0,0,1|1,0,1]=4 4989 B16R2.252 Cc1cccc(c1)SCc2ncccn2 62a_100000703007_100011215228 [0,1,0,0,0,1|2,0,0]=4 4990 B16R2.252 Cc1cccc(c1)SCc2ncccn2 62a_100011215228_100000703007 [0,1,0,0,0,1|2,0,0]=4 4991 B16R2.252 Cc1cccc(n1)CNc2ccccc2 207a_100000106764_100011215050 [0,1,0,0,0,1|1,0,0]=3 4992 B16R2.252 Cc1cccc(n1)CNc2ccccc2 34a_100000106764_100000757606 [0,1,0,0,0,1|1,0,0]=3 4993 B16R2.252 Cc1cccc(n1)COc2ccccc2 34a_100000210340_100000757606 [0,1,0,0,0,1|2,0,0]=4 4994 B16R2.252 Cc1cccc(n1)COc2ccccc2 7a_100000210340_100000757606 [0,1,0,0,0,1|2,0,0]=4 4995 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000719477_100000757606 [0,1,0,0,0,1|2,0,0]=4 4996 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000757606_100000041952 [0,1,0,0,0,1|2,0,0]=4 4997 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 207a_100000106764_100011361488 [0,1,0,0,0,1|1,0,0]=3 4998 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 34a_100000106764_100000718516 [0,1,0,0,0,1|1,0,0]=3 4999 B16R2.252 Cc1ccnc(c1)COc2ccccc2 34a_100000210340_100000718516 [0,1,0,0,0,1|2,0,0]=4 5000 B16R2.252 Cc1ccnc(c1)COc2ccccc2 7a_100000210340_100000718516 [0,1,0,0,0,1|2,0,0]=4 5001 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000718516_100000041952 [0,1,0,0,0,1|2,0,0]=4 5002 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000719477_100000718516 [0,1,0,0,0,1|2,0,0]=4 5003 B16R2.252 Cc1cncc(c1)CNc2ccccc2 207a_100000106764_100011998712 [0,1,0,0,0,1|1,0,0]=3 5004 B16R2.252 Cc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011998712 [0,1,0,0,0,1|1,0,0]=3 5005 B16R2.252 Cc1cncc(c1)CNc2ccccc2 34a_100000106764_100000716715 [0,1,0,0,0,1|1,0,0]=3 5006 B16R2.252 Cc1cncc(c1)COc2ccccc2 34a_100000210340_100000716715 [0,1,0,0,0,1|2,0,0]=4 5007 B16R2.252 Cc1cncc(c1)COc2ccccc2 7a_100000210340_100000716715 [0,1,0,0,0,1|2,0,0]=4 5008 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000716715_100000041952 [0,1,0,0,0,1|2,0,0]=4 5009 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000719477_100000716715 [0,1,0,0,0,1|2,0,0]=4 5010 B16R2.252 Cc1cncc(n1)CNc2ccccc2 207a_100000106764_100000100294 [0,1,0,0,0,1|0,0,1]=3 5011 B16R2.252 Clc1cc(ccn1)CNc2ccccc2 34a_100000106764_100000764220 [0,1,0,0,0,1|1,0,1]=4 5012 B16R2.252 Clc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210801 [0,1,0,0,0,1|2,0,0]=4 5013 B16R2.252 Clc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210801 [0,1,0,0,0,1|2,0,0]=4 5014 B16R2.252 Clc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187163 [0,1,0,0,0,1|2,0,0]=4 5015 B16R2.252 Clc1cccc(c1)NCc2ccccc2 207a_100000185859_100015611070 [0,1,0,0,0,1|2,0,0]=4 5016 B16R2.252 Clc1cccc(c1)NCc2ccccc2 270302a_100000185859_100015611070 [0,1,0,0,0,1|2,0,0]=4 5017 B16R2.252 Clc1cccc(c1)NCc2ccccc2 34a_100000185859_100015291786 [0,1,0,0,0,1|2,0,0]=4 5018 B16R2.252 Clc1cccc(c1)NCc2ccccn2 207a_100000185859_100000209966 [0,1,0,0,0,1|1,0,0]=3 5019 B16R2.252 Clc1cccc(c1)NCc2ccccn2 270302a_100000185859_100000209966 [0,1,0,0,0,1|1,0,0]=3 5020 B16R2.252 Clc1cccc(c1)NCc2ccccn2 34a_100000185859_100000721315 [0,1,0,0,0,1|1,0,0]=3 5021 B16R2.252 Clc1cccc(c1)NCc2cccnc2 207a_100000185859_100000209961 [0,1,0,0,0,1|1,0,0]=3 5022 B16R2.252 Clc1cccc(c1)NCc2cccnc2 270302a_100000185859_100000209961 [0,1,0,0,0,1|1,0,0]=3 5023 B16R2.252 Clc1cccc(c1)NCc2cccnc2 34a_100000185859_100000733263 [0,1,0,0,0,1|1,0,0]=3 5024 B16R2.252 Clc1cccc(c1)NCc2cccnn2 34a_100000185859_100016990269 [0,1,0,0,0,1|1,0,0]=3 5025 B16R2.252 Clc1cccc(c1)NCc2ccncc2 207a_100000185859_100000186114 [0,1,0,0,0,1|1,0,1]=4 5026 B16R2.252 Clc1cccc(c1)NCc2ccnnc2 270302a_100000185859_100011934578 [0,1,0,0,0,1|1,0,1]=4 5027 B16R2.252 Clc1cccc(c1)NCc2cnccn2 34a_100000185859_100016995436 [0,1,0,0,0,1|0,0,1]=3 5028 B16R2.252 Clc1cccc(c1)NCc2cncnc2 270302a_100000185859_100000749868 [0,1,0,0,0,1|0,0,1]=3 5029 B16R2.252 Clc1cccc(c1)NCc2cncnc2 34a_100000185859_100015196519 [0,1,0,0,0,1|0,0,1]=3 5030 B16R2.252 Clc1cccc(c1)NCc2ncccn2 34a_100000185859_100000703007 [0,1,0,0,0,1|1,0,0]=3 5031 B16R2.252 Clc1cccc(c1)OCc2ccccn2 34a_100000210295_100000721315 [0,1,0,0,0,1|2,0,0]=4 5032 B16R2.252 Clc1cccc(c1)OCc2ccccn2 7a_100000210295_100000721315 [0,1,0,0,0,1|2,0,0]=4 5033 B16R2.252 Clc1cccc(c1)OCc2cccnc2 34a_100000210295_100000733263 [0,1,0,0,0,1|2,0,0]=4 5034 B16R2.252 Clc1cccc(c1)OCc2cccnc2 7a_100000210295_100000741622 [0,1,0,0,0,1|2,0,0]=4 5035 B16R2.252 Clc1cccc(c1)OCc2cccnn2 34a_100000210295_100016990269 [0,1,0,0,0,1|2,0,0]=4 5036 B16R2.252 Clc1cccc(c1)OCc2cccnn2 7a_100000210295_100016990269 [0,1,0,0,0,1|2,0,0]=4 5037 B16R2.252 Clc1cccc(c1)OCc2cnccn2 34a_100000210295_100016995436 [0,1,0,0,0,1|1,0,1]=4 5038 B16R2.252 Clc1cccc(c1)OCc2cnccn2 7a_100000210295_100016995436 [0,1,0,0,0,1|1,0,1]=4 5039 B16R2.252 Clc1cccc(c1)OCc2cncnc2 34a_100000210295_100015196519 [0,1,0,0,0,1|1,0,1]=4 5040 B16R2.252 Clc1cccc(c1)OCc2cncnc2 7a_100000210295_100015196519 [0,1,0,0,0,1|1,0,1]=4 5041 B16R2.252 Clc1cccc(c1)OCc2ncccn2 34a_100000210295_100000703007 [0,1,0,0,0,1|2,0,0]=4 5042 B16R2.252 Clc1cccc(c1)OCc2ncccn2 7a_100000210295_100000703007 [0,1,0,0,0,1|2,0,0]=4 5043 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000699651_100000721315 [0,1,0,0,0,1|2,0,0]=4 5044 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000721315_100000699651 [0,1,0,0,0,1|2,0,0]=4 5045 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000699651_100000741622 [0,1,0,0,0,1|2,0,0]=4 5046 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000741622_100000699651 [0,1,0,0,0,1|2,0,0]=4 5047 B16R2.252 Clc1cccc(c1)SCc2cccnn2 62a_100000699651_100016990269 [0,1,0,0,0,1|2,0,0]=4 5048 B16R2.252 Clc1cccc(c1)SCc2cccnn2 62a_100016990269_100000699651 [0,1,0,0,0,1|2,0,0]=4 5049 B16R2.252 Clc1cccc(c1)SCc2cnccn2 62a_100000699651_100016995436 [0,1,0,0,0,1|1,0,1]=4 5050 B16R2.252 Clc1cccc(c1)SCc2cnccn2 62a_100016995436_100000699651 [0,1,0,0,0,1|1,0,1]=4 5051 B16R2.252 Clc1cccc(c1)SCc2cncnc2 62a_100000699651_100015196519 [0,1,0,0,0,1|1,0,1]=4 5052 B16R2.252 Clc1cccc(c1)SCc2cncnc2 62a_100015196519_100000699651 [0,1,0,0,0,1|1,0,1]=4 5053 B16R2.252 Clc1cccc(c1)SCc2ncccn2 62a_100000699651_100000703007 [0,1,0,0,0,1|2,0,0]=4 5054 B16R2.252 Clc1cccc(c1)SCc2ncccn2 62a_100000703007_100000699651 [0,1,0,0,0,1|2,0,0]=4 5055 B16R2.252 Clc1cccc(n1)CNc2ccccc2 34a_100000106764_100000086093 [0,1,0,0,0,1|1,0,0]=3 5056 B16R2.252 Clc1cccc(n1)COc2ccccc2 34a_100000210340_100000086093 [0,1,0,0,0,1|2,0,0]=4 5057 B16R2.252 Clc1cccc(n1)COc2ccccc2 7a_100000210340_100000086093 [0,1,0,0,0,1|2,0,0]=4 5058 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000086093_100000041952 [0,1,0,0,0,1|2,0,0]=4 5059 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000719477_100000086093 [0,1,0,0,0,1|2,0,0]=4 5060 B16R2.252 Clc1ccnc(c1)CNc2ccccc2 34a_100000106764_100016988179 [0,1,0,0,0,1|1,0,0]=3 5061 B16R2.252 Clc1ccnc(c1)COc2ccccc2 34a_100000210340_100016988179 [0,1,0,0,0,1|2,0,0]=4 5062 B16R2.252 Clc1ccnc(c1)COc2ccccc2 7a_100000210340_100016988179 [0,1,0,0,0,1|2,0,0]=4 5063 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100000719477_100016988179 [0,1,0,0,0,1|2,0,0]=4 5064 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100016988179_100000041952 [0,1,0,0,0,1|2,0,0]=4 5065 B16R2.252 Clc1cncc(c1)CNc2ccccc2 207a_100000106764_100000088910 [0,1,0,0,0,1|1,0,0]=3 5066 B16R2.252 Clc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000088910 [0,1,0,0,0,1|1,0,0]=3 5067 B16R2.252 Clc1cncc(c1)CNc2ccccc2 34a_100000106764_100016992070 [0,1,0,0,0,1|1,0,0]=3 5068 B16R2.252 Clc1cncc(c1)COc2ccccc2 34a_100000210340_100016992070 [0,1,0,0,0,1|2,0,0]=4 5069 B16R2.252 Clc1cncc(c1)COc2ccccc2 7a_100000210340_100016992070 [0,1,0,0,0,1|2,0,0]=4 5070 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100000719477_100016992070 [0,1,0,0,0,1|2,0,0]=4 5071 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100016992070_100000041952 [0,1,0,0,0,1|2,0,0]=4 5072 B16R2.252 Clc1nccc(n1)CNc2ccccc2 34a_100000106764_100000099655 [0,1,0,0,0,1|0,0,1]=3 5073 B16R2.252 Clc1nccc(n1)COc2ccccc2 34a_100000210340_100000099655 [0,1,0,0,0,1|1,0,1]=4 5074 B16R2.252 Clc1nccc(n1)COc2ccccc2 7a_100000210340_100000099655 [0,1,0,0,0,1|1,0,1]=4 5075 B16R2.252 Clc1nccc(n1)CSc2ccccc2 62a_100000099655_100000041952 [0,1,0,0,0,1|1,0,1]=4 5076 B16R2.252 Clc1nccc(n1)CSc2ccccc2 62a_100000719477_100000099655 [0,1,0,0,0,1|1,0,1]=4 5077 B16R2.252 Fc1cc(ccn1)NCc2ccccn2 27a_100000210449_100009816116 [0,1,0,0,0,1|2,0,0]=4 5078 B16R2.252 Fc1cc(ccn1)NCc2cccnc2 27a_100000210453_100009816116 [0,1,0,0,0,1|2,0,0]=4 5079 B16R2.252 Fc1cc(ccn1)NCc2cccnn2 27a_100159270163_100009816116 [0,1,0,0,0,1|2,0,0]=4 5080 B16R2.252 Fc1cc(ccn1)NCc2ccncn2 27a_100000736019_100009816116 [0,1,0,0,0,1|1,0,1]=4 5081 B16R2.252 Fc1cc(ccn1)NCc2cnccn2 27a_100000737960_100009816116 [0,1,0,0,0,1|1,0,1]=4 5082 B16R2.252 Fc1cc(ccn1)NCc2cncnc2 27a_100011243677_100009816116 [0,1,0,0,0,1|1,0,1]=4 5083 B16R2.252 Fc1cc(ccn1)NCc2ncccn2 27a_100015189908_100009816116 [0,1,0,0,0,1|2,0,0]=4 5084 B16R2.252 Fc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210812 [0,1,0,0,0,1|2,0,0]=4 5085 B16R2.252 Fc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210812 [0,1,0,0,0,1|2,0,0]=4 5086 B16R2.252 Fc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187166 [0,1,0,0,0,1|2,0,0]=4 5087 B16R2.252 Fc1cccc(c1)NCc2ccccc2 207a_100000210047_100015611070 [0,1,0,0,0,1|2,0,0]=4 5088 B16R2.252 Fc1cccc(c1)NCc2ccccc2 270302a_100000210047_100015611070 [0,1,0,0,0,1|2,0,0]=4 5089 B16R2.252 Fc1cccc(c1)NCc2ccccc2 34a_100000210047_100015291786 [0,1,0,0,0,1|2,0,0]=4 5090 B16R2.252 Fc1cccc(c1)NCc2ccccn2 207a_100000210047_100000209966 [0,1,0,0,0,1|1,0,0]=3 5091 B16R2.252 Fc1cccc(c1)NCc2ccccn2 270302a_100000210047_100000209966 [0,1,0,0,0,1|1,0,0]=3 5092 B16R2.252 Fc1cccc(c1)NCc2ccccn2 34a_100000210047_100000721315 [0,1,0,0,0,1|1,0,0]=3 5093 B16R2.252 Fc1cccc(c1)NCc2cccnc2 207a_100000210047_100000209961 [0,1,0,0,0,1|1,0,0]=3 5094 B16R2.252 Fc1cccc(c1)NCc2cccnc2 270302a_100000210047_100000209961 [0,1,0,0,0,1|1,0,0]=3 5095 B16R2.252 Fc1cccc(c1)NCc2cccnc2 34a_100000210047_100000733263 [0,1,0,0,0,1|1,0,0]=3 5096 B16R2.252 Fc1cccc(c1)NCc2cccnn2 34a_100000210047_100016990269 [0,1,0,0,0,1|1,0,0]=3 5097 B16R2.252 Fc1cccc(c1)NCc2ccncc2 207a_100000210047_100000186114 [0,1,0,0,0,1|1,0,1]=4 5098 B16R2.252 Fc1cccc(c1)NCc2ccnnc2 270302a_100000210047_100011934578 [0,1,0,0,0,1|1,0,1]=4 5099 B16R2.252 Fc1cccc(c1)NCc2cnccn2 34a_100000210047_100016995436 [0,1,0,0,0,1|0,0,1]=3 5100 B16R2.252 Fc1cccc(c1)NCc2cncnc2 270302a_100000210047_100000749868 [0,1,0,0,0,1|0,0,1]=3 5101 B16R2.252 Fc1cccc(c1)NCc2cncnc2 34a_100000210047_100015196519 [0,1,0,0,0,1|0,0,1]=3 5102 B16R2.252 Fc1cccc(c1)NCc2ncccn2 34a_100000210047_100000703007 [0,1,0,0,0,1|1,0,0]=3 5103 B16R2.252 Fc1cccc(c1)OCc2ccccn2 34a_100000210426_100000721315 [0,1,0,0,0,1|2,0,0]=4 5104 B16R2.252 Fc1cccc(c1)OCc2ccccn2 7a_100000210426_100000721315 [0,1,0,0,0,1|2,0,0]=4 5105 B16R2.252 Fc1cccc(c1)OCc2cccnc2 34a_100000210426_100000733263 [0,1,0,0,0,1|2,0,0]=4 5106 B16R2.252 Fc1cccc(c1)OCc2cccnc2 7a_100000210426_100000741622 [0,1,0,0,0,1|2,0,0]=4 5107 B16R2.252 Fc1cccc(c1)OCc2cccnn2 34a_100000210426_100016990269 [0,1,0,0,0,1|2,0,0]=4 5108 B16R2.252 Fc1cccc(c1)OCc2cccnn2 7a_100000210426_100016990269 [0,1,0,0,0,1|2,0,0]=4 5109 B16R2.252 Fc1cccc(c1)OCc2cnccn2 34a_100000210426_100016995436 [0,1,0,0,0,1|1,0,1]=4 5110 B16R2.252 Fc1cccc(c1)OCc2cnccn2 7a_100000210426_100016995436 [0,1,0,0,0,1|1,0,1]=4 5111 B16R2.252 Fc1cccc(c1)OCc2cncnc2 34a_100000210426_100015196519 [0,1,0,0,0,1|1,0,1]=4 5112 B16R2.252 Fc1cccc(c1)OCc2cncnc2 7a_100000210426_100015196519 [0,1,0,0,0,1|1,0,1]=4 5113 B16R2.252 Fc1cccc(c1)OCc2ncccn2 34a_100000210426_100000703007 [0,1,0,0,0,1|2,0,0]=4 5114 B16R2.252 Fc1cccc(c1)OCc2ncccn2 7a_100000210426_100000703007 [0,1,0,0,0,1|2,0,0]=4 5115 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000685547_100000721315 [0,1,0,0,0,1|2,0,0]=4 5116 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000721315_100000685547 [0,1,0,0,0,1|2,0,0]=4 5117 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000685547_100000741622 [0,1,0,0,0,1|2,0,0]=4 5118 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000741622_100000685547 [0,1,0,0,0,1|2,0,0]=4 5119 B16R2.252 Fc1cccc(c1)SCc2cccnn2 62a_100000685547_100016990269 [0,1,0,0,0,1|2,0,0]=4 5120 B16R2.252 Fc1cccc(c1)SCc2cccnn2 62a_100016990269_100000685547 [0,1,0,0,0,1|2,0,0]=4 5121 B16R2.252 Fc1cccc(c1)SCc2cnccn2 62a_100000685547_100016995436 [0,1,0,0,0,1|1,0,1]=4 5122 B16R2.252 Fc1cccc(c1)SCc2cnccn2 62a_100016995436_100000685547 [0,1,0,0,0,1|1,0,1]=4 5123 B16R2.252 Fc1cccc(c1)SCc2cncnc2 62a_100000685547_100015196519 [0,1,0,0,0,1|1,0,1]=4 5124 B16R2.252 Fc1cccc(c1)SCc2cncnc2 62a_100015196519_100000685547 [0,1,0,0,0,1|1,0,1]=4 5125 B16R2.252 Fc1cccc(c1)SCc2ncccn2 62a_100000685547_100000703007 [0,1,0,0,0,1|2,0,0]=4 5126 B16R2.252 Fc1cccc(c1)SCc2ncccn2 62a_100000703007_100000685547 [0,1,0,0,0,1|2,0,0]=4 5127 B16R2.252 Fc1cccc(n1)CNc2ccccc2 34a_100000106764_100009819644 [0,1,0,0,0,1|1,0,0]=3 5128 B16R2.252 Fc1cccc(n1)COc2ccccc2 34a_100000210340_100009819644 [0,1,0,0,0,1|2,0,0]=4 5129 B16R2.252 Fc1cccc(n1)COc2ccccc2 7a_100000210340_100009819644 [0,1,0,0,0,1|2,0,0]=4 5130 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100000719477_100009819644 [0,1,0,0,0,1|2,0,0]=4 5131 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100009819644_100000041952 [0,1,0,0,0,1|2,0,0]=4 5132 B16R2.252 Fc1cccc(n1)NCc2ccccn2 27a_100000210449_100009815982 [0,1,0,0,0,1|2,0,0]=4 5133 B16R2.252 Fc1cccc(n1)NCc2cccnc2 27a_100000210453_100009815982 [0,1,0,0,0,1|2,0,0]=4 5134 B16R2.252 Fc1cccc(n1)NCc2cccnn2 27a_100159270163_100009815982 [0,1,0,0,0,1|2,0,0]=4 5135 B16R2.252 Fc1cccc(n1)NCc2ccncn2 27a_100000736019_100009815982 [0,1,0,0,0,1|1,0,1]=4 5136 B16R2.252 Fc1cccc(n1)NCc2cnccn2 27a_100000737960_100009815982 [0,1,0,0,0,1|1,0,1]=4 5137 B16R2.252 Fc1cccc(n1)NCc2cncnc2 27a_100011243677_100009815982 [0,1,0,0,0,1|1,0,1]=4 5138 B16R2.252 Fc1cccc(n1)NCc2ncccn2 27a_100015189908_100009815982 [0,1,0,0,0,1|2,0,0]=4 5139 B16R2.252 Fc1ccnc(c1)NCc2ccccn2 27a_100000210449_100000764206 [0,1,0,0,0,1|2,0,0]=4 5140 B16R2.252 Fc1ccnc(c1)NCc2cccnc2 27a_100000210453_100000764206 [0,1,0,0,0,1|2,0,0]=4 5141 B16R2.252 Fc1ccnc(c1)NCc2cccnn2 27a_100159270163_100000764206 [0,1,0,0,0,1|2,0,0]=4 5142 B16R2.252 Fc1ccnc(c1)NCc2ccncn2 27a_100000736019_100000764206 [0,1,0,0,0,1|1,0,1]=4 5143 B16R2.252 Fc1ccnc(c1)NCc2cnccn2 27a_100000737960_100000764206 [0,1,0,0,0,1|1,0,1]=4 5144 B16R2.252 Fc1ccnc(c1)NCc2cncnc2 27a_100011243677_100000764206 [0,1,0,0,0,1|1,0,1]=4 5145 B16R2.252 Fc1ccnc(c1)NCc2ncccn2 27a_100015189908_100000764206 [0,1,0,0,0,1|2,0,0]=4 5146 B16R2.252 Fc1cncc(c1)CNc2ccccc2 207a_100000106764_100011361476 [0,1,0,0,0,1|1,0,0]=3 5147 B16R2.252 Fc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011361476 [0,1,0,0,0,1|1,0,0]=3 5148 B16R2.252 Fc1cncc(c1)CNc2ccccc2 34a_100000106764_100000725299 [0,1,0,0,0,1|1,0,0]=3 5149 B16R2.252 Fc1cncc(c1)COc2ccccc2 34a_100000210340_100000725299 [0,1,0,0,0,1|2,0,0]=4 5150 B16R2.252 Fc1cncc(c1)COc2ccccc2 7a_100000210340_100000725299 [0,1,0,0,0,1|2,0,0]=4 5151 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000719477_100000725299 [0,1,0,0,0,1|2,0,0]=4 5152 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000725299_100000041952 [0,1,0,0,0,1|2,0,0]=4 5153 B16R2.252 Ic1cccc(c1)CNc2ccccc2 207a_100000106764_100000014684 [0,1,0,0,0,1|2,0,0]=4 5154 B16R2.252 Ic1cccc(c1)CNc2ccccc2 270302a_100000106764_100000014684 [0,1,0,0,0,1|2,0,0]=4 5155 B16R2.252 Ic1cccc(c1)CNc2ccccc2 34a_100000106764_100011218688 [0,1,0,0,0,1|2,0,0]=4 5156 B16R2.252 Ic1cccc(c1)NCc2ccccc2 207a_100000211102_100015611070 [0,1,0,0,0,1|2,0,0]=4 5157 B16R2.252 Ic1cccc(c1)NCc2ccccc2 270302a_100000211102_100015611070 [0,1,0,0,0,1|2,0,0]=4 5158 B16R2.252 Ic1cccc(c1)NCc2ccccc2 34a_100000211102_100015291786 [0,1,0,0,0,1|2,0,0]=4 5159 B16R2.252 Ic1cccc(c1)NCc2ccccn2 207a_100000211102_100000209966 [0,1,0,0,0,1|1,0,0]=3 5160 B16R2.252 Ic1cccc(c1)NCc2ccccn2 270302a_100000211102_100000209966 [0,1,0,0,0,1|1,0,0]=3 5161 B16R2.252 Ic1cccc(c1)NCc2ccccn2 34a_100000211102_100000721315 [0,1,0,0,0,1|1,0,0]=3 5162 B16R2.252 Ic1cccc(c1)NCc2cccnc2 207a_100000211102_100000209961 [0,1,0,0,0,1|1,0,0]=3 5163 B16R2.252 Ic1cccc(c1)NCc2cccnc2 270302a_100000211102_100000209961 [0,1,0,0,0,1|1,0,0]=3 5164 B16R2.252 Ic1cccc(c1)NCc2cccnc2 34a_100000211102_100000733263 [0,1,0,0,0,1|1,0,0]=3 5165 B16R2.252 Ic1cccc(c1)NCc2cccnn2 34a_100000211102_100016990269 [0,1,0,0,0,1|1,0,0]=3 5166 B16R2.252 Ic1cccc(c1)NCc2ccncc2 207a_100000211102_100000186114 [0,1,0,0,0,1|1,0,1]=4 5167 B16R2.252 Ic1cccc(c1)NCc2ccnnc2 270302a_100000211102_100011934578 [0,1,0,0,0,1|1,0,1]=4 5168 B16R2.252 Ic1cccc(c1)NCc2cnccn2 34a_100000211102_100016995436 [0,1,0,0,0,1|0,0,1]=3 5169 B16R2.252 Ic1cccc(c1)NCc2cncnc2 270302a_100000211102_100000749868 [0,1,0,0,0,1|0,0,1]=3 5170 B16R2.252 Ic1cccc(c1)NCc2cncnc2 34a_100000211102_100015196519 [0,1,0,0,0,1|0,0,1]=3 5171 B16R2.252 Ic1cccc(c1)NCc2ncccn2 34a_100000211102_100000703007 [0,1,0,0,0,1|1,0,0]=3 5172 B16R2.252 Ic1cccc(c1)OCc2ccccn2 34a_100000211634_100000721315 [0,1,0,0,0,1|2,0,0]=4 5173 B16R2.252 Ic1cccc(c1)OCc2ccccn2 7a_100000211634_100000721315 [0,1,0,0,0,1|2,0,0]=4 5174 B16R2.252 Ic1cccc(c1)OCc2cccnc2 34a_100000211634_100000733263 [0,1,0,0,0,1|2,0,0]=4 5175 B16R2.252 Ic1cccc(c1)OCc2cccnc2 7a_100000211634_100000741622 [0,1,0,0,0,1|2,0,0]=4 5176 B16R2.252 Ic1cccc(c1)OCc2cccnn2 34a_100000211634_100016990269 [0,1,0,0,0,1|2,0,0]=4 5177 B16R2.252 Ic1cccc(c1)OCc2cccnn2 7a_100000211634_100016990269 [0,1,0,0,0,1|2,0,0]=4 5178 B16R2.252 Ic1cccc(c1)OCc2cnccn2 34a_100000211634_100016995436 [0,1,0,0,0,1|1,0,1]=4 5179 B16R2.252 Ic1cccc(c1)OCc2cnccn2 7a_100000211634_100016995436 [0,1,0,0,0,1|1,0,1]=4 5180 B16R2.252 Ic1cccc(c1)OCc2cncnc2 34a_100000211634_100015196519 [0,1,0,0,0,1|1,0,1]=4 5181 B16R2.252 Ic1cccc(c1)OCc2cncnc2 7a_100000211634_100015196519 [0,1,0,0,0,1|1,0,1]=4 5182 B16R2.252 Ic1cccc(c1)OCc2ncccn2 34a_100000211634_100000703007 [0,1,0,0,0,1|2,0,0]=4 5183 B16R2.252 Ic1cccc(c1)OCc2ncccn2 7a_100000211634_100000703007 [0,1,0,0,0,1|2,0,0]=4 5184 B16R2.252 Nc1cccc(c1)OCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,0,1|2,0,0]=4 5185 B16R2.252 Nc1cccc(c1)OCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,0,1|2,0,0]=4 5186 B16R2.252 Nc1cccc(c1)OCc2cccnn2 34a_100000210217_100016990269 [0,1,0,0,0,1|2,0,0]=4 5187 B16R2.252 Nc1cccc(c1)OCc2cnccn2 34a_100000210217_100016995436 [0,1,0,0,0,1|1,0,1]=4 5188 B16R2.252 Nc1cccc(c1)OCc2cncnc2 34a_100000210217_100015196519 [0,1,0,0,0,1|1,0,1]=4 5189 B16R2.252 Nc1cccc(c1)OCc2ncccn2 34a_100000210217_100000703007 [0,1,0,0,0,1|2,0,0]=4 5190 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000210019_100000721315 [0,1,0,0,0,1|2,0,0]=4 5191 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000721315_100000210019 [0,1,0,0,0,1|2,0,0]=4 5192 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000210019_100000741622 [0,1,0,0,0,1|2,0,0]=4 5193 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000741622_100000210019 [0,1,0,0,0,1|2,0,0]=4 5194 B16R2.252 Nc1cccc(c1)SCc2cccnn2 62a_100000210019_100016990269 [0,1,0,0,0,1|2,0,0]=4 5195 B16R2.252 Nc1cccc(c1)SCc2cccnn2 62a_100016990269_100000210019 [0,1,0,0,0,1|2,0,0]=4 5196 B16R2.252 Nc1cccc(c1)SCc2cnccn2 62a_100000210019_100016995436 [0,1,0,0,0,1|1,0,1]=4 5197 B16R2.252 Nc1cccc(c1)SCc2cnccn2 62a_100016995436_100000210019 [0,1,0,0,0,1|1,0,1]=4 5198 B16R2.252 Nc1cccc(c1)SCc2cncnc2 62a_100000210019_100015196519 [0,1,0,0,0,1|1,0,1]=4 5199 B16R2.252 Nc1cccc(c1)SCc2cncnc2 62a_100015196519_100000210019 [0,1,0,0,0,1|1,0,1]=4 5200 B16R2.252 Nc1cccc(c1)SCc2ncccn2 62a_100000210019_100000703007 [0,1,0,0,0,1|2,0,0]=4 5201 B16R2.252 Nc1cccc(c1)SCc2ncccn2 62a_100000703007_100000210019 [0,1,0,0,0,1|2,0,0]=4 5202 B16R2.252 O=C1CC(=NNc2ccccc2)C=CN1 4a_100015195140_100000133659 [0,1,0,0,0,1|2,0,0]=4 5203 B16R2.252 O=c1cc(cc[nH]1)NCc2ccccn2 27a_100000210449_100000061649 [0,1,0,0,0,1|2,0,0]=4 5204 B16R2.252 O=c1cc(cc[nH]1)NCc2cccnc2 27a_100000210453_100000061649 [0,1,0,0,0,1|2,0,0]=4 5205 B16R2.252 O=c1cc(cc[nH]1)NCc2cccnn2 27a_100159270163_100000061649 [0,1,0,0,0,1|2,0,0]=4 5206 B16R2.252 O=c1cc(cc[nH]1)NCc2ccncn2 27a_100000736019_100000061649 [0,1,0,0,0,1|1,0,1]=4 5207 B16R2.252 O=c1cc(cc[nH]1)NCc2cnccn2 27a_100000737960_100000061649 [0,1,0,0,0,1|1,0,1]=4 5208 B16R2.252 O=c1cc(cc[nH]1)NCc2cncnc2 27a_100011243677_100000061649 [0,1,0,0,0,1|1,0,1]=4 5209 B16R2.252 O=c1cc(cc[nH]1)NCc2ncccn2 27a_100015189908_100000061649 [0,1,0,0,0,1|2,0,0]=4 5210 B16R2.252 O=c1cc(nc[nH]1)SCc2ccccc2 62a_100012002517_100015291786 [0,1,0,0,0,1|2,0,0]=4 5211 B16R2.252 O=c1cccc([nH]1)CNc2ccccc2 207a_100000106764_100011935257 [0,1,0,0,0,1|1,0,1]=4 5212 B16R2.252 O=c1nc(cc[nH]1)C#Cc2ccccc2 271570a_100000069678_200000134032 [0,1,0,0,0,1|1,0,1]=4 5213 B16R2.252 O=c1nc(cc[nH]1)C=Cc2ccccc2 271570a_100102527694_200000134032 [0,1,0,0,0,1|1,0,1]=4 5214 B16R2.252 O=c1nc(cc[nH]1)NCc2ccccc2 27a_100015324214_200000134032 [0,1,0,0,0,1|2,0,0]=4 5215 B16R2.252 O=c1nc(cc[nH]1)SCc2ccccc2 62a_100000211182_200000134032 [0,1,0,0,0,1|2,0,0]=4 5216 B16R2.252 Oc1cc(ccn1)CNc2ccccc2 207a_100000106764_100000688113 [0,1,0,0,0,1|1,0,1]=4 5217 B16R2.252 Oc1cccc(c1)CNc2ccccc2 207a_100000106764_100000188321 [0,1,0,0,0,1|2,0,0]=4 5218 B16R2.252 Oc1cccc(c1)CNc2ccccc2 34a_100000106764_100011660834 [0,1,0,0,0,1|2,0,0]=4 5219 B16R2.252 Oc1cccc(c1)NCc2ccccc2 270302a_100000210217_100015611070 [0,1,0,0,0,1|2,0,0]=4 5220 B16R2.252 Oc1cccc(c1)NCc2ccccc2 271570a_203496583355_100000224063 [0,1,0,0,0,1|2,0,0]=4 5221 B16R2.252 Oc1cccc(c1)NCc2ccccc2 34a_100000210217_100015291786 [0,1,0,0,0,1|2,0,0]=4 5222 B16R2.252 Oc1cccc(c1)NCc2ccccn2 270302a_100000210217_100000209966 [0,1,0,0,0,1|1,0,0]=3 5223 B16R2.252 Oc1cccc(c1)NCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,0,1|1,0,0]=3 5224 B16R2.252 Oc1cccc(c1)NCc2cccnc2 270302a_100000210217_100000209961 [0,1,0,0,0,1|1,0,0]=3 5225 B16R2.252 Oc1cccc(c1)NCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,0,1|1,0,0]=3 5226 B16R2.252 Oc1cccc(c1)NCc2cccnn2 34a_100000210217_100016990269 [0,1,0,0,0,1|1,0,0]=3 5227 B16R2.252 Oc1cccc(c1)NCc2ccnnc2 270302a_100000210217_100011934578 [0,1,0,0,0,1|1,0,1]=4 5228 B16R2.252 Oc1cccc(c1)NCc2cnccn2 34a_100000210217_100016995436 [0,1,0,0,0,1|0,0,1]=3 5229 B16R2.252 Oc1cccc(c1)NCc2cncnc2 270302a_100000210217_100000749868 [0,1,0,0,0,1|0,0,1]=3 5230 B16R2.252 Oc1cccc(c1)NCc2cncnc2 34a_100000210217_100015196519 [0,1,0,0,0,1|0,0,1]=3 5231 B16R2.252 Oc1cccc(c1)NCc2ncccn2 34a_100000210217_100000703007 [0,1,0,0,0,1|1,0,0]=3 5232 B16R2.252 Oc1cccc(c1)OCc2ccccn2 271570a_203496583355_200011214830 [0,1,0,0,0,1|2,0,0]=4 5233 B16R2.252 Oc1cccc(c1)SCc2ccccn2 62a_100000721315_100000211634 [0,1,0,0,0,1|2,0,0]=4 5234 B16R2.252 Oc1cccc(c1)SCc2cccnc2 62a_100000741622_100000211634 [0,1,0,0,0,1|2,0,0]=4 5235 B16R2.252 Oc1cccc(c1)SCc2cccnn2 62a_100016990269_100000211634 [0,1,0,0,0,1|2,0,0]=4 5236 B16R2.252 Oc1cccc(c1)SCc2cnccn2 62a_100016995436_100000211634 [0,1,0,0,0,1|1,0,1]=4 5237 B16R2.252 Oc1cccc(c1)SCc2cncnc2 62a_100015196519_100000211634 [0,1,0,0,0,1|1,0,1]=4 5238 B16R2.252 Oc1cccc(c1)SCc2ncccn2 62a_100000703007_100000211634 [0,1,0,0,0,1|2,0,0]=4 5239 B16R2.252 Oc1cncc(c1)CNc2ccccc2 207a_100000106764_100012187055 [0,1,0,0,0,1|1,0,0]=3 5240 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_100000721315_114929384022 [0,1,0,0,0,1|2,0,0]=4 5241 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_114929384022_100000721315 [0,1,0,0,0,1|2,0,0]=4 5242 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_100000741622_114929384022 [0,1,0,0,0,1|2,0,0]=4 5243 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_114929384022_100000741622 [0,1,0,0,0,1|2,0,0]=4 5244 B16R2.252 [S]c1cccc(c1)SCc2cccnn2 62a_100016990269_114929384022 [0,1,0,0,0,1|2,0,0]=4 5245 B16R2.252 [S]c1cccc(c1)SCc2cccnn2 62a_114929384022_100016990269 [0,1,0,0,0,1|2,0,0]=4 5246 B16R2.252 [S]c1cccc(c1)SCc2cnccn2 62a_100016995436_114929384022 [0,1,0,0,0,1|1,0,1]=4 5247 B16R2.252 [S]c1cccc(c1)SCc2cnccn2 62a_114929384022_100016995436 [0,1,0,0,0,1|1,0,1]=4 5248 B16R2.252 [S]c1cccc(c1)SCc2cncnc2 62a_100015196519_114929384022 [0,1,0,0,0,1|1,0,1]=4 5249 B16R2.252 [S]c1cccc(c1)SCc2cncnc2 62a_114929384022_100015196519 [0,1,0,0,0,1|1,0,1]=4 5250 B16R2.252 [S]c1cccc(c1)SCc2ncccn2 62a_100000703007_114929384022 [0,1,0,0,0,1|2,0,0]=4 5251 B16R2.252 [S]c1cccc(c1)SCc2ncccn2 62a_114929384022_100000703007 [0,1,0,0,0,1|2,0,0]=4 5252 B16R2.135 Brc1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011740612 [0,1,0,0,0,1|1,0,0]=3 5253 B16R2.135 Brc1ccc(cc1)CCSc2c[nH]cn2 62a_100011740612_100000756875 [0,1,0,0,0,1|1,0,0]=3 5254 B16R2.135 Brc1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011740612 [0,1,0,0,0,1|2,0,0]=4 5255 B16R2.135 Brc1ccc(cc1)CCSc2c[nH]nn2 62a_100011740612_100009819707 [0,1,0,0,0,1|2,0,0]=4 5256 B16R2.135 Brc1ccc(cc1)CCSc2cscn2 62a_100000751502_100011740612 [0,1,0,0,0,1|2,0,0]=4 5257 B16R2.135 Brc1ccc(cc1)CCSc2cscn2 62a_100011740612_100000751502 [0,1,0,0,0,1|2,0,0]=4 5258 B16R2.135 Brc1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011740612 [0,1,0,0,0,1|2,0,0]=4 5259 B16R2.135 Brc1ccc(cc1)CCSc2nc[nH]n2 62a_100011740612_100000761765 [0,1,0,0,0,1|2,0,0]=4 5260 B16R2.135 Brc1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100000186029 [0,1,0,0,0,1|0,0,0]=2 5261 B16R2.135 Brc1ccc(cc1)CNCc2c[nH]cn2 2230a_100000174875_100000707719 [0,1,0,0,0,1|0,0,0]=2 5262 B16R2.135 Brc1ccc(cc1)CNCc2c[nH]cn2 34a_100000174875_100000707719 [0,1,0,0,0,1|0,0,0]=2 5263 B16R2.135 Brc1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100000186029 [0,1,0,0,0,1|1,0,0]=3 5264 B16R2.135 Brc1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100000186029 [0,1,0,0,0,1|1,0,0]=3 5265 B16R2.135 Brc1ccc(cc1)CNCc2cc[nH]n2 207a_100000174875_100000738523 [0,1,0,0,0,1|2,0,0]=4 5266 B16R2.135 Brc1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100000186029 [0,1,0,0,0,1|2,0,0]=4 5267 B16R2.135 Brc1ccc(cc1)CNCc2cc[nH]n2 270004a_100000174875_100000738523 [0,1,0,0,0,1|2,0,0]=4 5268 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 207a_100000174875_100000186105 [0,1,0,0,0,1|2,0,0]=4 5269 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000186029 [0,1,0,0,0,1|2,0,0]=4 5270 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100011217064 [0,1,0,0,0,1|2,0,0]=4 5271 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 270004a_100000174875_100000186105 [0,1,0,0,0,1|2,0,0]=4 5272 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000186029 [0,1,0,0,0,1|2,0,0]=4 5273 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000189115 [0,1,0,0,0,1|2,0,0]=4 5274 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 207a_100000174875_100000209959 [0,1,0,0,0,1|2,0,0]=4 5275 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000186029 [0,1,0,0,0,1|2,0,0]=4 5276 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100011217064 [0,1,0,0,0,1|2,0,0]=4 5277 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 270004a_100000174875_100000209959 [0,1,0,0,0,1|2,0,0]=4 5278 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000186029 [0,1,0,0,0,1|2,0,0]=4 5279 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 207a_100000174875_100011215517 [0,1,0,0,0,1|2,0,0]=4 5280 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000186029 [0,1,0,0,0,1|2,0,0]=4 5281 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100011217064 [0,1,0,0,0,1|2,0,0]=4 5282 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 270004a_100000174875_100011215517 [0,1,0,0,0,1|2,0,0]=4 5283 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000186029 [0,1,0,0,0,1|2,0,0]=4 5284 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000189115 [0,1,0,0,0,1|2,0,0]=4 5285 B16R2.135 Brc1ccc(cc1)CNCc2ccon2 207a_100000688301_100000186029 [0,1,0,0,0,1|2,0,0]=4 5286 B16R2.135 Brc1ccc(cc1)CNCc2ccon2 2230a_100000174875_100000234950 [0,1,0,0,0,1|2,0,0]=4 5287 B16R2.135 Brc1ccc(cc1)CNCc2ccon2 270004a_100000688301_100000186029 [0,1,0,0,0,1|2,0,0]=4 5288 B16R2.135 Brc1ccc(cc1)CNCc2ccon2 34a_100000174875_100000234950 [0,1,0,0,0,1|2,0,0]=4 5289 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 207a_100000174875_100000188534 [0,1,0,0,0,1|2,0,0]=4 5290 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000186029 [0,1,0,0,0,1|2,0,0]=4 5291 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 2230a_100000174875_100011261437 [0,1,0,0,0,1|2,0,0]=4 5292 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100011217064 [0,1,0,0,0,1|2,0,0]=4 5293 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 270004a_100000174875_100000188534 [0,1,0,0,0,1|2,0,0]=4 5294 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000186029 [0,1,0,0,0,1|2,0,0]=4 5295 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 34a_100000174875_100011261437 [0,1,0,0,0,1|2,0,0]=4 5296 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000189115 [0,1,0,0,0,1|2,0,0]=4 5297 B16R2.135 Brc1ccc(cc1)CNCc2cn[nH]c2 207a_100000174875_100016992096 [0,1,0,0,0,1|2,0,0]=4 5298 B16R2.135 Brc1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100000186029 [0,1,0,0,0,1|2,0,0]=4 5299 B16R2.135 Brc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000174875_100016992096 [0,1,0,0,0,1|2,0,0]=4 5300 B16R2.135 Brc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100000186029 [0,1,0,0,0,1|2,0,0]=4 5301 B16R2.135 Brc1ccc(cc1)CNCc2cnc[nH]2 207a_100000174875_100000742939 [0,1,0,0,0,1|0,0,2]=4 5302 B16R2.135 Brc1ccc(cc1)CNCc2cnco2 207a_100020634212_100000186029 [0,1,0,0,0,1|1,0,1]=4 5303 B16R2.135 Brc1ccc(cc1)CNCc2cnco2 270004a_100000174875_100000064291 [0,1,0,0,0,1|1,0,1]=4 5304 B16R2.135 Brc1ccc(cc1)CNCc2cnco2 270004a_100020634212_100000186029 [0,1,0,0,0,1|1,0,1]=4 5305 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 207a_100000174875_100000749870 [0,1,0,0,0,1|1,0,1]=4 5306 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 207a_100016987365_100000186029 [0,1,0,0,0,1|1,0,1]=4 5307 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 2230a_100000174875_100015185245 [0,1,0,0,0,1|1,0,1]=4 5308 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 2230a_100016987365_100011217064 [0,1,0,0,0,1|1,0,1]=4 5309 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 270004a_100000174875_100000749870 [0,1,0,0,0,1|1,0,1]=4 5310 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 270004a_100016987365_100000186029 [0,1,0,0,0,1|1,0,1]=4 5311 B16R2.135 Brc1ccc(cc1)CNCc2cncs2 34a_100000174875_100015185245 [0,1,0,0,0,1|1,0,1]=4 5312 B16R2.135 Brc1ccc(cc1)CNCc2cocn2 207a_100015188801_100000186029 [0,1,0,0,0,1|1,0,0]=3 5313 B16R2.135 Brc1ccc(cc1)CNCc2cocn2 270004a_100000174875_100000050382 [0,1,0,0,0,1|1,0,0]=3 5314 B16R2.135 Brc1ccc(cc1)CNCc2cocn2 270004a_100015188801_100000186029 [0,1,0,0,0,1|1,0,0]=3 5315 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 207a_100000174875_100000743575 [0,1,0,0,0,1|1,0,0]=3 5316 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 207a_100015185402_100000186029 [0,1,0,0,0,1|1,0,0]=3 5317 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 2230a_100000174875_100000205941 [0,1,0,0,0,1|1,0,0]=3 5318 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 2230a_100015185402_100011217064 [0,1,0,0,0,1|1,0,0]=3 5319 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 270004a_100000174875_100000743575 [0,1,0,0,0,1|1,0,0]=3 5320 B16R2.135 Brc1ccc(cc1)CNCc2cscn2 34a_100000174875_100000205941 [0,1,0,0,0,1|1,0,0]=3 5321 B16R2.135 Brc1ccc(cc1)CNCc2csnn2 270004a_100000174875_100000738508 [0,1,0,0,0,1|2,0,0]=4 5322 B16R2.135 Brc1ccc(cc1)CNCc2ncc[nH]2 207a_100000174875_100000743867 [0,1,0,0,0,1|2,0,0]=4 5323 B16R2.135 Brc1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100000186029 [0,1,0,0,0,1|2,0,0]=4 5324 B16R2.135 Brc1ccc(cc1)CNCc2ncc[nH]2 2230a_100000174875_100016991755 [0,1,0,0,0,1|2,0,0]=4 5325 B16R2.135 Brc1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100000186029 [0,1,0,0,0,1|2,0,0]=4 5326 B16R2.135 Brc1ccc(cc1)CNCc2ncc[nH]2 34a_100000174875_100016991755 [0,1,0,0,0,1|2,0,0]=4 5327 B16R2.135 Brc1ccc(cc1)CNCc2ncco2 207a_100016994969_100000186029 [0,1,0,0,0,1|2,0,0]=4 5328 B16R2.135 Brc1ccc(cc1)CNCc2ncco2 2230a_100000174875_103436540062 [0,1,0,0,0,1|2,0,0]=4 5329 B16R2.135 Brc1ccc(cc1)CNCc2ncco2 2230a_100016994969_100011217064 [0,1,0,0,0,1|2,0,0]=4 5330 B16R2.135 Brc1ccc(cc1)CNCc2ncco2 270004a_100000174875_100000064290 [0,1,0,0,0,1|2,0,0]=4 5331 B16R2.135 Brc1ccc(cc1)CNCc2ncco2 34a_100000174875_103436540062 [0,1,0,0,0,1|2,0,0]=4 5332 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 207a_100000174875_100000750902 [0,1,0,0,0,1|2,0,0]=4 5333 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 207a_100000740555_100000186029 [0,1,0,0,0,1|2,0,0]=4 5334 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 2230a_100000174875_100015184050 [0,1,0,0,0,1|2,0,0]=4 5335 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 2230a_100000740555_100011217064 [0,1,0,0,0,1|2,0,0]=4 5336 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 270004a_100000174875_100000750902 [0,1,0,0,0,1|2,0,0]=4 5337 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 270004a_100000740555_100000186029 [0,1,0,0,0,1|2,0,0]=4 5338 B16R2.135 Brc1ccc(cc1)CNCc2nccs2 34a_100000174875_100015184050 [0,1,0,0,0,1|2,0,0]=4 5339 B16R2.135 Brc1ccc(cc1)CNCc2ncon2 34a_100000174875_100000233494 [0,1,0,0,0,1|2,0,0]=4 5340 B16R2.135 Brc1ccc(cc1)CNCn2cncn2 2230a_100000174875_200020645497 [0,1,0,0,0,1|1,0,1]=4 5341 B16R2.135 Brc1ccc(cc1)CNCn2cncn2 34a_100000174875_200020645497 [0,1,0,0,0,1|1,0,1]=4 5342 B16R2.135 Brc1ccc(cc1)COCc2c[nH]cn2 34a_100000695286_100000707719 [0,1,0,0,0,1|1,0,0]=3 5343 B16R2.135 Brc1ccc(cc1)COCc2cscn2 34a_100000695286_100000205941 [0,1,0,0,0,1|2,0,0]=4 5344 B16R2.135 Brc1ccc(cc1)CSCc2c[nH]cn2 62a_100000189115_100000707719 [0,1,0,0,0,1|1,0,0]=3 5345 B16R2.135 Brc1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100000189115 [0,1,0,0,0,1|1,0,0]=3 5346 B16R2.135 Brc1ccc(cc1)CSCc2cscn2 62a_100000189115_100000205941 [0,1,0,0,0,1|2,0,0]=4 5347 B16R2.135 Brc1ccc(cc1)CSCc2cscn2 62a_100000205941_100000189115 [0,1,0,0,0,1|2,0,0]=4 5348 B16R2.135 Brc1ccc(cc1)NCCc2c[nH]cn2 2230a_100000210018_100020628418 [0,1,0,0,0,1|0,0,0]=2 5349 B16R2.135 Brc1ccc(cc1)NCCc2cccs2 2230a_100000210018_100000748579 [0,1,0,0,0,1|2,0,0]=4 5350 B16R2.135 Brc1ccc(cc1)NCCc2cccs2 34a_100000210018_100000748579 [0,1,0,0,0,1|2,0,0]=4 5351 B16R2.135 Brc1ccc(cc1)NCCc2cn[nH]c2 2230a_100000210018_100000743252 [0,1,0,0,0,1|2,0,0]=4 5352 B16R2.135 Brc1ccc(cc1)NCCn2cccn2 2230a_100000210018_100000685285 [0,1,0,0,0,1|2,0,0]=4 5353 B16R2.135 Brc1ccc(cc1)NCCn2cccn2 34a_100000210018_100015204718 [0,1,0,0,0,1|2,0,0]=4 5354 B16R2.135 Brc1ccc(cc1)NCCn2cncn2 2230a_100000210018_100000731791 [0,1,0,0,0,1|1,0,1]=4 5355 B16R2.135 Brc1ccc(cc1)NCCn2cncn2 34a_100000210018_200000749826 [0,1,0,0,0,1|1,0,1]=4 5356 B16R2.135 Brc1ccc(cc1)NN=Cc2cc[nH]c2 4a_100000735608_100000760201 [0,1,0,0,0,1|1,0,1]=4 5357 B16R2.135 Brc1ccc(cc1)NN=Cc2cocn2 4a_100000735608_100000050382 [0,1,0,0,0,1|1,0,1]=4 5358 B16R2.135 Brc1ccc(cc1)NN=Cc2cscn2 4a_100000735608_100000743575 [0,1,0,0,0,1|1,0,1]=4 5359 B16R2.135 Brc1ccc(cc1)OCCc2c[nH]cn2 7a_100000185759_100020628418 [0,1,0,0,0,1|1,0,0]=3 5360 B16R2.135 Brc1ccc(cc1)SCCc2c[nH]cn2 62a_100000752885_100020628418 [0,1,0,0,0,1|1,0,0]=3 5361 B16R2.135 Brc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000752885 [0,1,0,0,0,1|1,0,0]=3 5362 B16R2.135 Brc1ccc(cn1)CNCc2c[nH]cn2 2230a_100009817727_100000707719 [0,1,0,0,0,1|1,0,0]=3 5363 B16R2.135 Brc1ccc(cn1)CNCc2c[nH]cn2 34a_100009817727_100000707719 [0,1,0,0,0,1|1,0,0]=3 5364 B16R2.135 Brc1ccc(cn1)CNCc2cocn2 270004a_100009817727_100000050382 [0,1,0,0,0,1|2,0,0]=4 5365 B16R2.135 Brc1ccc(cn1)CNCc2cscn2 207a_100009817727_100000743575 [0,1,0,0,0,1|2,0,0]=4 5366 B16R2.135 Brc1ccc(cn1)CNCc2cscn2 2230a_100009817727_100000205941 [0,1,0,0,0,1|2,0,0]=4 5367 B16R2.135 Brc1ccc(cn1)CNCc2cscn2 2230a_100015185402_100009831999 [0,1,0,0,0,1|2,0,0]=4 5368 B16R2.135 Brc1ccc(cn1)CNCc2cscn2 270004a_100009817727_100000743575 [0,1,0,0,0,1|2,0,0]=4 5369 B16R2.135 Brc1ccc(cn1)CNCc2cscn2 34a_100009817727_100000205941 [0,1,0,0,0,1|2,0,0]=4 5370 B16R2.135 Brc1ccc(cn1)COCc2c[nH]cn2 34a_100009816760_100000707719 [0,1,0,0,0,1|2,0,0]=4 5371 B16R2.135 Brc1ccc(cn1)CSCc2c[nH]cn2 62a_100000707719_100009831999 [0,1,0,0,0,1|2,0,0]=4 5372 B16R2.135 Brc1ccc(cn1)CSCc2c[nH]cn2 62a_100009831999_100000707719 [0,1,0,0,0,1|2,0,0]=4 5373 B16R2.135 Brc1ccc(cn1)OCCc2c[nH]cn2 7a_100000685995_100020628418 [0,1,0,0,0,1|2,0,0]=4 5374 B16R2.135 Brc1ccc(cn1)SCCc2c[nH]cn2 62a_100009814638_100020628418 [0,1,0,0,0,1|2,0,0]=4 5375 B16R2.135 Brc1ccc(cn1)SCCc2c[nH]cn2 62a_100020628418_100009814638 [0,1,0,0,0,1|2,0,0]=4 5376 B16R2.135 Brc1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100000754260 [0,1,0,0,0,1|1,0,0]=3 5377 B16R2.135 Brc1ccc(nc1)CNCc2c[nH]cn2 34a_100015188789_100000707719 [0,1,0,0,0,1|1,0,0]=3 5378 B16R2.135 Brc1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100000754260 [0,1,0,0,0,1|2,0,0]=4 5379 B16R2.135 Brc1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100000754260 [0,1,0,0,0,1|2,0,0]=4 5380 B16R2.135 Brc1ccc(nc1)CNCc2cocn2 207a_100015188801_100000754260 [0,1,0,0,0,1|2,0,0]=4 5381 B16R2.135 Brc1ccc(nc1)CNCc2cocn2 270004a_100015188801_100000754260 [0,1,0,0,0,1|2,0,0]=4 5382 B16R2.135 Brc1ccc(nc1)CNCc2cscn2 207a_100015185402_100000754260 [0,1,0,0,0,1|2,0,0]=4 5383 B16R2.135 Brc1ccc(nc1)CNCc2cscn2 2230a_100015185402_100000702658 [0,1,0,0,0,1|2,0,0]=4 5384 B16R2.135 Brc1ccc(nc1)CNCc2cscn2 34a_100015188789_100000205941 [0,1,0,0,0,1|2,0,0]=4 5385 B16R2.135 Brc1ccc(nc1)COCc2c[nH]cn2 34a_100000754261_100000707719 [0,1,0,0,0,1|2,0,0]=4 5386 B16R2.135 Brc1ccc(nc1)CSCc2c[nH]cn2 62a_100000702658_100000707719 [0,1,0,0,0,1|2,0,0]=4 5387 B16R2.135 Brc1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000702658 [0,1,0,0,0,1|2,0,0]=4 5388 B16R2.135 Brc1ccc(nc1)NCCc2c[nH]cn2 27a_100000755092_100000686858 [0,1,0,0,0,1|1,0,0]=3 5389 B16R2.135 Brc1ccc(nc1)SCCc2c[nH]cn2 62a_100000686858_100020628418 [0,1,0,0,0,1|2,0,0]=4 5390 B16R2.135 Brc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000686858 [0,1,0,0,0,1|2,0,0]=4 5391 B16R2.135 Brc1cnc(cn1)NCCc2c[nH]cn2 27a_100000755092_100010187541 [0,1,0,0,0,1|2,0,0]=4 5392 B16R2.135 Brc1cnc(nc1)NCCc2c[nH]cn2 27a_100000755092_100000690281 [0,1,0,0,0,1|2,0,0]=4 5393 B16R2.135 C[n+]1ccc(cc1)COCc2c[nH]cn2 34a_100009831711_100000707719 [0,1,0,0,0,1|2,0,0]=4 5394 B16R2.135 Cc1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011713686 [0,1,0,0,0,1|1,0,0]=3 5395 B16R2.135 Cc1ccc(cc1)CCSc2c[nH]cn2 62a_100011713686_100000756875 [0,1,0,0,0,1|1,0,0]=3 5396 B16R2.135 Cc1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011713686 [0,1,0,0,0,1|2,0,0]=4 5397 B16R2.135 Cc1ccc(cc1)CCSc2c[nH]nn2 62a_100011713686_100009819707 [0,1,0,0,0,1|2,0,0]=4 5398 B16R2.135 Cc1ccc(cc1)CCSc2cscn2 62a_100000751502_100011713686 [0,1,0,0,0,1|2,0,0]=4 5399 B16R2.135 Cc1ccc(cc1)CCSc2cscn2 62a_100011713686_100000751502 [0,1,0,0,0,1|2,0,0]=4 5400 B16R2.135 Cc1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011713686 [0,1,0,0,0,1|2,0,0]=4 5401 B16R2.135 Cc1ccc(cc1)CCSc2nc[nH]n2 62a_100011713686_100000761765 [0,1,0,0,0,1|2,0,0]=4 5402 B16R2.135 Cc1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100000211033 [0,1,0,0,0,1|0,0,0]=2 5403 B16R2.135 Cc1ccc(cc1)CNCc2c[nH]cn2 2230a_100000174908_100000707719 [0,1,0,0,0,1|0,0,0]=2 5404 B16R2.135 Cc1ccc(cc1)CNCc2c[nH]cn2 34a_100000174908_100000707719 [0,1,0,0,0,1|0,0,0]=2 5405 B16R2.135 Cc1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100000211033 [0,1,0,0,0,1|1,0,0]=3 5406 B16R2.135 Cc1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100000211033 [0,1,0,0,0,1|1,0,0]=3 5407 B16R2.135 Cc1ccc(cc1)CNCc2cc[nH]n2 207a_100000174908_100000738523 [0,1,0,0,0,1|2,0,0]=4 5408 B16R2.135 Cc1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100000211033 [0,1,0,0,0,1|2,0,0]=4 5409 B16R2.135 Cc1ccc(cc1)CNCc2cc[nH]n2 270004a_100000174908_100000738523 [0,1,0,0,0,1|2,0,0]=4 5410 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 207a_100000174908_100000186105 [0,1,0,0,0,1|2,0,0]=4 5411 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000211033 [0,1,0,0,0,1|2,0,0]=4 5412 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000210814 [0,1,0,0,0,1|2,0,0]=4 5413 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 270004a_100000174908_100000186105 [0,1,0,0,0,1|2,0,0]=4 5414 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000211033 [0,1,0,0,0,1|2,0,0]=4 5415 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000210814 [0,1,0,0,0,1|2,0,0]=4 5416 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 207a_100000174908_100000209959 [0,1,0,0,0,1|2,0,0]=4 5417 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000211033 [0,1,0,0,0,1|2,0,0]=4 5418 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000210814 [0,1,0,0,0,1|2,0,0]=4 5419 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 270004a_100000174908_100000209959 [0,1,0,0,0,1|2,0,0]=4 5420 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000211033 [0,1,0,0,0,1|2,0,0]=4 5421 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 207a_100000174908_100011215517 [0,1,0,0,0,1|2,0,0]=4 5422 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000211033 [0,1,0,0,0,1|2,0,0]=4 5423 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000210814 [0,1,0,0,0,1|2,0,0]=4 5424 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 270004a_100000174908_100011215517 [0,1,0,0,0,1|2,0,0]=4 5425 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000211033 [0,1,0,0,0,1|2,0,0]=4 5426 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000210814 [0,1,0,0,0,1|2,0,0]=4 5427 B16R2.135 Cc1ccc(cc1)CNCc2ccon2 207a_100000688301_100000211033 [0,1,0,0,0,1|2,0,0]=4 5428 B16R2.135 Cc1ccc(cc1)CNCc2ccon2 2230a_100000174908_100000234950 [0,1,0,0,0,1|2,0,0]=4 5429 B16R2.135 Cc1ccc(cc1)CNCc2ccon2 270004a_100000688301_100000211033 [0,1,0,0,0,1|2,0,0]=4 5430 B16R2.135 Cc1ccc(cc1)CNCc2ccon2 34a_100000174908_100000234950 [0,1,0,0,0,1|2,0,0]=4 5431 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 207a_100000174908_100000188534 [0,1,0,0,0,1|2,0,0]=4 5432 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000211033 [0,1,0,0,0,1|2,0,0]=4 5433 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 2230a_100000174908_100011261437 [0,1,0,0,0,1|2,0,0]=4 5434 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000210814 [0,1,0,0,0,1|2,0,0]=4 5435 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 270004a_100000174908_100000188534 [0,1,0,0,0,1|2,0,0]=4 5436 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000211033 [0,1,0,0,0,1|2,0,0]=4 5437 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 34a_100000174908_100011261437 [0,1,0,0,0,1|2,0,0]=4 5438 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000210814 [0,1,0,0,0,1|2,0,0]=4 5439 B16R2.135 Cc1ccc(cc1)CNCc2cn[nH]c2 207a_100000174908_100016992096 [0,1,0,0,0,1|2,0,0]=4 5440 B16R2.135 Cc1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100000211033 [0,1,0,0,0,1|2,0,0]=4 5441 B16R2.135 Cc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000174908_100016992096 [0,1,0,0,0,1|2,0,0]=4 5442 B16R2.135 Cc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100000211033 [0,1,0,0,0,1|2,0,0]=4 5443 B16R2.135 Cc1ccc(cc1)CNCc2cnc[nH]2 207a_100000174908_100000742939 [0,1,0,0,0,1|0,0,2]=4 5444 B16R2.135 Cc1ccc(cc1)CNCc2cnco2 207a_100020634212_100000211033 [0,1,0,0,0,1|1,0,1]=4 5445 B16R2.135 Cc1ccc(cc1)CNCc2cnco2 270004a_100000174908_100000064291 [0,1,0,0,0,1|1,0,1]=4 5446 B16R2.135 Cc1ccc(cc1)CNCc2cnco2 270004a_100020634212_100000211033 [0,1,0,0,0,1|1,0,1]=4 5447 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 207a_100000174908_100000749870 [0,1,0,0,0,1|1,0,1]=4 5448 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 207a_100016987365_100000211033 [0,1,0,0,0,1|1,0,1]=4 5449 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 2230a_100000174908_100015185245 [0,1,0,0,0,1|1,0,1]=4 5450 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 2230a_100016987365_100000210814 [0,1,0,0,0,1|1,0,1]=4 5451 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 270004a_100000174908_100000749870 [0,1,0,0,0,1|1,0,1]=4 5452 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 270004a_100016987365_100000211033 [0,1,0,0,0,1|1,0,1]=4 5453 B16R2.135 Cc1ccc(cc1)CNCc2cncs2 34a_100000174908_100015185245 [0,1,0,0,0,1|1,0,1]=4 5454 B16R2.135 Cc1ccc(cc1)CNCc2cocn2 207a_100015188801_100000211033 [0,1,0,0,0,1|1,0,0]=3 5455 B16R2.135 Cc1ccc(cc1)CNCc2cocn2 270004a_100000174908_100000050382 [0,1,0,0,0,1|1,0,0]=3 5456 B16R2.135 Cc1ccc(cc1)CNCc2cocn2 270004a_100015188801_100000211033 [0,1,0,0,0,1|1,0,0]=3 5457 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 207a_100000174908_100000743575 [0,1,0,0,0,1|1,0,0]=3 5458 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 207a_100015185402_100000211033 [0,1,0,0,0,1|1,0,0]=3 5459 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 2230a_100000174908_100000205941 [0,1,0,0,0,1|1,0,0]=3 5460 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 2230a_100015185402_100000210814 [0,1,0,0,0,1|1,0,0]=3 5461 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 270004a_100000174908_100000743575 [0,1,0,0,0,1|1,0,0]=3 5462 B16R2.135 Cc1ccc(cc1)CNCc2cscn2 34a_100000174908_100000205941 [0,1,0,0,0,1|1,0,0]=3 5463 B16R2.135 Cc1ccc(cc1)CNCc2csnn2 270004a_100000174908_100000738508 [0,1,0,0,0,1|2,0,0]=4 5464 B16R2.135 Cc1ccc(cc1)CNCc2ncc[nH]2 207a_100000174908_100000743867 [0,1,0,0,0,1|2,0,0]=4 5465 B16R2.135 Cc1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100000211033 [0,1,0,0,0,1|2,0,0]=4 5466 B16R2.135 Cc1ccc(cc1)CNCc2ncc[nH]2 2230a_100000174908_100016991755 [0,1,0,0,0,1|2,0,0]=4 5467 B16R2.135 Cc1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100000211033 [0,1,0,0,0,1|2,0,0]=4 5468 B16R2.135 Cc1ccc(cc1)CNCc2ncc[nH]2 34a_100000174908_100016991755 [0,1,0,0,0,1|2,0,0]=4 5469 B16R2.135 Cc1ccc(cc1)CNCc2ncco2 207a_100016994969_100000211033 [0,1,0,0,0,1|2,0,0]=4 5470 B16R2.135 Cc1ccc(cc1)CNCc2ncco2 2230a_100000174908_103436540062 [0,1,0,0,0,1|2,0,0]=4 5471 B16R2.135 Cc1ccc(cc1)CNCc2ncco2 2230a_100016994969_100000210814 [0,1,0,0,0,1|2,0,0]=4 5472 B16R2.135 Cc1ccc(cc1)CNCc2ncco2 270004a_100000174908_100000064290 [0,1,0,0,0,1|2,0,0]=4 5473 B16R2.135 Cc1ccc(cc1)CNCc2ncco2 34a_100000174908_103436540062 [0,1,0,0,0,1|2,0,0]=4 5474 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 207a_100000174908_100000750902 [0,1,0,0,0,1|2,0,0]=4 5475 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 207a_100000740555_100000211033 [0,1,0,0,0,1|2,0,0]=4 5476 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 2230a_100000174908_100015184050 [0,1,0,0,0,1|2,0,0]=4 5477 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 2230a_100000740555_100000210814 [0,1,0,0,0,1|2,0,0]=4 5478 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 270004a_100000174908_100000750902 [0,1,0,0,0,1|2,0,0]=4 5479 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 270004a_100000740555_100000211033 [0,1,0,0,0,1|2,0,0]=4 5480 B16R2.135 Cc1ccc(cc1)CNCc2nccs2 34a_100000174908_100015184050 [0,1,0,0,0,1|2,0,0]=4 5481 B16R2.135 Cc1ccc(cc1)CNCc2ncon2 34a_100000174908_100000233494 [0,1,0,0,0,1|2,0,0]=4 5482 B16R2.135 Cc1ccc(cc1)CNCn2cncn2 2230a_100000174908_200020645497 [0,1,0,0,0,1|1,0,1]=4 5483 B16R2.135 Cc1ccc(cc1)CNCn2cncn2 34a_100000174908_200020645497 [0,1,0,0,0,1|1,0,1]=4 5484 B16R2.135 Cc1ccc(cc1)COCc2c[nH]cn2 34a_100011215236_100000707719 [0,1,0,0,0,1|1,0,0]=3 5485 B16R2.135 Cc1ccc(cc1)COCc2cscn2 34a_100011215236_100000205941 [0,1,0,0,0,1|2,0,0]=4 5486 B16R2.135 Cc1ccc(cc1)COCc2cscn2 7a_100011215236_100000205941 [0,1,0,0,0,1|2,0,0]=4 5487 B16R2.135 Cc1ccc(cc1)CSCc2c[nH]cn2 62a_100000210814_100000707719 [0,1,0,0,0,1|1,0,0]=3 5488 B16R2.135 Cc1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100000210814 [0,1,0,0,0,1|1,0,0]=3 5489 B16R2.135 Cc1ccc(cc1)CSCc2cscn2 62a_100000205941_100000210814 [0,1,0,0,0,1|2,0,0]=4 5490 B16R2.135 Cc1ccc(cc1)CSCc2cscn2 62a_100000210814_100000205941 [0,1,0,0,0,1|2,0,0]=4 5491 B16R2.135 Cc1ccc(cc1)NCCc2cccs2 34a_100000124888_100000748579 [0,1,0,0,0,1|2,0,0]=4 5492 B16R2.135 Cc1ccc(cc1)NCCn2cccn2 34a_100000124888_100015204718 [0,1,0,0,0,1|2,0,0]=4 5493 B16R2.135 Cc1ccc(cc1)NCCn2cncn2 34a_100000124888_200000749826 [0,1,0,0,0,1|1,0,1]=4 5494 B16R2.135 Cc1ccc(cc1)NN=Cc2cc[nH]c2 4a_100000683527_100000760201 [0,1,0,0,0,1|1,0,1]=4 5495 B16R2.135 Cc1ccc(cc1)NN=Cc2cocn2 4a_100000683527_100000050382 [0,1,0,0,0,1|1,0,1]=4 5496 B16R2.135 Cc1ccc(cc1)NN=Cc2cscn2 4a_100000683527_100000743575 [0,1,0,0,0,1|1,0,1]=4 5497 B16R2.135 Cc1ccc(cc1)OCCc2c[nH]cn2 7a_100000210336_100020628418 [0,1,0,0,0,1|1,0,0]=3 5498 B16R2.135 Cc1ccc(cc1)SCCc2c[nH]cn2 62a_100000186775_100020628418 [0,1,0,0,0,1|1,0,0]=3 5499 B16R2.135 Cc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000186775 [0,1,0,0,0,1|1,0,0]=3 5500 B16R2.135 Cc1ccc(cn1)CNCc2c[nH]cn2 34a_100000740942_100000707719 [0,1,0,0,0,1|1,0,0]=3 5501 B16R2.135 Cc1ccc(cn1)CNCc2c[nH]nn2 270004a_100020620823_100000743784 [0,1,0,0,0,1|2,0,0]=4 5502 B16R2.135 Cc1ccc(cn1)CNCc2cocn2 270004a_100000740942_100000050382 [0,1,0,0,0,1|2,0,0]=4 5503 B16R2.135 Cc1ccc(cn1)CNCc2cocn2 270004a_100015188801_100000743784 [0,1,0,0,0,1|2,0,0]=4 5504 B16R2.135 Cc1ccc(cn1)CNCc2cscn2 207a_100000740942_100000743575 [0,1,0,0,0,1|2,0,0]=4 5505 B16R2.135 Cc1ccc(cn1)CNCc2cscn2 2230a_100015185402_100016987292 [0,1,0,0,0,1|2,0,0]=4 5506 B16R2.135 Cc1ccc(cn1)CNCc2cscn2 270004a_100000740942_100000743575 [0,1,0,0,0,1|2,0,0]=4 5507 B16R2.135 Cc1ccc(cn1)CNCc2cscn2 34a_100000740942_100000205941 [0,1,0,0,0,1|2,0,0]=4 5508 B16R2.135 Cc1ccc(cn1)COCc2c[nH]cn2 34a_100011248133_100000707719 [0,1,0,0,0,1|2,0,0]=4 5509 B16R2.135 Cc1ccc(cn1)CSCc2c[nH]cn2 62a_100000707719_100016987292 [0,1,0,0,0,1|2,0,0]=4 5510 B16R2.135 Cc1ccc(cn1)CSCc2c[nH]cn2 62a_100016987292_100000707719 [0,1,0,0,0,1|2,0,0]=4 5511 B16R2.135 Cc1ccc(cn1)OCCc2c[nH]cn2 7a_100000745506_100020628418 [0,1,0,0,0,1|2,0,0]=4 5512 B16R2.135 Cc1ccc(cn1)SCCc2c[nH]cn2 62a_100000751577_100020628418 [0,1,0,0,0,1|2,0,0]=4 5513 B16R2.135 Cc1ccc(cn1)SCCc2c[nH]cn2 62a_100020628418_100000751577 [0,1,0,0,0,1|2,0,0]=4 5514 B16R2.135 Cc1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100000050478 [0,1,0,0,0,1|1,0,0]=3 5515 B16R2.135 Cc1ccc(nc1)CNCc2c[nH]cn2 34a_100015187455_100000707719 [0,1,0,0,0,1|1,0,0]=3 5516 B16R2.135 Cc1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100000050478 [0,1,0,0,0,1|2,0,0]=4 5517 B16R2.135 Cc1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100000050478 [0,1,0,0,0,1|2,0,0]=4 5518 B16R2.135 Cc1ccc(nc1)CNCc2cocn2 207a_100015188801_100000050478 [0,1,0,0,0,1|2,0,0]=4 5519 B16R2.135 Cc1ccc(nc1)CNCc2cocn2 270004a_100015188801_100000050478 [0,1,0,0,0,1|2,0,0]=4 5520 B16R2.135 Cc1ccc(nc1)CNCc2cscn2 207a_100015185402_100000050478 [0,1,0,0,0,1|2,0,0]=4 5521 B16R2.135 Cc1ccc(nc1)CNCc2cscn2 2230a_100015185402_100000691093 [0,1,0,0,0,1|2,0,0]=4 5522 B16R2.135 Cc1ccc(nc1)CNCc2cscn2 34a_100015187455_100000205941 [0,1,0,0,0,1|2,0,0]=4 5523 B16R2.135 Cc1ccc(nc1)COCc2c[nH]cn2 34a_100012001401_100000707719 [0,1,0,0,0,1|2,0,0]=4 5524 B16R2.135 Cc1ccc(nc1)CSCc2c[nH]cn2 62a_100000691093_100000707719 [0,1,0,0,0,1|2,0,0]=4 5525 B16R2.135 Cc1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000691093 [0,1,0,0,0,1|2,0,0]=4 5526 B16R2.135 Cc1ccc(nc1)SCCc2c[nH]cn2 62a_100011192072_100020628418 [0,1,0,0,0,1|2,0,0]=4 5527 B16R2.135 Cc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000754016 [0,1,0,0,0,1|2,0,0]=4 5528 B16R2.135 Cc1ccc(nn1)NCCc2c[nH]cn2 27a_100000755092_100000744512 [0,1,0,0,0,1|2,0,0]=4 5529 B16R2.135 Cc1cnc(cn1)CNCc2c[nH]cn2 34a_100132314150_100000707719 [0,1,0,0,0,1|2,0,0]=4 5530 B16R2.135 Cc1cnc(cn1)NCCc2c[nH]cn2 27a_100000755092_100000074397 [0,1,0,0,0,1|2,0,0]=4 5531 B16R2.135 Cc1cnc(nc1)NCCc2c[nH]cn2 27a_100000755092_100000061069 [0,1,0,0,0,1|2,0,0]=4 5532 B16R2.135 Clc1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011713675 [0,1,0,0,0,1|1,0,0]=3 5533 B16R2.135 Clc1ccc(cc1)CCSc2c[nH]cn2 62a_100011713675_100000756875 [0,1,0,0,0,1|1,0,0]=3 5534 B16R2.135 Clc1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011713675 [0,1,0,0,0,1|2,0,0]=4 5535 B16R2.135 Clc1ccc(cc1)CCSc2c[nH]nn2 62a_100011713675_100009819707 [0,1,0,0,0,1|2,0,0]=4 5536 B16R2.135 Clc1ccc(cc1)CCSc2cscn2 62a_100000751502_100011713675 [0,1,0,0,0,1|2,0,0]=4 5537 B16R2.135 Clc1ccc(cc1)CCSc2cscn2 62a_100011713675_100000751502 [0,1,0,0,0,1|2,0,0]=4 5538 B16R2.135 Clc1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011713675 [0,1,0,0,0,1|2,0,0]=4 5539 B16R2.135 Clc1ccc(cc1)CCSc2nc[nH]n2 62a_100011713675_100000761765 [0,1,0,0,0,1|2,0,0]=4 5540 B16R2.135 Clc1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100000189385 [0,1,0,0,0,1|0,0,0]=2 5541 B16R2.135 Clc1ccc(cc1)CNCc2c[nH]cn2 2230a_100000174871_100000707719 [0,1,0,0,0,1|0,0,0]=2 5542 B16R2.135 Clc1ccc(cc1)CNCc2c[nH]cn2 34a_100000174871_100000707719 [0,1,0,0,0,1|0,0,0]=2 5543 B16R2.135 Clc1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100000189385 [0,1,0,0,0,1|1,0,0]=3 5544 B16R2.135 Clc1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100000189385 [0,1,0,0,0,1|1,0,0]=3 5545 B16R2.135 Clc1ccc(cc1)CNCc2cc[nH]n2 207a_100000174871_100000738523 [0,1,0,0,0,1|2,0,0]=4 5546 B16R2.135 Clc1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100000189385 [0,1,0,0,0,1|2,0,0]=4 5547 B16R2.135 Clc1ccc(cc1)CNCc2cc[nH]n2 270004a_100000174871_100000738523 [0,1,0,0,0,1|2,0,0]=4 5548 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 207a_100000174871_100000186105 [0,1,0,0,0,1|2,0,0]=4 5549 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000189385 [0,1,0,0,0,1|2,0,0]=4 5550 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000694040 [0,1,0,0,0,1|2,0,0]=4 5551 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 270004a_100000174871_100000186105 [0,1,0,0,0,1|2,0,0]=4 5552 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000189385 [0,1,0,0,0,1|2,0,0]=4 5553 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000694040 [0,1,0,0,0,1|2,0,0]=4 5554 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 207a_100000174871_100000209959 [0,1,0,0,0,1|2,0,0]=4 5555 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000189385 [0,1,0,0,0,1|2,0,0]=4 5556 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000694040 [0,1,0,0,0,1|2,0,0]=4 5557 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 270004a_100000174871_100000209959 [0,1,0,0,0,1|2,0,0]=4 5558 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000189385 [0,1,0,0,0,1|2,0,0]=4 5559 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 207a_100000174871_100011215517 [0,1,0,0,0,1|2,0,0]=4 5560 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000189385 [0,1,0,0,0,1|2,0,0]=4 5561 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000694040 [0,1,0,0,0,1|2,0,0]=4 5562 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 270004a_100000174871_100011215517 [0,1,0,0,0,1|2,0,0]=4 5563 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000189385 [0,1,0,0,0,1|2,0,0]=4 5564 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000694040 [0,1,0,0,0,1|2,0,0]=4 5565 B16R2.135 Clc1ccc(cc1)CNCc2ccon2 207a_100000688301_100000189385 [0,1,0,0,0,1|2,0,0]=4 5566 B16R2.135 Clc1ccc(cc1)CNCc2ccon2 2230a_100000174871_100000234950 [0,1,0,0,0,1|2,0,0]=4 5567 B16R2.135 Clc1ccc(cc1)CNCc2ccon2 270004a_100000688301_100000189385 [0,1,0,0,0,1|2,0,0]=4 5568 B16R2.135 Clc1ccc(cc1)CNCc2ccon2 34a_100000174871_100000234950 [0,1,0,0,0,1|2,0,0]=4 5569 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 207a_100000174871_100000188534 [0,1,0,0,0,1|2,0,0]=4 5570 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000189385 [0,1,0,0,0,1|2,0,0]=4 5571 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 2230a_100000174871_100011261437 [0,1,0,0,0,1|2,0,0]=4 5572 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000694040 [0,1,0,0,0,1|2,0,0]=4 5573 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 270004a_100000174871_100000188534 [0,1,0,0,0,1|2,0,0]=4 5574 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000189385 [0,1,0,0,0,1|2,0,0]=4 5575 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 34a_100000174871_100011261437 [0,1,0,0,0,1|2,0,0]=4 5576 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000694040 [0,1,0,0,0,1|2,0,0]=4 5577 B16R2.135 Clc1ccc(cc1)CNCc2cn[nH]c2 207a_100000174871_100016992096 [0,1,0,0,0,1|2,0,0]=4 5578 B16R2.135 Clc1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100000189385 [0,1,0,0,0,1|2,0,0]=4 5579 B16R2.135 Clc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000174871_100016992096 [0,1,0,0,0,1|2,0,0]=4 5580 B16R2.135 Clc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100000189385 [0,1,0,0,0,1|2,0,0]=4 5581 B16R2.135 Clc1ccc(cc1)CNCc2cnc[nH]2 207a_100000174871_100000742939 [0,1,0,0,0,1|0,0,2]=4 5582 B16R2.135 Clc1ccc(cc1)CNCc2cnco2 207a_100020634212_100000189385 [0,1,0,0,0,1|1,0,1]=4 5583 B16R2.135 Clc1ccc(cc1)CNCc2cnco2 270004a_100000174871_100000064291 [0,1,0,0,0,1|1,0,1]=4 5584 B16R2.135 Clc1ccc(cc1)CNCc2cnco2 270004a_100020634212_100000189385 [0,1,0,0,0,1|1,0,1]=4 5585 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 207a_100000174871_100000749870 [0,1,0,0,0,1|1,0,1]=4 5586 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 207a_100016987365_100000189385 [0,1,0,0,0,1|1,0,1]=4 5587 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 2230a_100000174871_100015185245 [0,1,0,0,0,1|1,0,1]=4 5588 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 2230a_100016987365_100000694040 [0,1,0,0,0,1|1,0,1]=4 5589 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 270004a_100000174871_100000749870 [0,1,0,0,0,1|1,0,1]=4 5590 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 270004a_100016987365_100000189385 [0,1,0,0,0,1|1,0,1]=4 5591 B16R2.135 Clc1ccc(cc1)CNCc2cncs2 34a_100000174871_100015185245 [0,1,0,0,0,1|1,0,1]=4 5592 B16R2.135 Clc1ccc(cc1)CNCc2cocn2 207a_100015188801_100000189385 [0,1,0,0,0,1|1,0,0]=3 5593 B16R2.135 Clc1ccc(cc1)CNCc2cocn2 270004a_100000174871_100000050382 [0,1,0,0,0,1|1,0,0]=3 5594 B16R2.135 Clc1ccc(cc1)CNCc2cocn2 270004a_100015188801_100000189385 [0,1,0,0,0,1|1,0,0]=3 5595 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 207a_100000174871_100000743575 [0,1,0,0,0,1|1,0,0]=3 5596 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 207a_100015185402_100000189385 [0,1,0,0,0,1|1,0,0]=3 5597 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 2230a_100000174871_100000205941 [0,1,0,0,0,1|1,0,0]=3 5598 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 2230a_100015185402_100000694040 [0,1,0,0,0,1|1,0,0]=3 5599 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 270004a_100000174871_100000743575 [0,1,0,0,0,1|1,0,0]=3 5600 B16R2.135 Clc1ccc(cc1)CNCc2cscn2 34a_100000174871_100000205941 [0,1,0,0,0,1|1,0,0]=3 5601 B16R2.135 Clc1ccc(cc1)CNCc2csnn2 270004a_100000174871_100000738508 [0,1,0,0,0,1|2,0,0]=4 5602 B16R2.135 Clc1ccc(cc1)CNCc2ncc[nH]2 207a_100000174871_100000743867 [0,1,0,0,0,1|2,0,0]=4 5603 B16R2.135 Clc1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100000189385 [0,1,0,0,0,1|2,0,0]=4 5604 B16R2.135 Clc1ccc(cc1)CNCc2ncc[nH]2 2230a_100000174871_100016991755 [0,1,0,0,0,1|2,0,0]=4 5605 B16R2.135 Clc1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100000189385 [0,1,0,0,0,1|2,0,0]=4 5606 B16R2.135 Clc1ccc(cc1)CNCc2ncc[nH]2 34a_100000174871_100016991755 [0,1,0,0,0,1|2,0,0]=4 5607 B16R2.135 Clc1ccc(cc1)CNCc2ncco2 207a_100016994969_100000189385 [0,1,0,0,0,1|2,0,0]=4 5608 B16R2.135 Clc1ccc(cc1)CNCc2ncco2 2230a_100000174871_103436540062 [0,1,0,0,0,1|2,0,0]=4 5609 B16R2.135 Clc1ccc(cc1)CNCc2ncco2 2230a_100016994969_100000694040 [0,1,0,0,0,1|2,0,0]=4 5610 B16R2.135 Clc1ccc(cc1)CNCc2ncco2 270004a_100000174871_100000064290 [0,1,0,0,0,1|2,0,0]=4 5611 B16R2.135 Clc1ccc(cc1)CNCc2ncco2 34a_100000174871_103436540062 [0,1,0,0,0,1|2,0,0]=4 5612 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 207a_100000174871_100000750902 [0,1,0,0,0,1|2,0,0]=4 5613 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 207a_100000740555_100000189385 [0,1,0,0,0,1|2,0,0]=4 5614 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 2230a_100000174871_100015184050 [0,1,0,0,0,1|2,0,0]=4 5615 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 2230a_100000740555_100000694040 [0,1,0,0,0,1|2,0,0]=4 5616 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 270004a_100000174871_100000750902 [0,1,0,0,0,1|2,0,0]=4 5617 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 270004a_100000740555_100000189385 [0,1,0,0,0,1|2,0,0]=4 5618 B16R2.135 Clc1ccc(cc1)CNCc2nccs2 34a_100000174871_100015184050 [0,1,0,0,0,1|2,0,0]=4 5619 B16R2.135 Clc1ccc(cc1)CNCc2ncon2 34a_100000174871_100000233494 [0,1,0,0,0,1|2,0,0]=4 5620 B16R2.135 Clc1ccc(cc1)CNCn2cncn2 2230a_100000174871_200020645497 [0,1,0,0,0,1|1,0,1]=4 5621 B16R2.135 Clc1ccc(cc1)CNCn2cncn2 34a_100000174871_200020645497 [0,1,0,0,0,1|1,0,1]=4 5622 B16R2.135 Clc1ccc(cc1)COCc2c[nH]cn2 34a_100000211118_100000707719 [0,1,0,0,0,1|1,0,0]=3 5623 B16R2.135 Clc1ccc(cc1)COCc2cscn2 34a_100000211118_100000205941 [0,1,0,0,0,1|2,0,0]=4 5624 B16R2.135 Clc1ccc(cc1)COCc2cscn2 7a_100000211118_100000205941 [0,1,0,0,0,1|2,0,0]=4 5625 B16R2.135 Clc1ccc(cc1)CSCc2c[nH]cn2 62a_100000187161_100000707719 [0,1,0,0,0,1|1,0,0]=3 5626 B16R2.135 Clc1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100000187161 [0,1,0,0,0,1|1,0,0]=3 5627 B16R2.135 Clc1ccc(cc1)CSCc2cscn2 62a_100000187161_100000205941 [0,1,0,0,0,1|2,0,0]=4 5628 B16R2.135 Clc1ccc(cc1)CSCc2cscn2 62a_100000205941_100000187161 [0,1,0,0,0,1|2,0,0]=4 5629 B16R2.135 Clc1ccc(cc1)NCCc2c[nH]cn2 2230a_100000210052_100020628418 [0,1,0,0,0,1|0,0,0]=2 5630 B16R2.135 Clc1ccc(cc1)NCCc2cccs2 2230a_100000210052_100000748579 [0,1,0,0,0,1|2,0,0]=4 5631 B16R2.135 Clc1ccc(cc1)NCCc2cccs2 34a_100000210052_100000748579 [0,1,0,0,0,1|2,0,0]=4 5632 B16R2.135 Clc1ccc(cc1)NCCc2cn[nH]c2 2230a_100000210052_100000743252 [0,1,0,0,0,1|2,0,0]=4 5633 B16R2.135 Clc1ccc(cc1)NCCn2cccn2 2230a_100000210052_100000685285 [0,1,0,0,0,1|2,0,0]=4 5634 B16R2.135 Clc1ccc(cc1)NCCn2cccn2 34a_100000210052_100015204718 [0,1,0,0,0,1|2,0,0]=4 5635 B16R2.135 Clc1ccc(cc1)NCCn2cncn2 2230a_100000210052_100000731791 [0,1,0,0,0,1|1,0,1]=4 5636 B16R2.135 Clc1ccc(cc1)NCCn2cncn2 34a_100000210052_200000749826 [0,1,0,0,0,1|1,0,1]=4 5637 B16R2.135 Clc1ccc(cc1)NN=Cc2cc[nH]c2 4a_100000683521_100000760201 [0,1,0,0,0,1|1,0,1]=4 5638 B16R2.135 Clc1ccc(cc1)NN=Cc2cocn2 4a_100000683521_100000050382 [0,1,0,0,0,1|1,0,1]=4 5639 B16R2.135 Clc1ccc(cc1)NN=Cc2cscn2 4a_100000683521_100000743575 [0,1,0,0,0,1|1,0,1]=4 5640 B16R2.135 Clc1ccc(cc1)OCCc2c[nH]cn2 7a_100000210216_100020628418 [0,1,0,0,0,1|1,0,0]=3 5641 B16R2.135 Clc1ccc(cc1)SCCc2c[nH]cn2 62a_100000755918_100020628418 [0,1,0,0,0,1|1,0,0]=3 5642 B16R2.135 Clc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000755918 [0,1,0,0,0,1|1,0,0]=3 5643 B16R2.135 Clc1ccc(cn1)CNCc2c[nH]cn2 2230a_100000735879_100000707719 [0,1,0,0,0,1|1,0,0]=3 5644 B16R2.135 Clc1ccc(cn1)CNCc2c[nH]cn2 34a_100000735879_100000707719 [0,1,0,0,0,1|1,0,0]=3 5645 B16R2.135 Clc1ccc(cn1)CNCc2cocn2 270004a_100000735879_100000050382 [0,1,0,0,0,1|2,0,0]=4 5646 B16R2.135 Clc1ccc(cn1)CNCc2cscn2 207a_100000735879_100000743575 [0,1,0,0,0,1|2,0,0]=4 5647 B16R2.135 Clc1ccc(cn1)CNCc2cscn2 2230a_100000735879_100000205941 [0,1,0,0,0,1|2,0,0]=4 5648 B16R2.135 Clc1ccc(cn1)CNCc2cscn2 2230a_100015185402_100000735431 [0,1,0,0,0,1|2,0,0]=4 5649 B16R2.135 Clc1ccc(cn1)CNCc2cscn2 270004a_100000735879_100000743575 [0,1,0,0,0,1|2,0,0]=4 5650 B16R2.135 Clc1ccc(cn1)CNCc2cscn2 34a_100000735879_100000205941 [0,1,0,0,0,1|2,0,0]=4 5651 B16R2.135 Clc1ccc(cn1)COCc2c[nH]cn2 34a_100000755211_100000707719 [0,1,0,0,0,1|2,0,0]=4 5652 B16R2.135 Clc1ccc(cn1)CSCc2c[nH]cn2 62a_100000707719_100000735431 [0,1,0,0,0,1|2,0,0]=4 5653 B16R2.135 Clc1ccc(cn1)CSCc2c[nH]cn2 62a_100000735431_100000707719 [0,1,0,0,0,1|2,0,0]=4 5654 B16R2.135 Clc1ccc(cn1)OCCc2c[nH]cn2 7a_100000744096_100020628418 [0,1,0,0,0,1|2,0,0]=4 5655 B16R2.135 Clc1ccc(cn1)SCCc2c[nH]cn2 62a_100000034144_100020628418 [0,1,0,0,0,1|2,0,0]=4 5656 B16R2.135 Clc1ccc(cn1)SCCc2c[nH]cn2 62a_100020628418_100000034144 [0,1,0,0,0,1|2,0,0]=4 5657 B16R2.135 Clc1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100011361569 [0,1,0,0,0,1|1,0,0]=3 5658 B16R2.135 Clc1ccc(nc1)CNCc2c[nH]cn2 34a_100000697193_100000707719 [0,1,0,0,0,1|1,0,0]=3 5659 B16R2.135 Clc1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100011361569 [0,1,0,0,0,1|2,0,0]=4 5660 B16R2.135 Clc1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100011361569 [0,1,0,0,0,1|2,0,0]=4 5661 B16R2.135 Clc1ccc(nc1)CNCc2cocn2 207a_100015188801_100011361569 [0,1,0,0,0,1|2,0,0]=4 5662 B16R2.135 Clc1ccc(nc1)CNCc2cocn2 270004a_100000697193_100000050382 [0,1,0,0,0,1|2,0,0]=4 5663 B16R2.135 Clc1ccc(nc1)CNCc2cocn2 270004a_100015188801_100011361569 [0,1,0,0,0,1|2,0,0]=4 5664 B16R2.135 Clc1ccc(nc1)CNCc2cscn2 207a_100015185402_100011361569 [0,1,0,0,0,1|2,0,0]=4 5665 B16R2.135 Clc1ccc(nc1)CNCc2cscn2 2230a_100015185402_100012066911 [0,1,0,0,0,1|2,0,0]=4 5666 B16R2.135 Clc1ccc(nc1)CNCc2cscn2 270004a_100000697193_100000743575 [0,1,0,0,0,1|2,0,0]=4 5667 B16R2.135 Clc1ccc(nc1)CNCc2cscn2 34a_100000697193_100000205941 [0,1,0,0,0,1|2,0,0]=4 5668 B16R2.135 Clc1ccc(nc1)COCc2c[nH]cn2 34a_100000703999_100000707719 [0,1,0,0,0,1|2,0,0]=4 5669 B16R2.135 Clc1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000697101 [0,1,0,0,0,1|2,0,0]=4 5670 B16R2.135 Clc1ccc(nc1)CSCc2c[nH]cn2 62a_100012066911_100000707719 [0,1,0,0,0,1|2,0,0]=4 5671 B16R2.135 Clc1ccc(nc1)SCCc2c[nH]cn2 62a_100011356976_100020628418 [0,1,0,0,0,1|2,0,0]=4 5672 B16R2.135 Clc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100011356976 [0,1,0,0,0,1|2,0,0]=4 5673 B16R2.135 Clc1cnc(nc1)NCCc2c[nH]cn2 27a_100000755092_100011356929 [0,1,0,0,0,1|2,0,0]=4 5674 B16R2.135 Fc1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100011217392 [0,1,0,0,0,1|1,0,0]=3 5675 B16R2.135 Fc1ccc(cc1)CCSc2c[nH]cn2 62a_100011217392_100000756875 [0,1,0,0,0,1|1,0,0]=3 5676 B16R2.135 Fc1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100011217392 [0,1,0,0,0,1|2,0,0]=4 5677 B16R2.135 Fc1ccc(cc1)CCSc2c[nH]nn2 62a_100011217392_100009819707 [0,1,0,0,0,1|2,0,0]=4 5678 B16R2.135 Fc1ccc(cc1)CCSc2cscn2 62a_100000751502_100011217392 [0,1,0,0,0,1|2,0,0]=4 5679 B16R2.135 Fc1ccc(cc1)CCSc2cscn2 62a_100011217392_100000751502 [0,1,0,0,0,1|2,0,0]=4 5680 B16R2.135 Fc1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100011217392 [0,1,0,0,0,1|2,0,0]=4 5681 B16R2.135 Fc1ccc(cc1)CCSc2nc[nH]n2 62a_100011217392_100000761765 [0,1,0,0,0,1|2,0,0]=4 5682 B16R2.135 Fc1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100000210084 [0,1,0,0,0,1|0,0,0]=2 5683 B16R2.135 Fc1ccc(cc1)CNCc2c[nH]cn2 2230a_100000174882_100000707719 [0,1,0,0,0,1|0,0,0]=2 5684 B16R2.135 Fc1ccc(cc1)CNCc2c[nH]cn2 34a_100000174882_100000707719 [0,1,0,0,0,1|0,0,0]=2 5685 B16R2.135 Fc1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100000210084 [0,1,0,0,0,1|1,0,0]=3 5686 B16R2.135 Fc1ccc(cc1)CNCc2c[nH]nn2 270004a_100020620823_100000210084 [0,1,0,0,0,1|1,0,0]=3 5687 B16R2.135 Fc1ccc(cc1)CNCc2cc[nH]n2 207a_100000174882_100000738523 [0,1,0,0,0,1|2,0,0]=4 5688 B16R2.135 Fc1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100000210084 [0,1,0,0,0,1|2,0,0]=4 5689 B16R2.135 Fc1ccc(cc1)CNCc2cc[nH]n2 270004a_100000174882_100000738523 [0,1,0,0,0,1|2,0,0]=4 5690 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 207a_100000174882_100000186105 [0,1,0,0,0,1|2,0,0]=4 5691 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000210084 [0,1,0,0,0,1|2,0,0]=4 5692 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000198546 [0,1,0,0,0,1|2,0,0]=4 5693 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 270004a_100000174882_100000186105 [0,1,0,0,0,1|2,0,0]=4 5694 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000210084 [0,1,0,0,0,1|2,0,0]=4 5695 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000198546 [0,1,0,0,0,1|2,0,0]=4 5696 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 207a_100000174882_100000209959 [0,1,0,0,0,1|2,0,0]=4 5697 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000210084 [0,1,0,0,0,1|2,0,0]=4 5698 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000198546 [0,1,0,0,0,1|2,0,0]=4 5699 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 270004a_100000174882_100000209959 [0,1,0,0,0,1|2,0,0]=4 5700 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000210084 [0,1,0,0,0,1|2,0,0]=4 5701 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 207a_100000174882_100011215517 [0,1,0,0,0,1|2,0,0]=4 5702 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000210084 [0,1,0,0,0,1|2,0,0]=4 5703 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000198546 [0,1,0,0,0,1|2,0,0]=4 5704 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 270004a_100000174882_100011215517 [0,1,0,0,0,1|2,0,0]=4 5705 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000210084 [0,1,0,0,0,1|2,0,0]=4 5706 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000198546 [0,1,0,0,0,1|2,0,0]=4 5707 B16R2.135 Fc1ccc(cc1)CNCc2ccon2 207a_100000688301_100000210084 [0,1,0,0,0,1|2,0,0]=4 5708 B16R2.135 Fc1ccc(cc1)CNCc2ccon2 2230a_100000174882_100000234950 [0,1,0,0,0,1|2,0,0]=4 5709 B16R2.135 Fc1ccc(cc1)CNCc2ccon2 270004a_100000688301_100000210084 [0,1,0,0,0,1|2,0,0]=4 5710 B16R2.135 Fc1ccc(cc1)CNCc2ccon2 34a_100000174882_100000234950 [0,1,0,0,0,1|2,0,0]=4 5711 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 207a_100000174882_100000188534 [0,1,0,0,0,1|2,0,0]=4 5712 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000210084 [0,1,0,0,0,1|2,0,0]=4 5713 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 2230a_100000174882_100011261437 [0,1,0,0,0,1|2,0,0]=4 5714 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000198546 [0,1,0,0,0,1|2,0,0]=4 5715 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 270004a_100000174882_100000188534 [0,1,0,0,0,1|2,0,0]=4 5716 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000210084 [0,1,0,0,0,1|2,0,0]=4 5717 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 34a_100000174882_100011261437 [0,1,0,0,0,1|2,0,0]=4 5718 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000198546 [0,1,0,0,0,1|2,0,0]=4 5719 B16R2.135 Fc1ccc(cc1)CNCc2cn[nH]c2 207a_100000174882_100016992096 [0,1,0,0,0,1|2,0,0]=4 5720 B16R2.135 Fc1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100000210084 [0,1,0,0,0,1|2,0,0]=4 5721 B16R2.135 Fc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000174882_100016992096 [0,1,0,0,0,1|2,0,0]=4 5722 B16R2.135 Fc1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100000210084 [0,1,0,0,0,1|2,0,0]=4 5723 B16R2.135 Fc1ccc(cc1)CNCc2cnc[nH]2 207a_100000174882_100000742939 [0,1,0,0,0,1|0,0,2]=4 5724 B16R2.135 Fc1ccc(cc1)CNCc2cnco2 207a_100020634212_100000210084 [0,1,0,0,0,1|1,0,1]=4 5725 B16R2.135 Fc1ccc(cc1)CNCc2cnco2 270004a_100000174882_100000064291 [0,1,0,0,0,1|1,0,1]=4 5726 B16R2.135 Fc1ccc(cc1)CNCc2cnco2 270004a_100020634212_100000210084 [0,1,0,0,0,1|1,0,1]=4 5727 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 207a_100000174882_100000749870 [0,1,0,0,0,1|1,0,1]=4 5728 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 207a_100016987365_100000210084 [0,1,0,0,0,1|1,0,1]=4 5729 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 2230a_100000174882_100015185245 [0,1,0,0,0,1|1,0,1]=4 5730 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 2230a_100016987365_100000198546 [0,1,0,0,0,1|1,0,1]=4 5731 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 270004a_100000174882_100000749870 [0,1,0,0,0,1|1,0,1]=4 5732 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 270004a_100016987365_100000210084 [0,1,0,0,0,1|1,0,1]=4 5733 B16R2.135 Fc1ccc(cc1)CNCc2cncs2 34a_100000174882_100015185245 [0,1,0,0,0,1|1,0,1]=4 5734 B16R2.135 Fc1ccc(cc1)CNCc2cocn2 207a_100015188801_100000210084 [0,1,0,0,0,1|1,0,0]=3 5735 B16R2.135 Fc1ccc(cc1)CNCc2cocn2 270004a_100000174882_100000050382 [0,1,0,0,0,1|1,0,0]=3 5736 B16R2.135 Fc1ccc(cc1)CNCc2cocn2 270004a_100015188801_100000210084 [0,1,0,0,0,1|1,0,0]=3 5737 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 207a_100000174882_100000743575 [0,1,0,0,0,1|1,0,0]=3 5738 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 207a_100015185402_100000210084 [0,1,0,0,0,1|1,0,0]=3 5739 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 2230a_100000174882_100000205941 [0,1,0,0,0,1|1,0,0]=3 5740 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 2230a_100015185402_100000198546 [0,1,0,0,0,1|1,0,0]=3 5741 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 270004a_100000174882_100000743575 [0,1,0,0,0,1|1,0,0]=3 5742 B16R2.135 Fc1ccc(cc1)CNCc2cscn2 34a_100000174882_100000205941 [0,1,0,0,0,1|1,0,0]=3 5743 B16R2.135 Fc1ccc(cc1)CNCc2csnn2 270004a_100000174882_100000738508 [0,1,0,0,0,1|2,0,0]=4 5744 B16R2.135 Fc1ccc(cc1)CNCc2ncc[nH]2 207a_100000174882_100000743867 [0,1,0,0,0,1|2,0,0]=4 5745 B16R2.135 Fc1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100000210084 [0,1,0,0,0,1|2,0,0]=4 5746 B16R2.135 Fc1ccc(cc1)CNCc2ncc[nH]2 2230a_100000174882_100016991755 [0,1,0,0,0,1|2,0,0]=4 5747 B16R2.135 Fc1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100000210084 [0,1,0,0,0,1|2,0,0]=4 5748 B16R2.135 Fc1ccc(cc1)CNCc2ncc[nH]2 34a_100000174882_100016991755 [0,1,0,0,0,1|2,0,0]=4 5749 B16R2.135 Fc1ccc(cc1)CNCc2ncco2 207a_100016994969_100000210084 [0,1,0,0,0,1|2,0,0]=4 5750 B16R2.135 Fc1ccc(cc1)CNCc2ncco2 2230a_100000174882_103436540062 [0,1,0,0,0,1|2,0,0]=4 5751 B16R2.135 Fc1ccc(cc1)CNCc2ncco2 2230a_100016994969_100000198546 [0,1,0,0,0,1|2,0,0]=4 5752 B16R2.135 Fc1ccc(cc1)CNCc2ncco2 270004a_100000174882_100000064290 [0,1,0,0,0,1|2,0,0]=4 5753 B16R2.135 Fc1ccc(cc1)CNCc2ncco2 34a_100000174882_103436540062 [0,1,0,0,0,1|2,0,0]=4 5754 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 207a_100000174882_100000750902 [0,1,0,0,0,1|2,0,0]=4 5755 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 207a_100000740555_100000210084 [0,1,0,0,0,1|2,0,0]=4 5756 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 2230a_100000174882_100015184050 [0,1,0,0,0,1|2,0,0]=4 5757 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 2230a_100000740555_100000198546 [0,1,0,0,0,1|2,0,0]=4 5758 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 270004a_100000174882_100000750902 [0,1,0,0,0,1|2,0,0]=4 5759 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 270004a_100000740555_100000210084 [0,1,0,0,0,1|2,0,0]=4 5760 B16R2.135 Fc1ccc(cc1)CNCc2nccs2 34a_100000174882_100015184050 [0,1,0,0,0,1|2,0,0]=4 5761 B16R2.135 Fc1ccc(cc1)CNCc2ncon2 34a_100000174882_100000233494 [0,1,0,0,0,1|2,0,0]=4 5762 B16R2.135 Fc1ccc(cc1)CNCn2cncn2 2230a_100000174882_200020645497 [0,1,0,0,0,1|1,0,1]=4 5763 B16R2.135 Fc1ccc(cc1)CNCn2cncn2 34a_100000174882_200020645497 [0,1,0,0,0,1|1,0,1]=4 5764 B16R2.135 Fc1ccc(cc1)COCc2c[nH]cn2 34a_100000210977_100000707719 [0,1,0,0,0,1|1,0,0]=3 5765 B16R2.135 Fc1ccc(cc1)COCc2cscn2 34a_100000210977_100000205941 [0,1,0,0,0,1|2,0,0]=4 5766 B16R2.135 Fc1ccc(cc1)COCc2cscn2 7a_100000210977_100000205941 [0,1,0,0,0,1|2,0,0]=4 5767 B16R2.135 Fc1ccc(cc1)CSCc2c[nH]cn2 62a_100000198546_100000707719 [0,1,0,0,0,1|1,0,0]=3 5768 B16R2.135 Fc1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100000187164 [0,1,0,0,0,1|1,0,0]=3 5769 B16R2.135 Fc1ccc(cc1)CSCc2cscn2 62a_100000198546_100000205941 [0,1,0,0,0,1|2,0,0]=4 5770 B16R2.135 Fc1ccc(cc1)CSCc2cscn2 62a_100000205941_100000187164 [0,1,0,0,0,1|2,0,0]=4 5771 B16R2.135 Fc1ccc(cc1)NCCc2cccs2 34a_100000185862_100000748579 [0,1,0,0,0,1|2,0,0]=4 5772 B16R2.135 Fc1ccc(cc1)NCCn2cccn2 34a_100000185862_100015204718 [0,1,0,0,0,1|2,0,0]=4 5773 B16R2.135 Fc1ccc(cc1)NCCn2cncn2 34a_100000185862_200000749826 [0,1,0,0,0,1|1,0,1]=4 5774 B16R2.135 Fc1ccc(cc1)NN=Cc2cc[nH]c2 4a_100000728448_100000760201 [0,1,0,0,0,1|1,0,1]=4 5775 B16R2.135 Fc1ccc(cc1)NN=Cc2cocn2 4a_100000728448_100000050382 [0,1,0,0,0,1|1,0,1]=4 5776 B16R2.135 Fc1ccc(cc1)NN=Cc2cscn2 4a_100000728448_100000743575 [0,1,0,0,0,1|1,0,1]=4 5777 B16R2.135 Fc1ccc(cc1)SCCc2c[nH]cn2 62a_100000211213_100020628418 [0,1,0,0,0,1|1,0,0]=3 5778 B16R2.135 Fc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000211213 [0,1,0,0,0,1|1,0,0]=3 5779 B16R2.135 Fc1ccc(cn1)CNCc2c[nH]cn2 2230a_100000101913_100000707719 [0,1,0,0,0,1|1,0,0]=3 5780 B16R2.135 Fc1ccc(cn1)CNCc2c[nH]cn2 34a_100000101913_100000707719 [0,1,0,0,0,1|1,0,0]=3 5781 B16R2.135 Fc1ccc(cn1)CNCc2cocn2 270004a_100000101913_100000050382 [0,1,0,0,0,1|2,0,0]=4 5782 B16R2.135 Fc1ccc(cn1)CNCc2cscn2 2230a_100000101913_100000205941 [0,1,0,0,0,1|2,0,0]=4 5783 B16R2.135 Fc1ccc(cn1)CNCc2cscn2 2230a_100015185402_100009820150 [0,1,0,0,0,1|2,0,0]=4 5784 B16R2.135 Fc1ccc(cn1)CNCc2cscn2 270004a_100000101913_100000743575 [0,1,0,0,0,1|2,0,0]=4 5785 B16R2.135 Fc1ccc(cn1)CNCc2cscn2 34a_100000101913_100000205941 [0,1,0,0,0,1|2,0,0]=4 5786 B16R2.135 Fc1ccc(cn1)COCc2c[nH]cn2 34a_100000079959_100000707719 [0,1,0,0,0,1|2,0,0]=4 5787 B16R2.135 Fc1ccc(cn1)CSCc2c[nH]cn2 62a_100000707719_100000099788 [0,1,0,0,0,1|2,0,0]=4 5788 B16R2.135 Fc1ccc(cn1)CSCc2c[nH]cn2 62a_100009820150_100000707719 [0,1,0,0,0,1|2,0,0]=4 5789 B16R2.135 Fc1ccc(cn1)OCCc2c[nH]cn2 7a_100000688820_100020628418 [0,1,0,0,0,1|2,0,0]=4 5790 B16R2.135 Fc1ccc(cn1)SCCc2c[nH]cn2 62a_100000042367_100020628418 [0,1,0,0,0,1|2,0,0]=4 5791 B16R2.135 Fc1ccc(cn1)SCCc2c[nH]cn2 62a_100020628418_100000042367 [0,1,0,0,0,1|2,0,0]=4 5792 B16R2.135 Fc1ccc(nc1)CNCc2c[nH]cn2 207a_100000758547_100011934744 [0,1,0,0,0,1|1,0,0]=3 5793 B16R2.135 Fc1ccc(nc1)CNCc2c[nH]cn2 34a_100020620131_100000707719 [0,1,0,0,0,1|1,0,0]=3 5794 B16R2.135 Fc1ccc(nc1)CNCc2c[nH]nn2 207a_100020620823_100011934744 [0,1,0,0,0,1|2,0,0]=4 5795 B16R2.135 Fc1ccc(nc1)CNCc2c[nH]nn2 270004a_100020620823_100011934744 [0,1,0,0,0,1|2,0,0]=4 5796 B16R2.135 Fc1ccc(nc1)CNCc2cocn2 207a_100015188801_100011934744 [0,1,0,0,0,1|2,0,0]=4 5797 B16R2.135 Fc1ccc(nc1)CNCc2cocn2 270004a_100015188801_100011934744 [0,1,0,0,0,1|2,0,0]=4 5798 B16R2.135 Fc1ccc(nc1)CNCc2cscn2 207a_100015185402_100011934744 [0,1,0,0,0,1|2,0,0]=4 5799 B16R2.135 Fc1ccc(nc1)CNCc2cscn2 2230a_100015185402_100000703193 [0,1,0,0,0,1|2,0,0]=4 5800 B16R2.135 Fc1ccc(nc1)CNCc2cscn2 34a_100020620131_100000205941 [0,1,0,0,0,1|2,0,0]=4 5801 B16R2.135 Fc1ccc(nc1)COCc2c[nH]cn2 34a_100011999454_100000707719 [0,1,0,0,0,1|2,0,0]=4 5802 B16R2.135 Fc1ccc(nc1)CSCc2c[nH]cn2 62a_100000703193_100000707719 [0,1,0,0,0,1|2,0,0]=4 5803 B16R2.135 Fc1ccc(nc1)CSCc2c[nH]cn2 62a_100000707719_100000703193 [0,1,0,0,0,1|2,0,0]=4 5804 B16R2.135 Fc1ccc(nc1)SCCc2c[nH]cn2 62a_100000744514_100020628418 [0,1,0,0,0,1|2,0,0]=4 5805 B16R2.135 Fc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000744514 [0,1,0,0,0,1|2,0,0]=4 5806 B16R2.135 Fc1cnc(cn1)NCCc2c[nH]cn2 27a_100000755092_100009856528 [0,1,0,0,0,1|2,0,0]=4 5807 B16R2.135 Fc1cnc(nc1)NCCc2c[nH]cn2 27a_100000755092_100000685220 [0,1,0,0,0,1|2,0,0]=4 5808 B16R2.135 Ic1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100000188517 [0,1,0,0,0,1|0,0,0]=2 5809 B16R2.135 Ic1ccc(cc1)CNCc2c[nH]cn2 2230a_100016989417_100000707719 [0,1,0,0,0,1|0,0,0]=2 5810 B16R2.135 Ic1ccc(cc1)CNCc2c[nH]cn2 34a_100016989417_100000707719 [0,1,0,0,0,1|0,0,0]=2 5811 B16R2.135 Ic1ccc(cc1)CNCc2c[nH]nn2 207a_100020620823_100000188517 [0,1,0,0,0,1|1,0,0]=3 5812 B16R2.135 Ic1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100000188517 [0,1,0,0,0,1|2,0,0]=4 5813 B16R2.135 Ic1ccc(cc1)CNCc2cc[nH]n2 207a_100016989417_100000738523 [0,1,0,0,0,1|2,0,0]=4 5814 B16R2.135 Ic1ccc(cc1)CNCc2cc[nH]n2 270004a_100016989417_100000738523 [0,1,0,0,0,1|2,0,0]=4 5815 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 207a_100000185738_100000188517 [0,1,0,0,0,1|2,0,0]=4 5816 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 207a_100016989417_100000186105 [0,1,0,0,0,1|2,0,0]=4 5817 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000189116 [0,1,0,0,0,1|2,0,0]=4 5818 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 270004a_100016989417_100000186105 [0,1,0,0,0,1|2,0,0]=4 5819 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 34a_100000185738_100000189116 [0,1,0,0,0,1|2,0,0]=4 5820 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 207a_100000211653_100000188517 [0,1,0,0,0,1|2,0,0]=4 5821 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 207a_100016989417_100000209959 [0,1,0,0,0,1|2,0,0]=4 5822 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000189116 [0,1,0,0,0,1|2,0,0]=4 5823 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 270004a_100016989417_100000209959 [0,1,0,0,0,1|2,0,0]=4 5824 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000188517 [0,1,0,0,0,1|2,0,0]=4 5825 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 207a_100016989417_100011215517 [0,1,0,0,0,1|2,0,0]=4 5826 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000189116 [0,1,0,0,0,1|2,0,0]=4 5827 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 270004a_100016989417_100011215517 [0,1,0,0,0,1|2,0,0]=4 5828 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000189116 [0,1,0,0,0,1|2,0,0]=4 5829 B16R2.135 Ic1ccc(cc1)CNCc2ccon2 207a_100000688301_100000188517 [0,1,0,0,0,1|2,0,0]=4 5830 B16R2.135 Ic1ccc(cc1)CNCc2ccon2 2230a_100016989417_100000234950 [0,1,0,0,0,1|2,0,0]=4 5831 B16R2.135 Ic1ccc(cc1)CNCc2ccon2 34a_100016989417_100000234950 [0,1,0,0,0,1|2,0,0]=4 5832 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000188517 [0,1,0,0,0,1|2,0,0]=4 5833 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 207a_100016989417_100000188534 [0,1,0,0,0,1|2,0,0]=4 5834 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000189116 [0,1,0,0,0,1|2,0,0]=4 5835 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 2230a_100016989417_100011261437 [0,1,0,0,0,1|2,0,0]=4 5836 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 270004a_100016989417_100000188534 [0,1,0,0,0,1|2,0,0]=4 5837 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000189116 [0,1,0,0,0,1|2,0,0]=4 5838 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 34a_100016989417_100011261437 [0,1,0,0,0,1|2,0,0]=4 5839 B16R2.135 Ic1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100000188517 [0,1,0,0,0,1|2,0,0]=4 5840 B16R2.135 Ic1ccc(cc1)CNCc2cn[nH]c2 207a_100016989417_100016992096 [0,1,0,0,0,1|2,0,0]=4 5841 B16R2.135 Ic1ccc(cc1)CNCc2cn[nH]c2 270004a_100016989417_100016992096 [0,1,0,0,0,1|2,0,0]=4 5842 B16R2.135 Ic1ccc(cc1)CNCc2cnc[nH]2 207a_100016989417_100000742939 [0,1,0,0,0,1|0,0,2]=4 5843 B16R2.135 Ic1ccc(cc1)CNCc2cnco2 207a_100020634212_100000188517 [0,1,0,0,0,1|1,0,1]=4 5844 B16R2.135 Ic1ccc(cc1)CNCc2cnco2 270004a_100016989417_100000064291 [0,1,0,0,0,1|1,0,1]=4 5845 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 207a_100016987365_100000188517 [0,1,0,0,0,1|1,0,1]=4 5846 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 207a_100016989417_100000749870 [0,1,0,0,0,1|1,0,1]=4 5847 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 2230a_100016987365_100000189116 [0,1,0,0,0,1|1,0,1]=4 5848 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 2230a_100016989417_100015185245 [0,1,0,0,0,1|1,0,1]=4 5849 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 270004a_100016989417_100000749870 [0,1,0,0,0,1|1,0,1]=4 5850 B16R2.135 Ic1ccc(cc1)CNCc2cncs2 34a_100016989417_100015185245 [0,1,0,0,0,1|1,0,1]=4 5851 B16R2.135 Ic1ccc(cc1)CNCc2cocn2 207a_100015188801_100000188517 [0,1,0,0,0,1|1,0,0]=3 5852 B16R2.135 Ic1ccc(cc1)CNCc2cocn2 270004a_100016989417_100000050382 [0,1,0,0,0,1|1,0,0]=3 5853 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 207a_100015185402_100000188517 [0,1,0,0,0,1|1,0,0]=3 5854 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 207a_100016989417_100000743575 [0,1,0,0,0,1|1,0,0]=3 5855 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 2230a_100015185402_100000189116 [0,1,0,0,0,1|1,0,0]=3 5856 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 2230a_100016989417_100000205941 [0,1,0,0,0,1|1,0,0]=3 5857 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 270004a_100016989417_100000743575 [0,1,0,0,0,1|1,0,0]=3 5858 B16R2.135 Ic1ccc(cc1)CNCc2cscn2 34a_100016989417_100000205941 [0,1,0,0,0,1|1,0,0]=3 5859 B16R2.135 Ic1ccc(cc1)CNCc2csnn2 270004a_100016989417_100000738508 [0,1,0,0,0,1|2,0,0]=4 5860 B16R2.135 Ic1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100000188517 [0,1,0,0,0,1|2,0,0]=4 5861 B16R2.135 Ic1ccc(cc1)CNCc2ncc[nH]2 207a_100016989417_100000743867 [0,1,0,0,0,1|2,0,0]=4 5862 B16R2.135 Ic1ccc(cc1)CNCc2ncc[nH]2 2230a_100016989417_100016991755 [0,1,0,0,0,1|2,0,0]=4 5863 B16R2.135 Ic1ccc(cc1)CNCc2ncc[nH]2 34a_100016989417_100016991755 [0,1,0,0,0,1|2,0,0]=4 5864 B16R2.135 Ic1ccc(cc1)CNCc2ncco2 207a_100016994969_100000188517 [0,1,0,0,0,1|2,0,0]=4 5865 B16R2.135 Ic1ccc(cc1)CNCc2ncco2 2230a_100016989417_103436540062 [0,1,0,0,0,1|2,0,0]=4 5866 B16R2.135 Ic1ccc(cc1)CNCc2ncco2 2230a_100016994969_100000189116 [0,1,0,0,0,1|2,0,0]=4 5867 B16R2.135 Ic1ccc(cc1)CNCc2ncco2 270004a_100016989417_100000064290 [0,1,0,0,0,1|2,0,0]=4 5868 B16R2.135 Ic1ccc(cc1)CNCc2ncco2 34a_100016989417_103436540062 [0,1,0,0,0,1|2,0,0]=4 5869 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 207a_100000740555_100000188517 [0,1,0,0,0,1|2,0,0]=4 5870 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 207a_100016989417_100000750902 [0,1,0,0,0,1|2,0,0]=4 5871 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 2230a_100000740555_100000189116 [0,1,0,0,0,1|2,0,0]=4 5872 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 2230a_100016989417_100015184050 [0,1,0,0,0,1|2,0,0]=4 5873 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 270004a_100016989417_100000750902 [0,1,0,0,0,1|2,0,0]=4 5874 B16R2.135 Ic1ccc(cc1)CNCc2nccs2 34a_100016989417_100015184050 [0,1,0,0,0,1|2,0,0]=4 5875 B16R2.135 Ic1ccc(cc1)CNCc2ncon2 34a_100016989417_100000233494 [0,1,0,0,0,1|2,0,0]=4 5876 B16R2.135 Ic1ccc(cc1)CNCn2cncn2 2230a_100016989417_200020645497 [0,1,0,0,0,1|1,0,1]=4 5877 B16R2.135 Ic1ccc(cc1)CNCn2cncn2 34a_100016989417_200020645497 [0,1,0,0,0,1|1,0,1]=4 5878 B16R2.135 Ic1ccc(cc1)COCc2c[nH]cn2 34a_100000690907_100000707719 [0,1,0,0,0,1|1,0,0]=3 5879 B16R2.135 Ic1ccc(cc1)COCc2cscn2 34a_100000690907_100000205941 [0,1,0,0,0,1|2,0,0]=4 5880 B16R2.135 Ic1ccc(cc1)COCc2cscn2 7a_100000690907_100000205941 [0,1,0,0,0,1|2,0,0]=4 5881 B16R2.135 Ic1ccc(cc1)CSCc2c[nH]cn2 62a_100000189116_100000707719 [0,1,0,0,0,1|1,0,0]=3 5882 B16R2.135 Ic1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100000189116 [0,1,0,0,0,1|1,0,0]=3 5883 B16R2.135 Ic1ccc(cc1)CSCc2cscn2 62a_100000189116_100000205941 [0,1,0,0,0,1|2,0,0]=4 5884 B16R2.135 Ic1ccc(cc1)CSCc2cscn2 62a_100000205941_100000189116 [0,1,0,0,0,1|2,0,0]=4 5885 B16R2.135 Ic1ccc(cc1)NCCc2cccs2 34a_100000185761_100000748579 [0,1,0,0,0,1|2,0,0]=4 5886 B16R2.135 Ic1ccc(cc1)NCCn2cccn2 34a_100000185761_100015204718 [0,1,0,0,0,1|2,0,0]=4 5887 B16R2.135 Ic1ccc(cc1)NCCn2cncn2 34a_100000185761_200000749826 [0,1,0,0,0,1|1,0,1]=4 5888 B16R2.135 Ic1ccc(cc1)NN=Cc2cc[nH]c2 4a_100016988836_100000760201 [0,1,0,0,0,1|1,0,1]=4 5889 B16R2.135 Ic1ccc(cc1)NN=Cc2cocn2 4a_100016988836_100000050382 [0,1,0,0,0,1|1,0,1]=4 5890 B16R2.135 Ic1ccc(cc1)NN=Cc2cscn2 4a_100016988836_100000743575 [0,1,0,0,0,1|1,0,1]=4 5891 B16R2.135 Ic1ccc(cc1)OCCc2c[nH]cn2 7a_100000212066_100020628418 [0,1,0,0,0,1|1,0,0]=3 5892 B16R2.135 Ic1ccc(cn1)OCCc2c[nH]cn2 7a_100000687607_100020628418 [0,1,0,0,0,1|2,0,0]=4 5893 B16R2.135 Nc1ccc(cc1)COCc2c[nH]cn2 34a_100011215238_100000707719 [0,1,0,0,0,1|1,0,0]=3 5894 B16R2.135 Nc1ccc(cc1)COCc2cscn2 34a_100011215238_100000205941 [0,1,0,0,0,1|2,0,0]=4 5895 B16R2.135 Nc1ccc(cc1)SCCc2c[nH]cn2 62a_100000185761_100020628418 [0,1,0,0,0,1|1,0,0]=3 5896 B16R2.135 Nc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000185761 [0,1,0,0,0,1|1,0,0]=3 5897 B16R2.135 Nc1ccc(cn1)COCc2c[nH]cn2 34a_100000704267_100000707719 [0,1,0,0,0,1|2,0,0]=4 5898 B16R2.135 Nc1ccc(cn1)OCCc2c[nH]cn2 7a_100015188713_100020628418 [0,1,0,0,0,1|2,0,0]=4 5899 B16R2.135 Nc1ccc(cn1)SCCc2c[nH]cn2 62a_100000187370_100020628418 [0,1,0,0,0,1|2,0,0]=4 5900 B16R2.135 Nc1ccc(cn1)SCCc2c[nH]cn2 62a_100020628418_100000187370 [0,1,0,0,0,1|2,0,0]=4 5901 B16R2.135 Nc1ccc(nc1)COCc2c[nH]cn2 34a_100011998161_100000707719 [0,1,0,0,0,1|2,0,0]=4 5902 B16R2.135 Nc1ccc(nc1)SCCc2c[nH]cn2 62a_100000737798_100020628418 [0,1,0,0,0,1|2,0,0]=4 5903 B16R2.135 Nc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000737798 [0,1,0,0,0,1|2,0,0]=4 5904 B16R2.135 O=c1ccc(c[nH]1)COCc2c[nH]cn2 34a_100011999846_100000707719 [0,1,0,0,0,1|2,0,0]=4 5905 B16R2.135 O=c1ccc(c[nH]1)SCCc2c[nH]cn2 62a_100000212171_100020628418 [0,1,0,0,0,1|2,0,0]=4 5906 B16R2.135 O=c1ccc(c[nH]1)SCCc2c[nH]cn2 62a_100020628418_100000212171 [0,1,0,0,0,1|2,0,0]=4 5907 B16R2.135 O=c1ccc(n[nH]1)CNCc2c[nH]cn2 207a_100000758547_100011361533 [0,1,0,0,0,1|2,0,0]=4 5908 B16R2.135 Oc1ccc(cc1)CCSc2c[nH]cn2 62a_100000756875_100009816426 [0,1,0,0,0,1|1,0,0]=3 5909 B16R2.135 Oc1ccc(cc1)CCSc2c[nH]cn2 62a_100009816426_100000756875 [0,1,0,0,0,1|1,0,0]=3 5910 B16R2.135 Oc1ccc(cc1)CCSc2c[nH]nn2 62a_100009816426_100009819707 [0,1,0,0,0,1|2,0,0]=4 5911 B16R2.135 Oc1ccc(cc1)CCSc2c[nH]nn2 62a_100009819707_100009816426 [0,1,0,0,0,1|2,0,0]=4 5912 B16R2.135 Oc1ccc(cc1)CCSc2cscn2 62a_100000751502_100009816426 [0,1,0,0,0,1|2,0,0]=4 5913 B16R2.135 Oc1ccc(cc1)CCSc2cscn2 62a_100009816426_100000751502 [0,1,0,0,0,1|2,0,0]=4 5914 B16R2.135 Oc1ccc(cc1)CCSc2nc[nH]n2 62a_100000761765_100009816426 [0,1,0,0,0,1|2,0,0]=4 5915 B16R2.135 Oc1ccc(cc1)CCSc2nc[nH]n2 62a_100009816426_100000761765 [0,1,0,0,0,1|2,0,0]=4 5916 B16R2.135 Oc1ccc(cc1)CNCc2c[nH]cn2 34a_100000185549_100000707719 [0,1,0,0,0,1|0,0,0]=2 5917 B16R2.135 Oc1ccc(cc1)CNCc2ccon2 34a_100000185549_100000234950 [0,1,0,0,0,1|2,0,0]=4 5918 B16R2.135 Oc1ccc(cc1)CNCc2ccsc2 34a_100000185549_100011261437 [0,1,0,0,0,1|2,0,0]=4 5919 B16R2.135 Oc1ccc(cc1)CNCc2cncs2 34a_100000185549_100015185245 [0,1,0,0,0,1|1,0,1]=4 5920 B16R2.135 Oc1ccc(cc1)CNCc2cscn2 34a_100000185549_100000205941 [0,1,0,0,0,1|1,0,0]=3 5921 B16R2.135 Oc1ccc(cc1)CNCc2ncc[nH]2 34a_100000185549_100016991755 [0,1,0,0,0,1|2,0,0]=4 5922 B16R2.135 Oc1ccc(cc1)CNCc2ncco2 34a_100000185549_103436540062 [0,1,0,0,0,1|2,0,0]=4 5923 B16R2.135 Oc1ccc(cc1)CNCc2nccs2 34a_100000185549_100015184050 [0,1,0,0,0,1|2,0,0]=4 5924 B16R2.135 Oc1ccc(cc1)CNCc2ncon2 34a_100000185549_100000233494 [0,1,0,0,0,1|2,0,0]=4 5925 B16R2.135 Oc1ccc(cc1)CNCn2cncn2 34a_100000185549_200020645497 [0,1,0,0,0,1|1,0,1]=4 5926 B16R2.135 Oc1ccc(cc1)NCCc2cccs2 34a_100000185829_100000748579 [0,1,0,0,0,1|2,0,0]=4 5927 B16R2.135 Oc1ccc(cc1)NCCn2cccn2 34a_100000185829_100015204718 [0,1,0,0,0,1|2,0,0]=4 5928 B16R2.135 Oc1ccc(cc1)NCCn2cncn2 34a_100000185829_200000749826 [0,1,0,0,0,1|1,0,1]=4 5929 B16R2.135 Oc1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000185759 [0,1,0,0,0,1|1,0,0]=3 5930 B16R2.135 Oc1ccc(cn1)CNCc2c[nH]cn2 207a_100000758547_100011361521 [0,1,0,0,0,1|1,0,0]=3 5931 B16R2.135 Oc1ccc(cn1)CNCc2c[nH]cn2 2230a_100000757128_100000707719 [0,1,0,0,0,1|1,0,0]=3 5932 B16R2.135 Oc1ccc(cn1)CNCc2c[nH]nn2 207a_100020620823_100011361521 [0,1,0,0,0,1|2,0,0]=4 5933 B16R2.135 Oc1ccc(cn1)CNCc2cocn2 207a_100015188801_100011361521 [0,1,0,0,0,1|2,0,0]=4 5934 B16R2.135 Oc1ccc(cn1)CNCc2cscn2 207a_100015185402_100011361521 [0,1,0,0,0,1|2,0,0]=4 5935 B16R2.135 Oc1ccc(cn1)CNCc2cscn2 2230a_100000757128_100000205941 [0,1,0,0,0,1|2,0,0]=4 5936 B16R2.135 Oc1ccc(nc1)SCCc2c[nH]cn2 62a_100000685995_100020628418 [0,1,0,0,0,1|2,0,0]=4 5937 B16R2.135 Oc1ccc(nc1)SCCc2c[nH]cn2 62a_100020628418_100000744096 [0,1,0,0,0,1|2,0,0]=4 5938 B16R2.135 [O-][n+]1ccc(cc1)COCc2c[nH]cn2 34a_100000031831_100000707719 [0,1,0,0,0,1|2,0,0]=4 5939 B16R2.135 [O-][n+]1ccc(cc1)SCCc2c[nH]cn2 62a_100020628418_100000039755 [0,1,0,0,0,1|2,0,0]=4 5940 B16R2.255 Brc1cc(ccn1)CNCc2c[nH]cn2 2230a_100025757509_100000707719 [0,1,0,0,0,1|1,0,0]=3 5941 B16R2.255 Brc1cc(ccn1)CNCc2c[nH]cn2 34a_100025757509_100000707719 [0,1,0,0,0,1|1,0,0]=3 5942 B16R2.255 Brc1cc(ccn1)CNCc2c[nH]nn2 270004a_100020620823_100009814634 [0,1,0,0,0,1|2,0,0]=4 5943 B16R2.255 Brc1cc(ccn1)CNCc2cocn2 270004a_100015188801_100009814634 [0,1,0,0,0,1|2,0,0]=4 5944 B16R2.255 Brc1cc(ccn1)CNCc2cocn2 270004a_100025757509_100000050382 [0,1,0,0,0,1|2,0,0]=4 5945 B16R2.255 Brc1cc(ccn1)CNCc2cscn2 2230a_100015185402_100010243470 [0,1,0,0,0,1|2,0,0]=4 5946 B16R2.255 Brc1cc(ccn1)CNCc2cscn2 2230a_100025757509_100000205941 [0,1,0,0,0,1|2,0,0]=4 5947 B16R2.255 Brc1cc(ccn1)CNCc2cscn2 270004a_100025757509_100000743575 [0,1,0,0,0,1|2,0,0]=4 5948 B16R2.255 Brc1cc(ccn1)CNCc2cscn2 34a_100025757509_100000205941 [0,1,0,0,0,1|2,0,0]=4 5949 B16R2.255 Brc1cc(ccn1)COCc2c[nH]cn2 34a_100009814636_100000707719 [0,1,0,0,0,1|2,0,0]=4 5950 B16R2.255 Brc1cc(ccn1)CSCc2c[nH]cn2 62a_100000707719_100010243470 [0,1,0,0,0,1|2,0,0]=4 5951 B16R2.255 Brc1cc(ccn1)CSCc2c[nH]cn2 62a_100010254460_100000707719 [0,1,0,0,0,1|2,0,0]=4 5952 B16R2.255 Brc1cc(ccn1)SCCc2c[nH]cn2 62a_100009814637_100020628418 [0,1,0,0,0,1|2,0,0]=4 5953 B16R2.255 Brc1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100009814637 [0,1,0,0,0,1|2,0,0]=4 5954 B16R2.255 Brc1cccc(c1)CCSc2c[nH]cn2 62a_100000756875_100011740638 [0,1,0,0,0,1|1,0,0]=3 5955 B16R2.255 Brc1cccc(c1)CCSc2c[nH]cn2 62a_100011740638_100000756875 [0,1,0,0,0,1|1,0,0]=3 5956 B16R2.255 Brc1cccc(c1)CCSc2c[nH]nn2 62a_100009819707_100011740638 [0,1,0,0,0,1|2,0,0]=4 5957 B16R2.255 Brc1cccc(c1)CCSc2c[nH]nn2 62a_100011740638_100009819707 [0,1,0,0,0,1|2,0,0]=4 5958 B16R2.255 Brc1cccc(c1)CCSc2cscn2 62a_100000751502_100011740638 [0,1,0,0,0,1|2,0,0]=4 5959 B16R2.255 Brc1cccc(c1)CCSc2cscn2 62a_100011740638_100000751502 [0,1,0,0,0,1|2,0,0]=4 5960 B16R2.255 Brc1cccc(c1)CCSc2nc[nH]n2 62a_100000761765_100011740638 [0,1,0,0,0,1|2,0,0]=4 5961 B16R2.255 Brc1cccc(c1)CCSc2nc[nH]n2 62a_100011740638_100000761765 [0,1,0,0,0,1|2,0,0]=4 5962 B16R2.255 Brc1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000210085 [0,1,0,0,0,1|0,0,0]=2 5963 B16R2.255 Brc1cccc(c1)CNCc2c[nH]cn2 2230a_100000174977_100000707719 [0,1,0,0,0,1|0,0,0]=2 5964 B16R2.255 Brc1cccc(c1)CNCc2c[nH]cn2 34a_100000174977_100000707719 [0,1,0,0,0,1|0,0,0]=2 5965 B16R2.255 Brc1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000210085 [0,1,0,0,0,1|1,0,0]=3 5966 B16R2.255 Brc1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000210085 [0,1,0,0,0,1|1,0,0]=3 5967 B16R2.255 Brc1cccc(c1)CNCc2cc[nH]n2 207a_100000174977_100000738523 [0,1,0,0,0,1|2,0,0]=4 5968 B16R2.255 Brc1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000210085 [0,1,0,0,0,1|2,0,0]=4 5969 B16R2.255 Brc1cccc(c1)CNCc2cc[nH]n2 270004a_100000174977_100000738523 [0,1,0,0,0,1|2,0,0]=4 5970 B16R2.255 Brc1cccc(c1)CNCc2ccco2 207a_100000174977_100000186105 [0,1,0,0,0,1|2,0,0]=4 5971 B16R2.255 Brc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210085 [0,1,0,0,0,1|2,0,0]=4 5972 B16R2.255 Brc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000698116 [0,1,0,0,0,1|2,0,0]=4 5973 B16R2.255 Brc1cccc(c1)CNCc2ccco2 270004a_100000174977_100000186105 [0,1,0,0,0,1|2,0,0]=4 5974 B16R2.255 Brc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210085 [0,1,0,0,0,1|2,0,0]=4 5975 B16R2.255 Brc1cccc(c1)CNCc2ccco2 34a_100000185738_100000698116 [0,1,0,0,0,1|2,0,0]=4 5976 B16R2.255 Brc1cccc(c1)CNCc2cccs2 207a_100000174977_100000209959 [0,1,0,0,0,1|2,0,0]=4 5977 B16R2.255 Brc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210085 [0,1,0,0,0,1|2,0,0]=4 5978 B16R2.255 Brc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000698116 [0,1,0,0,0,1|2,0,0]=4 5979 B16R2.255 Brc1cccc(c1)CNCc2cccs2 270004a_100000174977_100000209959 [0,1,0,0,0,1|2,0,0]=4 5980 B16R2.255 Brc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210085 [0,1,0,0,0,1|2,0,0]=4 5981 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 207a_100000174977_100011215517 [0,1,0,0,0,1|2,0,0]=4 5982 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210085 [0,1,0,0,0,1|2,0,0]=4 5983 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000698116 [0,1,0,0,0,1|2,0,0]=4 5984 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 270004a_100000174977_100011215517 [0,1,0,0,0,1|2,0,0]=4 5985 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210085 [0,1,0,0,0,1|2,0,0]=4 5986 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000698116 [0,1,0,0,0,1|2,0,0]=4 5987 B16R2.255 Brc1cccc(c1)CNCc2ccon2 207a_100000688301_100000210085 [0,1,0,0,0,1|2,0,0]=4 5988 B16R2.255 Brc1cccc(c1)CNCc2ccon2 2230a_100000174977_100000234950 [0,1,0,0,0,1|2,0,0]=4 5989 B16R2.255 Brc1cccc(c1)CNCc2ccon2 270004a_100000688301_100000210085 [0,1,0,0,0,1|2,0,0]=4 5990 B16R2.255 Brc1cccc(c1)CNCc2ccon2 34a_100000174977_100000234950 [0,1,0,0,0,1|2,0,0]=4 5991 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 207a_100000174977_100000188534 [0,1,0,0,0,1|2,0,0]=4 5992 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210085 [0,1,0,0,0,1|2,0,0]=4 5993 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 2230a_100000174977_100011261437 [0,1,0,0,0,1|2,0,0]=4 5994 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000698116 [0,1,0,0,0,1|2,0,0]=4 5995 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 270004a_100000174977_100000188534 [0,1,0,0,0,1|2,0,0]=4 5996 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210085 [0,1,0,0,0,1|2,0,0]=4 5997 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 34a_100000174977_100011261437 [0,1,0,0,0,1|2,0,0]=4 5998 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000698116 [0,1,0,0,0,1|2,0,0]=4 5999 B16R2.255 Brc1cccc(c1)CNCc2cn[nH]c2 207a_100000174977_100016992096 [0,1,0,0,0,1|2,0,0]=4 6000 B16R2.255 Brc1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000210085 [0,1,0,0,0,1|2,0,0]=4 6001 B16R2.255 Brc1cccc(c1)CNCc2cn[nH]c2 270004a_100000174977_100016992096 [0,1,0,0,0,1|2,0,0]=4 6002 B16R2.255 Brc1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000210085 [0,1,0,0,0,1|2,0,0]=4 6003 B16R2.255 Brc1cccc(c1)CNCc2cnc[nH]2 207a_100000174977_100000742939 [0,1,0,0,0,1|0,0,2]=4 6004 B16R2.255 Brc1cccc(c1)CNCc2cnco2 207a_100020634212_100000210085 [0,1,0,0,0,1|1,0,1]=4 6005 B16R2.255 Brc1cccc(c1)CNCc2cnco2 270004a_100000174977_100000064291 [0,1,0,0,0,1|1,0,1]=4 6006 B16R2.255 Brc1cccc(c1)CNCc2cnco2 270004a_100020634212_100000210085 [0,1,0,0,0,1|1,0,1]=4 6007 B16R2.255 Brc1cccc(c1)CNCc2cncs2 207a_100000174977_100000749870 [0,1,0,0,0,1|1,0,1]=4 6008 B16R2.255 Brc1cccc(c1)CNCc2cncs2 207a_100016987365_100000210085 [0,1,0,0,0,1|1,0,1]=4 6009 B16R2.255 Brc1cccc(c1)CNCc2cncs2 2230a_100000174977_100015185245 [0,1,0,0,0,1|1,0,1]=4 6010 B16R2.255 Brc1cccc(c1)CNCc2cncs2 2230a_100016987365_100000698116 [0,1,0,0,0,1|1,0,1]=4 6011 B16R2.255 Brc1cccc(c1)CNCc2cncs2 270004a_100000174977_100000749870 [0,1,0,0,0,1|1,0,1]=4 6012 B16R2.255 Brc1cccc(c1)CNCc2cncs2 270004a_100016987365_100000210085 [0,1,0,0,0,1|1,0,1]=4 6013 B16R2.255 Brc1cccc(c1)CNCc2cncs2 34a_100000174977_100015185245 [0,1,0,0,0,1|1,0,1]=4 6014 B16R2.255 Brc1cccc(c1)CNCc2cocn2 207a_100015188801_100000210085 [0,1,0,0,0,1|1,0,0]=3 6015 B16R2.255 Brc1cccc(c1)CNCc2cocn2 270004a_100000174977_100000050382 [0,1,0,0,0,1|1,0,0]=3 6016 B16R2.255 Brc1cccc(c1)CNCc2cocn2 270004a_100015188801_100000210085 [0,1,0,0,0,1|1,0,0]=3 6017 B16R2.255 Brc1cccc(c1)CNCc2cscn2 207a_100000174977_100000743575 [0,1,0,0,0,1|1,0,0]=3 6018 B16R2.255 Brc1cccc(c1)CNCc2cscn2 207a_100015185402_100000210085 [0,1,0,0,0,1|1,0,0]=3 6019 B16R2.255 Brc1cccc(c1)CNCc2cscn2 2230a_100000174977_100000205941 [0,1,0,0,0,1|1,0,0]=3 6020 B16R2.255 Brc1cccc(c1)CNCc2cscn2 2230a_100015185402_100000698116 [0,1,0,0,0,1|1,0,0]=3 6021 B16R2.255 Brc1cccc(c1)CNCc2cscn2 270004a_100000174977_100000743575 [0,1,0,0,0,1|1,0,0]=3 6022 B16R2.255 Brc1cccc(c1)CNCc2cscn2 34a_100000174977_100000205941 [0,1,0,0,0,1|1,0,0]=3 6023 B16R2.255 Brc1cccc(c1)CNCc2csnn2 270004a_100000174977_100000738508 [0,1,0,0,0,1|2,0,0]=4 6024 B16R2.255 Brc1cccc(c1)CNCc2ncc[nH]2 207a_100000174977_100000743867 [0,1,0,0,0,1|2,0,0]=4 6025 B16R2.255 Brc1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000210085 [0,1,0,0,0,1|2,0,0]=4 6026 B16R2.255 Brc1cccc(c1)CNCc2ncc[nH]2 2230a_100000174977_100016991755 [0,1,0,0,0,1|2,0,0]=4 6027 B16R2.255 Brc1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000210085 [0,1,0,0,0,1|2,0,0]=4 6028 B16R2.255 Brc1cccc(c1)CNCc2ncc[nH]2 34a_100000174977_100016991755 [0,1,0,0,0,1|2,0,0]=4 6029 B16R2.255 Brc1cccc(c1)CNCc2ncco2 207a_100016994969_100000210085 [0,1,0,0,0,1|2,0,0]=4 6030 B16R2.255 Brc1cccc(c1)CNCc2ncco2 2230a_100000174977_103436540062 [0,1,0,0,0,1|2,0,0]=4 6031 B16R2.255 Brc1cccc(c1)CNCc2ncco2 2230a_100016994969_100000698116 [0,1,0,0,0,1|2,0,0]=4 6032 B16R2.255 Brc1cccc(c1)CNCc2ncco2 270004a_100000174977_100000064290 [0,1,0,0,0,1|2,0,0]=4 6033 B16R2.255 Brc1cccc(c1)CNCc2ncco2 34a_100000174977_103436540062 [0,1,0,0,0,1|2,0,0]=4 6034 B16R2.255 Brc1cccc(c1)CNCc2nccs2 207a_100000174977_100000750902 [0,1,0,0,0,1|2,0,0]=4 6035 B16R2.255 Brc1cccc(c1)CNCc2nccs2 207a_100000740555_100000210085 [0,1,0,0,0,1|2,0,0]=4 6036 B16R2.255 Brc1cccc(c1)CNCc2nccs2 2230a_100000174977_100015184050 [0,1,0,0,0,1|2,0,0]=4 6037 B16R2.255 Brc1cccc(c1)CNCc2nccs2 2230a_100000740555_100000698116 [0,1,0,0,0,1|2,0,0]=4 6038 B16R2.255 Brc1cccc(c1)CNCc2nccs2 270004a_100000174977_100000750902 [0,1,0,0,0,1|2,0,0]=4 6039 B16R2.255 Brc1cccc(c1)CNCc2nccs2 270004a_100000740555_100000210085 [0,1,0,0,0,1|2,0,0]=4 6040 B16R2.255 Brc1cccc(c1)CNCc2nccs2 34a_100000174977_100015184050 [0,1,0,0,0,1|2,0,0]=4 6041 B16R2.255 Brc1cccc(c1)CNCc2ncon2 34a_100000174977_100000233494 [0,1,0,0,0,1|2,0,0]=4 6042 B16R2.255 Brc1cccc(c1)CNCn2cncn2 2230a_100000174977_200020645497 [0,1,0,0,0,1|1,0,1]=4 6043 B16R2.255 Brc1cccc(c1)CNCn2cncn2 34a_100000174977_200020645497 [0,1,0,0,0,1|1,0,1]=4 6044 B16R2.255 Brc1cccc(c1)COCc2c[nH]cn2 34a_100000687537_100000707719 [0,1,0,0,0,1|1,0,0]=3 6045 B16R2.255 Brc1cccc(c1)COCc2cscn2 34a_100000687537_100000205941 [0,1,0,0,0,1|2,0,0]=4 6046 B16R2.255 Brc1cccc(c1)COCc2cscn2 7a_100000687537_100000205941 [0,1,0,0,0,1|2,0,0]=4 6047 B16R2.255 Brc1cccc(c1)CSCc2c[nH]cn2 62a_100000211773_100000707719 [0,1,0,0,0,1|1,0,0]=3 6048 B16R2.255 Brc1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100000211773 [0,1,0,0,0,1|1,0,0]=3 6049 B16R2.255 Brc1cccc(c1)CSCc2cscn2 62a_100000205941_100000211773 [0,1,0,0,0,1|2,0,0]=4 6050 B16R2.255 Brc1cccc(c1)CSCc2cscn2 62a_100000211773_100000205941 [0,1,0,0,0,1|2,0,0]=4 6051 B16R2.255 Brc1cccc(c1)NCCc2cccs2 34a_100000210019_100000748579 [0,1,0,0,0,1|2,0,0]=4 6052 B16R2.255 Brc1cccc(c1)NCCn2cccn2 34a_100000210019_100015204718 [0,1,0,0,0,1|2,0,0]=4 6053 B16R2.255 Brc1cccc(c1)NCCn2cncn2 34a_100000210019_200000749826 [0,1,0,0,0,1|1,0,1]=4 6054 B16R2.255 Brc1cccc(c1)NN=Cc2cc[nH]c2 4a_100000217339_100000760201 [0,1,0,0,0,1|1,0,1]=4 6055 B16R2.255 Brc1cccc(c1)NN=Cc2cocn2 4a_100000217339_100000050382 [0,1,0,0,0,1|1,0,1]=4 6056 B16R2.255 Brc1cccc(c1)NN=Cc2cscn2 4a_100000217339_100000743575 [0,1,0,0,0,1|1,0,1]=4 6057 B16R2.255 Brc1cccc(c1)OCCc2c[nH]cn2 7a_100000210342_100020628418 [0,1,0,0,0,1|1,0,0]=3 6058 B16R2.255 Brc1cccc(c1)SCCc2c[nH]cn2 62a_100000691529_100020628418 [0,1,0,0,0,1|1,0,0]=3 6059 B16R2.255 Brc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100000691529 [0,1,0,0,0,1|1,0,0]=3 6060 B16R2.255 Brc1cccc(n1)CNCc2c[nH]cn2 2230a_100016987751_100000707719 [0,1,0,0,0,1|1,0,0]=3 6061 B16R2.255 Brc1cccc(n1)CNCc2c[nH]nn2 270004a_100020620823_100000688028 [0,1,0,0,0,1|2,0,0]=4 6062 B16R2.255 Brc1cccc(n1)CNCc2cocn2 270004a_100015188801_100000688028 [0,1,0,0,0,1|2,0,0]=4 6063 B16R2.255 Brc1cccc(n1)CNCc2cscn2 2230a_100015185402_100009889011 [0,1,0,0,0,1|2,0,0]=4 6064 B16R2.255 Brc1cccc(n1)CNCc2cscn2 2230a_100016987751_100000205941 [0,1,0,0,0,1|2,0,0]=4 6065 B16R2.255 Brc1cccc(n1)COCc2c[nH]cn2 34a_100000694195_100000707719 [0,1,0,0,0,1|2,0,0]=4 6066 B16R2.255 Brc1cccc(n1)CSCc2c[nH]cn2 62a_100000707719_100009889011 [0,1,0,0,0,1|2,0,0]=4 6067 B16R2.255 Brc1cccc(n1)CSCc2c[nH]cn2 62a_100009889011_100000707719 [0,1,0,0,0,1|2,0,0]=4 6068 B16R2.255 Brc1cccc(n1)SCCc2c[nH]cn2 62a_100000684672_100020628418 [0,1,0,0,0,1|2,0,0]=4 6069 B16R2.255 Brc1cccc(n1)SCCc2c[nH]cn2 62a_100020628418_100000684672 [0,1,0,0,0,1|2,0,0]=4 6070 B16R2.255 Brc1ccnc(c1)CNCc2c[nH]nn2 270004a_100020620823_100009818557 [0,1,0,0,0,1|2,0,0]=4 6071 B16R2.255 Brc1ccnc(c1)CNCc2cocn2 270004a_100015188801_100009818557 [0,1,0,0,0,1|2,0,0]=4 6072 B16R2.255 Brc1ccnc(c1)CNCc2cscn2 2230a_100015185402_100010173614 [0,1,0,0,0,1|2,0,0]=4 6073 B16R2.255 Brc1ccnc(c1)CSCc2c[nH]cn2 62a_100000707719_100010173614 [0,1,0,0,0,1|2,0,0]=4 6074 B16R2.255 Brc1ccnc(c1)CSCc2c[nH]cn2 62a_100010173614_100000707719 [0,1,0,0,0,1|2,0,0]=4 6075 B16R2.255 Brc1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100000687066 [0,1,0,0,0,1|1,0,0]=3 6076 B16R2.255 Brc1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100000687066 [0,1,0,0,0,1|2,0,0]=4 6077 B16R2.255 Brc1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000687066 [0,1,0,0,0,1|2,0,0]=4 6078 B16R2.255 Brc1cncc(c1)CNCc2cocn2 207a_100015188801_100000687066 [0,1,0,0,0,1|2,0,0]=4 6079 B16R2.255 Brc1cncc(c1)CNCc2cocn2 270004a_100011249555_100000050382 [0,1,0,0,0,1|2,0,0]=4 6080 B16R2.255 Brc1cncc(c1)CNCc2cocn2 270004a_100015188801_100000687066 [0,1,0,0,0,1|2,0,0]=4 6081 B16R2.255 Brc1cncc(c1)CNCc2cscn2 207a_100011249555_100000743575 [0,1,0,0,0,1|2,0,0]=4 6082 B16R2.255 Brc1cncc(c1)CNCc2cscn2 207a_100015185402_100000687066 [0,1,0,0,0,1|2,0,0]=4 6083 B16R2.255 Brc1cncc(c1)CNCc2cscn2 2230a_100015185402_100000738771 [0,1,0,0,0,1|2,0,0]=4 6084 B16R2.255 Brc1cncc(c1)CNCc2cscn2 270004a_100011249555_100000743575 [0,1,0,0,0,1|2,0,0]=4 6085 B16R2.255 Brc1cncc(c1)COCc2c[nH]cn2 34a_100011259137_100000707719 [0,1,0,0,0,1|2,0,0]=4 6086 B16R2.255 Brc1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100000738771 [0,1,0,0,0,1|2,0,0]=4 6087 B16R2.255 Brc1cncc(c1)CSCc2c[nH]cn2 62a_100000738771_100000707719 [0,1,0,0,0,1|2,0,0]=4 6088 B16R2.255 Brc1cncc(c1)OCCc2c[nH]cn2 7a_100000754920_100020628418 [0,1,0,0,0,1|2,0,0]=4 6089 B16R2.255 Brc1cncc(c1)SCCc2c[nH]cn2 62a_100000728054_100020628418 [0,1,0,0,0,1|2,0,0]=4 6090 B16R2.255 Brc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000728054 [0,1,0,0,0,1|2,0,0]=4 6091 B16R2.255 C[n+]1cccc(c1)SCCc2c[nH]cn2 62a_100009996589_100020628418 [0,1,0,0,0,1|2,0,0]=4 6092 B16R2.255 C[n+]1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100009996589 [0,1,0,0,0,1|2,0,0]=4 6093 B16R2.255 Cc1cc(ccn1)CNCc2c[nH]cn2 207a_100000758547_100011361630 [0,1,0,0,0,1|1,0,0]=3 6094 B16R2.255 Cc1cc(ccn1)CNCc2c[nH]cn2 34a_100011934566_100000707719 [0,1,0,0,0,1|1,0,0]=3 6095 B16R2.255 Cc1cc(ccn1)CNCc2c[nH]nn2 207a_100020620823_100011361630 [0,1,0,0,0,1|2,0,0]=4 6096 B16R2.255 Cc1cc(ccn1)CNCc2c[nH]nn2 270004a_100020620823_100011361630 [0,1,0,0,0,1|2,0,0]=4 6097 B16R2.255 Cc1cc(ccn1)CNCc2cocn2 207a_100015188801_100011361630 [0,1,0,0,0,1|2,0,0]=4 6098 B16R2.255 Cc1cc(ccn1)CNCc2cocn2 270004a_100011934566_100000050382 [0,1,0,0,0,1|2,0,0]=4 6099 B16R2.255 Cc1cc(ccn1)CNCc2cocn2 270004a_100015188801_100011361630 [0,1,0,0,0,1|2,0,0]=4 6100 B16R2.255 Cc1cc(ccn1)CNCc2cscn2 207a_100011934566_100000743575 [0,1,0,0,0,1|2,0,0]=4 6101 B16R2.255 Cc1cc(ccn1)CNCc2cscn2 207a_100015185402_100011361630 [0,1,0,0,0,1|2,0,0]=4 6102 B16R2.255 Cc1cc(ccn1)CNCc2cscn2 2230a_100015185402_200020672517 [0,1,0,0,0,1|2,0,0]=4 6103 B16R2.255 Cc1cc(ccn1)CNCc2cscn2 270004a_100011934566_100000743575 [0,1,0,0,0,1|2,0,0]=4 6104 B16R2.255 Cc1cc(ccn1)CNCc2cscn2 34a_100011934566_100000205941 [0,1,0,0,0,1|2,0,0]=4 6105 B16R2.255 Cc1cc(ccn1)COCc2c[nH]cn2 34a_100011998630_100000707719 [0,1,0,0,0,1|2,0,0]=4 6106 B16R2.255 Cc1cc(ccn1)CSCc2c[nH]cn2 62a_100000707719_200020672517 [0,1,0,0,0,1|2,0,0]=4 6107 B16R2.255 Cc1cc(ccn1)CSCc2c[nH]cn2 62a_200020672517_100000707719 [0,1,0,0,0,1|2,0,0]=4 6108 B16R2.255 Cc1cc(ccn1)NCCc2c[nH]cn2 27a_100000755092_100000758586 [0,1,0,0,0,1|1,0,0]=3 6109 B16R2.255 Cc1cc(ccn1)SCCc2c[nH]cn2 62a_100000758586_100020628418 [0,1,0,0,0,1|2,0,0]=4 6110 B16R2.255 Cc1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100000758586 [0,1,0,0,0,1|2,0,0]=4 6111 B16R2.255 Cc1cc(ncn1)NCCc2c[nH]cn2 27a_100000755092_100000744208 [0,1,0,0,0,1|2,0,0]=4 6112 B16R2.255 Cc1cccc(c1)CCSc2c[nH]cn2 62a_100000756875_100011713685 [0,1,0,0,0,1|1,0,0]=3 6113 B16R2.255 Cc1cccc(c1)CCSc2c[nH]cn2 62a_100011713685_100000756875 [0,1,0,0,0,1|1,0,0]=3 6114 B16R2.255 Cc1cccc(c1)CCSc2c[nH]nn2 62a_100009819707_100011713685 [0,1,0,0,0,1|2,0,0]=4 6115 B16R2.255 Cc1cccc(c1)CCSc2c[nH]nn2 62a_100011713685_100009819707 [0,1,0,0,0,1|2,0,0]=4 6116 B16R2.255 Cc1cccc(c1)CCSc2cscn2 62a_100000751502_100011713685 [0,1,0,0,0,1|2,0,0]=4 6117 B16R2.255 Cc1cccc(c1)CCSc2cscn2 62a_100011713685_100000751502 [0,1,0,0,0,1|2,0,0]=4 6118 B16R2.255 Cc1cccc(c1)CCSc2nc[nH]n2 62a_100000761765_100011713685 [0,1,0,0,0,1|2,0,0]=4 6119 B16R2.255 Cc1cccc(c1)CCSc2nc[nH]n2 62a_100011713685_100000761765 [0,1,0,0,0,1|2,0,0]=4 6120 B16R2.255 Cc1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000211157 [0,1,0,0,0,1|0,0,0]=2 6121 B16R2.255 Cc1cccc(c1)CNCc2c[nH]cn2 2230a_100000185548_100000707719 [0,1,0,0,0,1|0,0,0]=2 6122 B16R2.255 Cc1cccc(c1)CNCc2c[nH]cn2 34a_100000185548_100000707719 [0,1,0,0,0,1|0,0,0]=2 6123 B16R2.255 Cc1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000211157 [0,1,0,0,0,1|1,0,0]=3 6124 B16R2.255 Cc1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000211157 [0,1,0,0,0,1|1,0,0]=3 6125 B16R2.255 Cc1cccc(c1)CNCc2cc[nH]n2 207a_100000185548_100000738523 [0,1,0,0,0,1|2,0,0]=4 6126 B16R2.255 Cc1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000211157 [0,1,0,0,0,1|2,0,0]=4 6127 B16R2.255 Cc1cccc(c1)CNCc2cc[nH]n2 270004a_100000185548_100000738523 [0,1,0,0,0,1|2,0,0]=4 6128 B16R2.255 Cc1cccc(c1)CNCc2ccco2 207a_100000185548_100000186105 [0,1,0,0,0,1|2,0,0]=4 6129 B16R2.255 Cc1cccc(c1)CNCc2ccco2 207a_100000185738_100000211157 [0,1,0,0,0,1|2,0,0]=4 6130 B16R2.255 Cc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000211840 [0,1,0,0,0,1|2,0,0]=4 6131 B16R2.255 Cc1cccc(c1)CNCc2ccco2 270004a_100000185548_100000186105 [0,1,0,0,0,1|2,0,0]=4 6132 B16R2.255 Cc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000211157 [0,1,0,0,0,1|2,0,0]=4 6133 B16R2.255 Cc1cccc(c1)CNCc2ccco2 34a_100000185738_100000211840 [0,1,0,0,0,1|2,0,0]=4 6134 B16R2.255 Cc1cccc(c1)CNCc2cccs2 207a_100000185548_100000209959 [0,1,0,0,0,1|2,0,0]=4 6135 B16R2.255 Cc1cccc(c1)CNCc2cccs2 207a_100000211653_100000211157 [0,1,0,0,0,1|2,0,0]=4 6136 B16R2.255 Cc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000211840 [0,1,0,0,0,1|2,0,0]=4 6137 B16R2.255 Cc1cccc(c1)CNCc2cccs2 270004a_100000185548_100000209959 [0,1,0,0,0,1|2,0,0]=4 6138 B16R2.255 Cc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000211157 [0,1,0,0,0,1|2,0,0]=4 6139 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 207a_100000185548_100011215517 [0,1,0,0,0,1|2,0,0]=4 6140 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000211157 [0,1,0,0,0,1|2,0,0]=4 6141 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000211840 [0,1,0,0,0,1|2,0,0]=4 6142 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 270004a_100000185548_100011215517 [0,1,0,0,0,1|2,0,0]=4 6143 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000211157 [0,1,0,0,0,1|2,0,0]=4 6144 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000211840 [0,1,0,0,0,1|2,0,0]=4 6145 B16R2.255 Cc1cccc(c1)CNCc2ccon2 207a_100000688301_100000211157 [0,1,0,0,0,1|2,0,0]=4 6146 B16R2.255 Cc1cccc(c1)CNCc2ccon2 2230a_100000185548_100000234950 [0,1,0,0,0,1|2,0,0]=4 6147 B16R2.255 Cc1cccc(c1)CNCc2ccon2 270004a_100000688301_100000211157 [0,1,0,0,0,1|2,0,0]=4 6148 B16R2.255 Cc1cccc(c1)CNCc2ccon2 34a_100000185548_100000234950 [0,1,0,0,0,1|2,0,0]=4 6149 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 207a_100000185548_100000188534 [0,1,0,0,0,1|2,0,0]=4 6150 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000211157 [0,1,0,0,0,1|2,0,0]=4 6151 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 2230a_100000185548_100011261437 [0,1,0,0,0,1|2,0,0]=4 6152 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000211840 [0,1,0,0,0,1|2,0,0]=4 6153 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 270004a_100000185548_100000188534 [0,1,0,0,0,1|2,0,0]=4 6154 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000211157 [0,1,0,0,0,1|2,0,0]=4 6155 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 34a_100000185548_100011261437 [0,1,0,0,0,1|2,0,0]=4 6156 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000211840 [0,1,0,0,0,1|2,0,0]=4 6157 B16R2.255 Cc1cccc(c1)CNCc2cn[nH]c2 207a_100000185548_100016992096 [0,1,0,0,0,1|2,0,0]=4 6158 B16R2.255 Cc1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000211157 [0,1,0,0,0,1|2,0,0]=4 6159 B16R2.255 Cc1cccc(c1)CNCc2cn[nH]c2 270004a_100000185548_100016992096 [0,1,0,0,0,1|2,0,0]=4 6160 B16R2.255 Cc1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000211157 [0,1,0,0,0,1|2,0,0]=4 6161 B16R2.255 Cc1cccc(c1)CNCc2cnc[nH]2 207a_100000185548_100000742939 [0,1,0,0,0,1|0,0,2]=4 6162 B16R2.255 Cc1cccc(c1)CNCc2cnco2 207a_100020634212_100000211157 [0,1,0,0,0,1|1,0,1]=4 6163 B16R2.255 Cc1cccc(c1)CNCc2cnco2 270004a_100000185548_100000064291 [0,1,0,0,0,1|1,0,1]=4 6164 B16R2.255 Cc1cccc(c1)CNCc2cnco2 270004a_100020634212_100000211157 [0,1,0,0,0,1|1,0,1]=4 6165 B16R2.255 Cc1cccc(c1)CNCc2cncs2 207a_100000185548_100000749870 [0,1,0,0,0,1|1,0,1]=4 6166 B16R2.255 Cc1cccc(c1)CNCc2cncs2 207a_100016987365_100000211157 [0,1,0,0,0,1|1,0,1]=4 6167 B16R2.255 Cc1cccc(c1)CNCc2cncs2 2230a_100000185548_100015185245 [0,1,0,0,0,1|1,0,1]=4 6168 B16R2.255 Cc1cccc(c1)CNCc2cncs2 2230a_100016987365_100000211840 [0,1,0,0,0,1|1,0,1]=4 6169 B16R2.255 Cc1cccc(c1)CNCc2cncs2 270004a_100000185548_100000749870 [0,1,0,0,0,1|1,0,1]=4 6170 B16R2.255 Cc1cccc(c1)CNCc2cncs2 270004a_100016987365_100000211157 [0,1,0,0,0,1|1,0,1]=4 6171 B16R2.255 Cc1cccc(c1)CNCc2cncs2 34a_100000185548_100015185245 [0,1,0,0,0,1|1,0,1]=4 6172 B16R2.255 Cc1cccc(c1)CNCc2cocn2 207a_100015188801_100000211157 [0,1,0,0,0,1|1,0,0]=3 6173 B16R2.255 Cc1cccc(c1)CNCc2cocn2 270004a_100000185548_100000050382 [0,1,0,0,0,1|1,0,0]=3 6174 B16R2.255 Cc1cccc(c1)CNCc2cocn2 270004a_100015188801_100000211157 [0,1,0,0,0,1|1,0,0]=3 6175 B16R2.255 Cc1cccc(c1)CNCc2cscn2 207a_100000185548_100000743575 [0,1,0,0,0,1|1,0,0]=3 6176 B16R2.255 Cc1cccc(c1)CNCc2cscn2 207a_100015185402_100000211157 [0,1,0,0,0,1|1,0,0]=3 6177 B16R2.255 Cc1cccc(c1)CNCc2cscn2 2230a_100000185548_100000205941 [0,1,0,0,0,1|1,0,0]=3 6178 B16R2.255 Cc1cccc(c1)CNCc2cscn2 2230a_100015185402_100000211840 [0,1,0,0,0,1|1,0,0]=3 6179 B16R2.255 Cc1cccc(c1)CNCc2cscn2 270004a_100000185548_100000743575 [0,1,0,0,0,1|1,0,0]=3 6180 B16R2.255 Cc1cccc(c1)CNCc2cscn2 34a_100000185548_100000205941 [0,1,0,0,0,1|1,0,0]=3 6181 B16R2.255 Cc1cccc(c1)CNCc2csnn2 270004a_100000185548_100000738508 [0,1,0,0,0,1|2,0,0]=4 6182 B16R2.255 Cc1cccc(c1)CNCc2ncc[nH]2 207a_100000185548_100000743867 [0,1,0,0,0,1|2,0,0]=4 6183 B16R2.255 Cc1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000211157 [0,1,0,0,0,1|2,0,0]=4 6184 B16R2.255 Cc1cccc(c1)CNCc2ncc[nH]2 2230a_100000185548_100016991755 [0,1,0,0,0,1|2,0,0]=4 6185 B16R2.255 Cc1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000211157 [0,1,0,0,0,1|2,0,0]=4 6186 B16R2.255 Cc1cccc(c1)CNCc2ncc[nH]2 34a_100000185548_100016991755 [0,1,0,0,0,1|2,0,0]=4 6187 B16R2.255 Cc1cccc(c1)CNCc2ncco2 207a_100016994969_100000211157 [0,1,0,0,0,1|2,0,0]=4 6188 B16R2.255 Cc1cccc(c1)CNCc2ncco2 2230a_100000185548_103436540062 [0,1,0,0,0,1|2,0,0]=4 6189 B16R2.255 Cc1cccc(c1)CNCc2ncco2 2230a_100016994969_100000211840 [0,1,0,0,0,1|2,0,0]=4 6190 B16R2.255 Cc1cccc(c1)CNCc2ncco2 270004a_100000185548_100000064290 [0,1,0,0,0,1|2,0,0]=4 6191 B16R2.255 Cc1cccc(c1)CNCc2ncco2 34a_100000185548_103436540062 [0,1,0,0,0,1|2,0,0]=4 6192 B16R2.255 Cc1cccc(c1)CNCc2nccs2 207a_100000185548_100000750902 [0,1,0,0,0,1|2,0,0]=4 6193 B16R2.255 Cc1cccc(c1)CNCc2nccs2 207a_100000740555_100000211157 [0,1,0,0,0,1|2,0,0]=4 6194 B16R2.255 Cc1cccc(c1)CNCc2nccs2 2230a_100000185548_100015184050 [0,1,0,0,0,1|2,0,0]=4 6195 B16R2.255 Cc1cccc(c1)CNCc2nccs2 2230a_100000740555_100000211840 [0,1,0,0,0,1|2,0,0]=4 6196 B16R2.255 Cc1cccc(c1)CNCc2nccs2 270004a_100000185548_100000750902 [0,1,0,0,0,1|2,0,0]=4 6197 B16R2.255 Cc1cccc(c1)CNCc2nccs2 270004a_100000740555_100000211157 [0,1,0,0,0,1|2,0,0]=4 6198 B16R2.255 Cc1cccc(c1)CNCc2nccs2 34a_100000185548_100015184050 [0,1,0,0,0,1|2,0,0]=4 6199 B16R2.255 Cc1cccc(c1)CNCc2ncon2 34a_100000185548_100000233494 [0,1,0,0,0,1|2,0,0]=4 6200 B16R2.255 Cc1cccc(c1)CNCn2cncn2 2230a_100000185548_200020645497 [0,1,0,0,0,1|1,0,1]=4 6201 B16R2.255 Cc1cccc(c1)CNCn2cncn2 34a_100000185548_200020645497 [0,1,0,0,0,1|1,0,1]=4 6202 B16R2.255 Cc1cccc(c1)COCc2c[nH]cn2 34a_100011217746_100000707719 [0,1,0,0,0,1|1,0,0]=3 6203 B16R2.255 Cc1cccc(c1)COCc2cscn2 34a_100011217746_100000205941 [0,1,0,0,0,1|2,0,0]=4 6204 B16R2.255 Cc1cccc(c1)COCc2cscn2 7a_100011217746_100000205941 [0,1,0,0,0,1|2,0,0]=4 6205 B16R2.255 Cc1cccc(c1)CSCc2c[nH]cn2 62a_100000211840_100000707719 [0,1,0,0,0,1|1,0,0]=3 6206 B16R2.255 Cc1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100000211840 [0,1,0,0,0,1|1,0,0]=3 6207 B16R2.255 Cc1cccc(c1)CSCc2cscn2 62a_100000205941_100000211840 [0,1,0,0,0,1|2,0,0]=4 6208 B16R2.255 Cc1cccc(c1)CSCc2cscn2 62a_100000211840_100000205941 [0,1,0,0,0,1|2,0,0]=4 6209 B16R2.255 Cc1cccc(c1)NCCc2c[nH]cn2 2230a_100000188690_100020628418 [0,1,0,0,0,1|0,0,0]=2 6210 B16R2.255 Cc1cccc(c1)NCCc2cccs2 2230a_100000188690_100000748579 [0,1,0,0,0,1|2,0,0]=4 6211 B16R2.255 Cc1cccc(c1)NCCc2cccs2 34a_100000188690_100000748579 [0,1,0,0,0,1|2,0,0]=4 6212 B16R2.255 Cc1cccc(c1)NCCc2cn[nH]c2 2230a_100000188690_100000743252 [0,1,0,0,0,1|2,0,0]=4 6213 B16R2.255 Cc1cccc(c1)NCCn2cccn2 2230a_100000188690_100000685285 [0,1,0,0,0,1|2,0,0]=4 6214 B16R2.255 Cc1cccc(c1)NCCn2cccn2 34a_100000188690_100015204718 [0,1,0,0,0,1|2,0,0]=4 6215 B16R2.255 Cc1cccc(c1)NCCn2cncn2 2230a_100000188690_100000731791 [0,1,0,0,0,1|1,0,1]=4 6216 B16R2.255 Cc1cccc(c1)NCCn2cncn2 34a_100000188690_200000749826 [0,1,0,0,0,1|1,0,1]=4 6217 B16R2.255 Cc1cccc(c1)NN=Cc2cc[nH]c2 4a_100000681630_100000760201 [0,1,0,0,0,1|1,0,1]=4 6218 B16R2.255 Cc1cccc(c1)NN=Cc2cocn2 4a_100000681630_100000050382 [0,1,0,0,0,1|1,0,1]=4 6219 B16R2.255 Cc1cccc(c1)NN=Cc2cscn2 4a_100000681630_100000743575 [0,1,0,0,0,1|1,0,1]=4 6220 B16R2.255 Cc1cccc(c1)OCCc2c[nH]cn2 7a_100000210337_100020628418 [0,1,0,0,0,1|1,0,0]=3 6221 B16R2.255 Cc1cccc(c1)SCCc2c[nH]cn2 62a_100011215228_100020628418 [0,1,0,0,0,1|1,0,0]=3 6222 B16R2.255 Cc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100011215228 [0,1,0,0,0,1|1,0,0]=3 6223 B16R2.255 Cc1cccc(n1)CNCc2c[nH]cn2 207a_100000758547_100011215050 [0,1,0,0,0,1|1,0,0]=3 6224 B16R2.255 Cc1cccc(n1)CNCc2c[nH]cn2 34a_100000701342_100000707719 [0,1,0,0,0,1|1,0,0]=3 6225 B16R2.255 Cc1cccc(n1)CNCc2c[nH]nn2 207a_100020620823_100011215050 [0,1,0,0,0,1|2,0,0]=4 6226 B16R2.255 Cc1cccc(n1)CNCc2c[nH]nn2 270004a_100020620823_100011215050 [0,1,0,0,0,1|2,0,0]=4 6227 B16R2.255 Cc1cccc(n1)CNCc2cocn2 207a_100015188801_100011215050 [0,1,0,0,0,1|2,0,0]=4 6228 B16R2.255 Cc1cccc(n1)CNCc2cocn2 270004a_100015188801_100011215050 [0,1,0,0,0,1|2,0,0]=4 6229 B16R2.255 Cc1cccc(n1)CNCc2cscn2 207a_100015185402_100011215050 [0,1,0,0,0,1|2,0,0]=4 6230 B16R2.255 Cc1cccc(n1)CNCc2cscn2 2230a_100015185402_100000757606 [0,1,0,0,0,1|2,0,0]=4 6231 B16R2.255 Cc1cccc(n1)CNCc2cscn2 34a_100000701342_100000205941 [0,1,0,0,0,1|2,0,0]=4 6232 B16R2.255 Cc1cccc(n1)COCc2c[nH]cn2 34a_100000690600_100000707719 [0,1,0,0,0,1|2,0,0]=4 6233 B16R2.255 Cc1cccc(n1)CSCc2c[nH]cn2 62a_100000707719_100000757606 [0,1,0,0,0,1|2,0,0]=4 6234 B16R2.255 Cc1cccc(n1)CSCc2c[nH]cn2 62a_100000757606_100000707719 [0,1,0,0,0,1|2,0,0]=4 6235 B16R2.255 Cc1cccc(n1)SCCc2c[nH]cn2 62a_100000742759_100020628418 [0,1,0,0,0,1|2,0,0]=4 6236 B16R2.255 Cc1cccc(n1)SCCc2c[nH]cn2 62a_100020628418_100000742759 [0,1,0,0,0,1|2,0,0]=4 6237 B16R2.255 Cc1ccnc(c1)CNCc2c[nH]cn2 207a_100000758547_100011361488 [0,1,0,0,0,1|1,0,0]=3 6238 B16R2.255 Cc1ccnc(c1)CNCc2c[nH]nn2 207a_100020620823_100011361488 [0,1,0,0,0,1|2,0,0]=4 6239 B16R2.255 Cc1ccnc(c1)CNCc2c[nH]nn2 270004a_100020620823_100011361488 [0,1,0,0,0,1|2,0,0]=4 6240 B16R2.255 Cc1ccnc(c1)CNCc2cocn2 207a_100015188801_100011361488 [0,1,0,0,0,1|2,0,0]=4 6241 B16R2.255 Cc1ccnc(c1)CNCc2cocn2 270004a_100015188801_100011361488 [0,1,0,0,0,1|2,0,0]=4 6242 B16R2.255 Cc1ccnc(c1)CNCc2cscn2 207a_100015185402_100011361488 [0,1,0,0,0,1|2,0,0]=4 6243 B16R2.255 Cc1ccnc(c1)CNCc2cscn2 2230a_100015185402_100000718516 [0,1,0,0,0,1|2,0,0]=4 6244 B16R2.255 Cc1ccnc(c1)COCc2c[nH]cn2 34a_100011998357_100000707719 [0,1,0,0,0,1|2,0,0]=4 6245 B16R2.255 Cc1ccnc(c1)CSCc2c[nH]cn2 62a_100000707719_100000718516 [0,1,0,0,0,1|2,0,0]=4 6246 B16R2.255 Cc1ccnc(c1)CSCc2c[nH]cn2 62a_100000718516_100000707719 [0,1,0,0,0,1|2,0,0]=4 6247 B16R2.255 Cc1ccnc(c1)SCCc2c[nH]cn2 62a_100000750283_100020628418 [0,1,0,0,0,1|2,0,0]=4 6248 B16R2.255 Cc1ccnc(c1)SCCc2c[nH]cn2 62a_100020628418_100000750283 [0,1,0,0,0,1|2,0,0]=4 6249 B16R2.255 Cc1ccnc(n1)CNCc2c[nH]cn2 2230a_100015186494_100000707719 [0,1,0,0,0,1|2,0,0]=4 6250 B16R2.255 Cc1ccnc(n1)NCCc2c[nH]cn2 27a_100000755092_100000750684 [0,1,0,0,0,1|2,0,0]=4 6251 B16R2.255 Cc1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100011998712 [0,1,0,0,0,1|1,0,0]=3 6252 B16R2.255 Cc1cncc(c1)CNCc2c[nH]cn2 2230a_100000692839_100000707719 [0,1,0,0,0,1|1,0,0]=3 6253 B16R2.255 Cc1cncc(c1)CNCc2c[nH]cn2 34a_100000692839_100000707719 [0,1,0,0,0,1|1,0,0]=3 6254 B16R2.255 Cc1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100011998712 [0,1,0,0,0,1|2,0,0]=4 6255 B16R2.255 Cc1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100011998712 [0,1,0,0,0,1|2,0,0]=4 6256 B16R2.255 Cc1cncc(c1)CNCc2cocn2 207a_100015188801_100011998712 [0,1,0,0,0,1|2,0,0]=4 6257 B16R2.255 Cc1cncc(c1)CNCc2cocn2 270004a_100000692839_100000050382 [0,1,0,0,0,1|2,0,0]=4 6258 B16R2.255 Cc1cncc(c1)CNCc2cocn2 270004a_100015188801_100011998712 [0,1,0,0,0,1|2,0,0]=4 6259 B16R2.255 Cc1cncc(c1)CNCc2cscn2 207a_100000692839_100000743575 [0,1,0,0,0,1|2,0,0]=4 6260 B16R2.255 Cc1cncc(c1)CNCc2cscn2 207a_100015185402_100011998712 [0,1,0,0,0,1|2,0,0]=4 6261 B16R2.255 Cc1cncc(c1)CNCc2cscn2 2230a_100000692839_100000205941 [0,1,0,0,0,1|2,0,0]=4 6262 B16R2.255 Cc1cncc(c1)CNCc2cscn2 2230a_100015185402_100000716715 [0,1,0,0,0,1|2,0,0]=4 6263 B16R2.255 Cc1cncc(c1)CNCc2cscn2 270004a_100000692839_100000743575 [0,1,0,0,0,1|2,0,0]=4 6264 B16R2.255 Cc1cncc(c1)CNCc2cscn2 34a_100000692839_100000205941 [0,1,0,0,0,1|2,0,0]=4 6265 B16R2.255 Cc1cncc(c1)COCc2c[nH]cn2 34a_100011998709_100000707719 [0,1,0,0,0,1|2,0,0]=4 6266 B16R2.255 Cc1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100000716715 [0,1,0,0,0,1|2,0,0]=4 6267 B16R2.255 Cc1cncc(c1)CSCc2c[nH]cn2 62a_100000716715_100000707719 [0,1,0,0,0,1|2,0,0]=4 6268 B16R2.255 Cc1cncc(c1)OCCc2c[nH]cn2 7a_100011830280_100020628418 [0,1,0,0,0,1|2,0,0]=4 6269 B16R2.255 Cc1cncc(c1)SCCc2c[nH]cn2 62a_100000760492_100020628418 [0,1,0,0,0,1|2,0,0]=4 6270 B16R2.255 Cc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000760492 [0,1,0,0,0,1|2,0,0]=4 6271 B16R2.255 Cc1cncc(n1)CNCc2c[nH]cn2 207a_100000758547_100000100294 [0,1,0,0,0,1|2,0,0]=4 6272 B16R2.255 Cc1cncc(n1)NCCc2c[nH]cn2 27a_100000755092_100000754123 [0,1,0,0,0,1|2,0,0]=4 6273 B16R2.255 Cc1cnnc(c1)NCCc2c[nH]cn2 27a_100000755092_100000070100 [0,1,0,0,0,1|2,0,0]=4 6274 B16R2.255 Cc1nccc(n1)NCCc2c[nH]cn2 27a_100000755092_100000749937 [0,1,0,0,0,1|2,0,0]=4 6275 B16R2.255 Clc1cc(ccn1)CNCc2c[nH]cn2 2230a_100015205668_100000707719 [0,1,0,0,0,1|1,0,0]=3 6276 B16R2.255 Clc1cc(ccn1)CNCc2c[nH]cn2 34a_100015205668_100000707719 [0,1,0,0,0,1|1,0,0]=3 6277 B16R2.255 Clc1cc(ccn1)CNCc2c[nH]nn2 270004a_100020620823_100011290808 [0,1,0,0,0,1|2,0,0]=4 6278 B16R2.255 Clc1cc(ccn1)CNCc2cocn2 270004a_100015188801_100011290808 [0,1,0,0,0,1|2,0,0]=4 6279 B16R2.255 Clc1cc(ccn1)CNCc2cocn2 270004a_100015205668_100000050382 [0,1,0,0,0,1|2,0,0]=4 6280 B16R2.255 Clc1cc(ccn1)CNCc2cscn2 2230a_100015185402_100000764220 [0,1,0,0,0,1|2,0,0]=4 6281 B16R2.255 Clc1cc(ccn1)CNCc2cscn2 2230a_100015205668_100000205941 [0,1,0,0,0,1|2,0,0]=4 6282 B16R2.255 Clc1cc(ccn1)CNCc2cscn2 270004a_100015205668_100000743575 [0,1,0,0,0,1|2,0,0]=4 6283 B16R2.255 Clc1cc(ccn1)CNCc2cscn2 34a_100015205668_100000205941 [0,1,0,0,0,1|2,0,0]=4 6284 B16R2.255 Clc1cc(ccn1)COCc2c[nH]cn2 34a_100000748751_100000707719 [0,1,0,0,0,1|2,0,0]=4 6285 B16R2.255 Clc1cc(ccn1)CSCc2c[nH]cn2 62a_100000707719_100000764220 [0,1,0,0,0,1|2,0,0]=4 6286 B16R2.255 Clc1cc(ccn1)CSCc2c[nH]cn2 62a_100000764220_100000707719 [0,1,0,0,0,1|2,0,0]=4 6287 B16R2.255 Clc1cc(ccn1)SCCc2c[nH]cn2 62a_100000035001_100020628418 [0,1,0,0,0,1|2,0,0]=4 6288 B16R2.255 Clc1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100000035001 [0,1,0,0,0,1|2,0,0]=4 6289 B16R2.255 Clc1cccc(c1)CCSc2c[nH]cn2 62a_100000756875_100011713710 [0,1,0,0,0,1|1,0,0]=3 6290 B16R2.255 Clc1cccc(c1)CCSc2c[nH]cn2 62a_100011713710_100000756875 [0,1,0,0,0,1|1,0,0]=3 6291 B16R2.255 Clc1cccc(c1)CCSc2c[nH]nn2 62a_100009819707_100011713710 [0,1,0,0,0,1|2,0,0]=4 6292 B16R2.255 Clc1cccc(c1)CCSc2c[nH]nn2 62a_100011713710_100009819707 [0,1,0,0,0,1|2,0,0]=4 6293 B16R2.255 Clc1cccc(c1)CCSc2cscn2 62a_100000751502_100011713710 [0,1,0,0,0,1|2,0,0]=4 6294 B16R2.255 Clc1cccc(c1)CCSc2cscn2 62a_100011713710_100000751502 [0,1,0,0,0,1|2,0,0]=4 6295 B16R2.255 Clc1cccc(c1)CCSc2nc[nH]n2 62a_100000761765_100011713710 [0,1,0,0,0,1|2,0,0]=4 6296 B16R2.255 Clc1cccc(c1)CCSc2nc[nH]n2 62a_100011713710_100000761765 [0,1,0,0,0,1|2,0,0]=4 6297 B16R2.255 Clc1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000210801 [0,1,0,0,0,1|0,0,0]=2 6298 B16R2.255 Clc1cccc(c1)CNCc2c[nH]cn2 2230a_100000174878_100000707719 [0,1,0,0,0,1|0,0,0]=2 6299 B16R2.255 Clc1cccc(c1)CNCc2c[nH]cn2 34a_100000174878_100000707719 [0,1,0,0,0,1|0,0,0]=2 6300 B16R2.255 Clc1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000210801 [0,1,0,0,0,1|1,0,0]=3 6301 B16R2.255 Clc1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000210801 [0,1,0,0,0,1|1,0,0]=3 6302 B16R2.255 Clc1cccc(c1)CNCc2cc[nH]n2 207a_100000174878_100000738523 [0,1,0,0,0,1|2,0,0]=4 6303 B16R2.255 Clc1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000210801 [0,1,0,0,0,1|2,0,0]=4 6304 B16R2.255 Clc1cccc(c1)CNCc2cc[nH]n2 270004a_100000174878_100000738523 [0,1,0,0,0,1|2,0,0]=4 6305 B16R2.255 Clc1cccc(c1)CNCc2ccco2 207a_100000174878_100000186105 [0,1,0,0,0,1|2,0,0]=4 6306 B16R2.255 Clc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210801 [0,1,0,0,0,1|2,0,0]=4 6307 B16R2.255 Clc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000181238 [0,1,0,0,0,1|2,0,0]=4 6308 B16R2.255 Clc1cccc(c1)CNCc2ccco2 270004a_100000174878_100000186105 [0,1,0,0,0,1|2,0,0]=4 6309 B16R2.255 Clc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210801 [0,1,0,0,0,1|2,0,0]=4 6310 B16R2.255 Clc1cccc(c1)CNCc2ccco2 34a_100000185738_100000187163 [0,1,0,0,0,1|2,0,0]=4 6311 B16R2.255 Clc1cccc(c1)CNCc2cccs2 207a_100000174878_100000209959 [0,1,0,0,0,1|2,0,0]=4 6312 B16R2.255 Clc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210801 [0,1,0,0,0,1|2,0,0]=4 6313 B16R2.255 Clc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000181238 [0,1,0,0,0,1|2,0,0]=4 6314 B16R2.255 Clc1cccc(c1)CNCc2cccs2 270004a_100000174878_100000209959 [0,1,0,0,0,1|2,0,0]=4 6315 B16R2.255 Clc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210801 [0,1,0,0,0,1|2,0,0]=4 6316 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 207a_100000174878_100011215517 [0,1,0,0,0,1|2,0,0]=4 6317 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210801 [0,1,0,0,0,1|2,0,0]=4 6318 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000181238 [0,1,0,0,0,1|2,0,0]=4 6319 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 270004a_100000174878_100011215517 [0,1,0,0,0,1|2,0,0]=4 6320 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210801 [0,1,0,0,0,1|2,0,0]=4 6321 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000187163 [0,1,0,0,0,1|2,0,0]=4 6322 B16R2.255 Clc1cccc(c1)CNCc2ccon2 207a_100000688301_100000210801 [0,1,0,0,0,1|2,0,0]=4 6323 B16R2.255 Clc1cccc(c1)CNCc2ccon2 2230a_100000174878_100000234950 [0,1,0,0,0,1|2,0,0]=4 6324 B16R2.255 Clc1cccc(c1)CNCc2ccon2 270004a_100000688301_100000210801 [0,1,0,0,0,1|2,0,0]=4 6325 B16R2.255 Clc1cccc(c1)CNCc2ccon2 34a_100000174878_100000234950 [0,1,0,0,0,1|2,0,0]=4 6326 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 207a_100000174878_100000188534 [0,1,0,0,0,1|2,0,0]=4 6327 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210801 [0,1,0,0,0,1|2,0,0]=4 6328 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 2230a_100000174878_100011261437 [0,1,0,0,0,1|2,0,0]=4 6329 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000181238 [0,1,0,0,0,1|2,0,0]=4 6330 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 270004a_100000174878_100000188534 [0,1,0,0,0,1|2,0,0]=4 6331 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210801 [0,1,0,0,0,1|2,0,0]=4 6332 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 34a_100000174878_100011261437 [0,1,0,0,0,1|2,0,0]=4 6333 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000187163 [0,1,0,0,0,1|2,0,0]=4 6334 B16R2.255 Clc1cccc(c1)CNCc2cn[nH]c2 207a_100000174878_100016992096 [0,1,0,0,0,1|2,0,0]=4 6335 B16R2.255 Clc1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000210801 [0,1,0,0,0,1|2,0,0]=4 6336 B16R2.255 Clc1cccc(c1)CNCc2cn[nH]c2 270004a_100000174878_100016992096 [0,1,0,0,0,1|2,0,0]=4 6337 B16R2.255 Clc1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000210801 [0,1,0,0,0,1|2,0,0]=4 6338 B16R2.255 Clc1cccc(c1)CNCc2cnc[nH]2 207a_100000174878_100000742939 [0,1,0,0,0,1|0,0,2]=4 6339 B16R2.255 Clc1cccc(c1)CNCc2cnco2 207a_100020634212_100000210801 [0,1,0,0,0,1|1,0,1]=4 6340 B16R2.255 Clc1cccc(c1)CNCc2cnco2 270004a_100000174878_100000064291 [0,1,0,0,0,1|1,0,1]=4 6341 B16R2.255 Clc1cccc(c1)CNCc2cnco2 270004a_100020634212_100000210801 [0,1,0,0,0,1|1,0,1]=4 6342 B16R2.255 Clc1cccc(c1)CNCc2cncs2 207a_100000174878_100000749870 [0,1,0,0,0,1|1,0,1]=4 6343 B16R2.255 Clc1cccc(c1)CNCc2cncs2 207a_100016987365_100000210801 [0,1,0,0,0,1|1,0,1]=4 6344 B16R2.255 Clc1cccc(c1)CNCc2cncs2 2230a_100000174878_100015185245 [0,1,0,0,0,1|1,0,1]=4 6345 B16R2.255 Clc1cccc(c1)CNCc2cncs2 2230a_100016987365_100000181238 [0,1,0,0,0,1|1,0,1]=4 6346 B16R2.255 Clc1cccc(c1)CNCc2cncs2 270004a_100000174878_100000749870 [0,1,0,0,0,1|1,0,1]=4 6347 B16R2.255 Clc1cccc(c1)CNCc2cncs2 270004a_100016987365_100000210801 [0,1,0,0,0,1|1,0,1]=4 6348 B16R2.255 Clc1cccc(c1)CNCc2cncs2 34a_100000174878_100015185245 [0,1,0,0,0,1|1,0,1]=4 6349 B16R2.255 Clc1cccc(c1)CNCc2cocn2 207a_100015188801_100000210801 [0,1,0,0,0,1|1,0,0]=3 6350 B16R2.255 Clc1cccc(c1)CNCc2cocn2 270004a_100000174878_100000050382 [0,1,0,0,0,1|1,0,0]=3 6351 B16R2.255 Clc1cccc(c1)CNCc2cocn2 270004a_100015188801_100000210801 [0,1,0,0,0,1|1,0,0]=3 6352 B16R2.255 Clc1cccc(c1)CNCc2cscn2 207a_100000174878_100000743575 [0,1,0,0,0,1|1,0,0]=3 6353 B16R2.255 Clc1cccc(c1)CNCc2cscn2 207a_100015185402_100000210801 [0,1,0,0,0,1|1,0,0]=3 6354 B16R2.255 Clc1cccc(c1)CNCc2cscn2 2230a_100000174878_100000205941 [0,1,0,0,0,1|1,0,0]=3 6355 B16R2.255 Clc1cccc(c1)CNCc2cscn2 2230a_100015185402_100000181238 [0,1,0,0,0,1|1,0,0]=3 6356 B16R2.255 Clc1cccc(c1)CNCc2cscn2 270004a_100000174878_100000743575 [0,1,0,0,0,1|1,0,0]=3 6357 B16R2.255 Clc1cccc(c1)CNCc2cscn2 34a_100000174878_100000205941 [0,1,0,0,0,1|1,0,0]=3 6358 B16R2.255 Clc1cccc(c1)CNCc2csnn2 270004a_100000174878_100000738508 [0,1,0,0,0,1|2,0,0]=4 6359 B16R2.255 Clc1cccc(c1)CNCc2ncc[nH]2 207a_100000174878_100000743867 [0,1,0,0,0,1|2,0,0]=4 6360 B16R2.255 Clc1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000210801 [0,1,0,0,0,1|2,0,0]=4 6361 B16R2.255 Clc1cccc(c1)CNCc2ncc[nH]2 2230a_100000174878_100016991755 [0,1,0,0,0,1|2,0,0]=4 6362 B16R2.255 Clc1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000210801 [0,1,0,0,0,1|2,0,0]=4 6363 B16R2.255 Clc1cccc(c1)CNCc2ncc[nH]2 34a_100000174878_100016991755 [0,1,0,0,0,1|2,0,0]=4 6364 B16R2.255 Clc1cccc(c1)CNCc2ncco2 207a_100016994969_100000210801 [0,1,0,0,0,1|2,0,0]=4 6365 B16R2.255 Clc1cccc(c1)CNCc2ncco2 2230a_100000174878_103436540062 [0,1,0,0,0,1|2,0,0]=4 6366 B16R2.255 Clc1cccc(c1)CNCc2ncco2 2230a_100016994969_100000181238 [0,1,0,0,0,1|2,0,0]=4 6367 B16R2.255 Clc1cccc(c1)CNCc2ncco2 270004a_100000174878_100000064290 [0,1,0,0,0,1|2,0,0]=4 6368 B16R2.255 Clc1cccc(c1)CNCc2ncco2 34a_100000174878_103436540062 [0,1,0,0,0,1|2,0,0]=4 6369 B16R2.255 Clc1cccc(c1)CNCc2nccs2 207a_100000174878_100000750902 [0,1,0,0,0,1|2,0,0]=4 6370 B16R2.255 Clc1cccc(c1)CNCc2nccs2 207a_100000740555_100000210801 [0,1,0,0,0,1|2,0,0]=4 6371 B16R2.255 Clc1cccc(c1)CNCc2nccs2 2230a_100000174878_100015184050 [0,1,0,0,0,1|2,0,0]=4 6372 B16R2.255 Clc1cccc(c1)CNCc2nccs2 2230a_100000740555_100000181238 [0,1,0,0,0,1|2,0,0]=4 6373 B16R2.255 Clc1cccc(c1)CNCc2nccs2 270004a_100000174878_100000750902 [0,1,0,0,0,1|2,0,0]=4 6374 B16R2.255 Clc1cccc(c1)CNCc2nccs2 270004a_100000740555_100000210801 [0,1,0,0,0,1|2,0,0]=4 6375 B16R2.255 Clc1cccc(c1)CNCc2nccs2 34a_100000174878_100015184050 [0,1,0,0,0,1|2,0,0]=4 6376 B16R2.255 Clc1cccc(c1)CNCc2ncon2 34a_100000174878_100000233494 [0,1,0,0,0,1|2,0,0]=4 6377 B16R2.255 Clc1cccc(c1)CNCn2cncn2 2230a_100000174878_200020645497 [0,1,0,0,0,1|1,0,1]=4 6378 B16R2.255 Clc1cccc(c1)CNCn2cncn2 34a_100000174878_200020645497 [0,1,0,0,0,1|1,0,1]=4 6379 B16R2.255 Clc1cccc(c1)COCc2c[nH]cn2 34a_100000241301_100000707719 [0,1,0,0,0,1|1,0,0]=3 6380 B16R2.255 Clc1cccc(c1)COCc2cscn2 34a_100000241301_100000205941 [0,1,0,0,0,1|2,0,0]=4 6381 B16R2.255 Clc1cccc(c1)COCc2cscn2 7a_100000241301_100000205941 [0,1,0,0,0,1|2,0,0]=4 6382 B16R2.255 Clc1cccc(c1)CSCc2c[nH]cn2 62a_100000187163_100000707719 [0,1,0,0,0,1|1,0,0]=3 6383 B16R2.255 Clc1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100000187163 [0,1,0,0,0,1|1,0,0]=3 6384 B16R2.255 Clc1cccc(c1)CSCc2cscn2 62a_100000187163_100000205941 [0,1,0,0,0,1|2,0,0]=4 6385 B16R2.255 Clc1cccc(c1)CSCc2cscn2 62a_100000205941_100000187163 [0,1,0,0,0,1|2,0,0]=4 6386 B16R2.255 Clc1cccc(c1)NCCc2cccs2 34a_100000185859_100000748579 [0,1,0,0,0,1|2,0,0]=4 6387 B16R2.255 Clc1cccc(c1)NCCn2cccn2 34a_100000185859_100015204718 [0,1,0,0,0,1|2,0,0]=4 6388 B16R2.255 Clc1cccc(c1)NCCn2cncn2 34a_100000185859_200000749826 [0,1,0,0,0,1|1,0,1]=4 6389 B16R2.255 Clc1cccc(c1)NN=Cc2cc[nH]c2 4a_100000184277_100000760201 [0,1,0,0,0,1|1,0,1]=4 6390 B16R2.255 Clc1cccc(c1)NN=Cc2cocn2 4a_100000184277_100000050382 [0,1,0,0,0,1|1,0,1]=4 6391 B16R2.255 Clc1cccc(c1)NN=Cc2cscn2 4a_100000184277_100000743575 [0,1,0,0,0,1|1,0,1]=4 6392 B16R2.255 Clc1cccc(c1)OCCc2c[nH]cn2 7a_100000210295_100020628418 [0,1,0,0,0,1|1,0,0]=3 6393 B16R2.255 Clc1cccc(c1)SCCc2c[nH]cn2 62a_100000699651_100020628418 [0,1,0,0,0,1|1,0,0]=3 6394 B16R2.255 Clc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100000699651 [0,1,0,0,0,1|1,0,0]=3 6395 B16R2.255 Clc1cccc(n1)CNCc2c[nH]cn2 2230a_100016990191_100000707719 [0,1,0,0,0,1|1,0,0]=3 6396 B16R2.255 Clc1cccc(n1)CNCc2c[nH]nn2 270004a_100020620823_100011361687 [0,1,0,0,0,1|2,0,0]=4 6397 B16R2.255 Clc1cccc(n1)CNCc2cocn2 270004a_100015188801_100011361687 [0,1,0,0,0,1|2,0,0]=4 6398 B16R2.255 Clc1cccc(n1)CNCc2cscn2 2230a_100015185402_100000086093 [0,1,0,0,0,1|2,0,0]=4 6399 B16R2.255 Clc1cccc(n1)CNCc2cscn2 2230a_100016990191_100000205941 [0,1,0,0,0,1|2,0,0]=4 6400 B16R2.255 Clc1cccc(n1)COCc2c[nH]cn2 34a_100011998359_100000707719 [0,1,0,0,0,1|2,0,0]=4 6401 B16R2.255 Clc1cccc(n1)CSCc2c[nH]cn2 62a_100000086093_100000707719 [0,1,0,0,0,1|2,0,0]=4 6402 B16R2.255 Clc1cccc(n1)CSCc2c[nH]cn2 62a_100000707719_100000086093 [0,1,0,0,0,1|2,0,0]=4 6403 B16R2.255 Clc1cccc(n1)SCCc2c[nH]cn2 62a_100000051397_100020628418 [0,1,0,0,0,1|2,0,0]=4 6404 B16R2.255 Clc1cccc(n1)SCCc2c[nH]cn2 62a_100020628418_100000051397 [0,1,0,0,0,1|2,0,0]=4 6405 B16R2.255 Clc1ccnc(c1)CNCc2c[nH]nn2 270004a_100020620823_100011998288 [0,1,0,0,0,1|2,0,0]=4 6406 B16R2.255 Clc1ccnc(c1)CNCc2cocn2 270004a_100015188801_100011998288 [0,1,0,0,0,1|2,0,0]=4 6407 B16R2.255 Clc1ccnc(c1)CNCc2cscn2 2230a_100015185402_100016988179 [0,1,0,0,0,1|2,0,0]=4 6408 B16R2.255 Clc1ccnc(c1)COCc2c[nH]cn2 34a_100000748867_100000707719 [0,1,0,0,0,1|2,0,0]=4 6409 B16R2.255 Clc1ccnc(c1)CSCc2c[nH]cn2 62a_100000707719_100016988179 [0,1,0,0,0,1|2,0,0]=4 6410 B16R2.255 Clc1ccnc(c1)CSCc2c[nH]cn2 62a_100016988179_100000707719 [0,1,0,0,0,1|2,0,0]=4 6411 B16R2.255 Clc1ccnc(c1)SCCc2c[nH]cn2 62a_100010167805_100020628418 [0,1,0,0,0,1|2,0,0]=4 6412 B16R2.255 Clc1ccnc(c1)SCCc2c[nH]cn2 62a_100020628418_100010167805 [0,1,0,0,0,1|2,0,0]=4 6413 B16R2.255 Clc1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100000088910 [0,1,0,0,0,1|1,0,0]=3 6414 B16R2.255 Clc1cncc(c1)CNCc2c[nH]cn2 2230a_200020614424_100000707719 [0,1,0,0,0,1|1,0,0]=3 6415 B16R2.255 Clc1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100000088910 [0,1,0,0,0,1|2,0,0]=4 6416 B16R2.255 Clc1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000088910 [0,1,0,0,0,1|2,0,0]=4 6417 B16R2.255 Clc1cncc(c1)CNCc2cocn2 207a_100015188801_100000088910 [0,1,0,0,0,1|2,0,0]=4 6418 B16R2.255 Clc1cncc(c1)CNCc2cocn2 270004a_100015188801_100000088910 [0,1,0,0,0,1|2,0,0]=4 6419 B16R2.255 Clc1cncc(c1)CNCc2cocn2 270004a_200020614424_100000050382 [0,1,0,0,0,1|2,0,0]=4 6420 B16R2.255 Clc1cncc(c1)CNCc2cscn2 207a_100015185402_100000088910 [0,1,0,0,0,1|2,0,0]=4 6421 B16R2.255 Clc1cncc(c1)CNCc2cscn2 207a_200020614424_100000743575 [0,1,0,0,0,1|2,0,0]=4 6422 B16R2.255 Clc1cncc(c1)CNCc2cscn2 2230a_100015185402_100016992070 [0,1,0,0,0,1|2,0,0]=4 6423 B16R2.255 Clc1cncc(c1)CNCc2cscn2 2230a_200020614424_100000205941 [0,1,0,0,0,1|2,0,0]=4 6424 B16R2.255 Clc1cncc(c1)CNCc2cscn2 270004a_200020614424_100000743575 [0,1,0,0,0,1|2,0,0]=4 6425 B16R2.255 Clc1cncc(c1)COCc2c[nH]cn2 34a_100000092867_100000707719 [0,1,0,0,0,1|2,0,0]=4 6426 B16R2.255 Clc1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100016992070 [0,1,0,0,0,1|2,0,0]=4 6427 B16R2.255 Clc1cncc(c1)CSCc2c[nH]cn2 62a_100016992070_100000707719 [0,1,0,0,0,1|2,0,0]=4 6428 B16R2.255 Clc1cncc(c1)OCCc2c[nH]cn2 7a_100000032511_100020628418 [0,1,0,0,0,1|2,0,0]=4 6429 B16R2.255 Clc1cncc(c1)SCCc2c[nH]cn2 62a_100000049639_100020628418 [0,1,0,0,0,1|2,0,0]=4 6430 B16R2.255 Clc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000049639 [0,1,0,0,0,1|2,0,0]=4 6431 B16R2.255 Clc1cncc(n1)NCCc2c[nH]cn2 27a_100000755092_100010892449 [0,1,0,0,0,1|2,0,0]=4 6432 B16R2.255 Fc1cc(ccn1)CNCc2c[nH]cn2 2230a_100015188774_100000707719 [0,1,0,0,0,1|1,0,0]=3 6433 B16R2.255 Fc1cc(ccn1)CNCc2c[nH]cn2 34a_100015188774_100000707719 [0,1,0,0,0,1|1,0,0]=3 6434 B16R2.255 Fc1cc(ccn1)CNCc2c[nH]nn2 270004a_100020620823_100000068331 [0,1,0,0,0,1|2,0,0]=4 6435 B16R2.255 Fc1cc(ccn1)CNCc2cocn2 270004a_100015188774_100000050382 [0,1,0,0,0,1|2,0,0]=4 6436 B16R2.255 Fc1cc(ccn1)CNCc2cocn2 270004a_100015188801_100000068331 [0,1,0,0,0,1|2,0,0]=4 6437 B16R2.255 Fc1cc(ccn1)CNCc2cscn2 2230a_100015188774_100000205941 [0,1,0,0,0,1|2,0,0]=4 6438 B16R2.255 Fc1cc(ccn1)CNCc2cscn2 270004a_100015188774_100000743575 [0,1,0,0,0,1|2,0,0]=4 6439 B16R2.255 Fc1cc(ccn1)CNCc2cscn2 34a_100015188774_100000205941 [0,1,0,0,0,1|2,0,0]=4 6440 B16R2.255 Fc1cc(ccn1)COCc2c[nH]cn2 34a_100000082451_100000707719 [0,1,0,0,0,1|2,0,0]=4 6441 B16R2.255 Fc1cc(ccn1)NCCc2c[nH]cn2 27a_100000755092_100009816116 [0,1,0,0,0,1|1,0,0]=3 6442 B16R2.255 Fc1cc(ccn1)SCCc2c[nH]cn2 62a_100009816116_100020628418 [0,1,0,0,0,1|2,0,0]=4 6443 B16R2.255 Fc1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100009816116 [0,1,0,0,0,1|2,0,0]=4 6444 B16R2.255 Fc1cc(ncn1)NCCc2c[nH]cn2 27a_100000755092_200009880791 [0,1,0,0,0,1|2,0,0]=4 6445 B16R2.255 Fc1cccc(c1)CCSc2c[nH]cn2 62a_100000756875_100011217235 [0,1,0,0,0,1|1,0,0]=3 6446 B16R2.255 Fc1cccc(c1)CCSc2c[nH]cn2 62a_100011217235_100000756875 [0,1,0,0,0,1|1,0,0]=3 6447 B16R2.255 Fc1cccc(c1)CCSc2c[nH]nn2 62a_100009819707_100011217235 [0,1,0,0,0,1|2,0,0]=4 6448 B16R2.255 Fc1cccc(c1)CCSc2c[nH]nn2 62a_100011217235_100009819707 [0,1,0,0,0,1|2,0,0]=4 6449 B16R2.255 Fc1cccc(c1)CCSc2cscn2 62a_100000751502_100011217235 [0,1,0,0,0,1|2,0,0]=4 6450 B16R2.255 Fc1cccc(c1)CCSc2cscn2 62a_100011217235_100000751502 [0,1,0,0,0,1|2,0,0]=4 6451 B16R2.255 Fc1cccc(c1)CCSc2nc[nH]n2 62a_100000761765_100011217235 [0,1,0,0,0,1|2,0,0]=4 6452 B16R2.255 Fc1cccc(c1)CCSc2nc[nH]n2 62a_100011217235_100000761765 [0,1,0,0,0,1|2,0,0]=4 6453 B16R2.255 Fc1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000210812 [0,1,0,0,0,1|0,0,0]=2 6454 B16R2.255 Fc1cccc(c1)CNCc2c[nH]cn2 2230a_100000174948_100000707719 [0,1,0,0,0,1|0,0,0]=2 6455 B16R2.255 Fc1cccc(c1)CNCc2c[nH]cn2 34a_100000174948_100000707719 [0,1,0,0,0,1|0,0,0]=2 6456 B16R2.255 Fc1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000210812 [0,1,0,0,0,1|1,0,0]=3 6457 B16R2.255 Fc1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000210812 [0,1,0,0,0,1|1,0,0]=3 6458 B16R2.255 Fc1cccc(c1)CNCc2cc[nH]n2 207a_100000174948_100000738523 [0,1,0,0,0,1|2,0,0]=4 6459 B16R2.255 Fc1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000210812 [0,1,0,0,0,1|2,0,0]=4 6460 B16R2.255 Fc1cccc(c1)CNCc2cc[nH]n2 270004a_100000174948_100000738523 [0,1,0,0,0,1|2,0,0]=4 6461 B16R2.255 Fc1cccc(c1)CNCc2ccco2 207a_100000174948_100000186105 [0,1,0,0,0,1|2,0,0]=4 6462 B16R2.255 Fc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210812 [0,1,0,0,0,1|2,0,0]=4 6463 B16R2.255 Fc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000230114 [0,1,0,0,0,1|2,0,0]=4 6464 B16R2.255 Fc1cccc(c1)CNCc2ccco2 270004a_100000174948_100000186105 [0,1,0,0,0,1|2,0,0]=4 6465 B16R2.255 Fc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210812 [0,1,0,0,0,1|2,0,0]=4 6466 B16R2.255 Fc1cccc(c1)CNCc2ccco2 34a_100000185738_100000187166 [0,1,0,0,0,1|2,0,0]=4 6467 B16R2.255 Fc1cccc(c1)CNCc2cccs2 207a_100000174948_100000209959 [0,1,0,0,0,1|2,0,0]=4 6468 B16R2.255 Fc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210812 [0,1,0,0,0,1|2,0,0]=4 6469 B16R2.255 Fc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000230114 [0,1,0,0,0,1|2,0,0]=4 6470 B16R2.255 Fc1cccc(c1)CNCc2cccs2 270004a_100000174948_100000209959 [0,1,0,0,0,1|2,0,0]=4 6471 B16R2.255 Fc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210812 [0,1,0,0,0,1|2,0,0]=4 6472 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 207a_100000174948_100011215517 [0,1,0,0,0,1|2,0,0]=4 6473 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210812 [0,1,0,0,0,1|2,0,0]=4 6474 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000230114 [0,1,0,0,0,1|2,0,0]=4 6475 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 270004a_100000174948_100011215517 [0,1,0,0,0,1|2,0,0]=4 6476 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210812 [0,1,0,0,0,1|2,0,0]=4 6477 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000187166 [0,1,0,0,0,1|2,0,0]=4 6478 B16R2.255 Fc1cccc(c1)CNCc2ccon2 207a_100000688301_100000210812 [0,1,0,0,0,1|2,0,0]=4 6479 B16R2.255 Fc1cccc(c1)CNCc2ccon2 2230a_100000174948_100000234950 [0,1,0,0,0,1|2,0,0]=4 6480 B16R2.255 Fc1cccc(c1)CNCc2ccon2 270004a_100000688301_100000210812 [0,1,0,0,0,1|2,0,0]=4 6481 B16R2.255 Fc1cccc(c1)CNCc2ccon2 34a_100000174948_100000234950 [0,1,0,0,0,1|2,0,0]=4 6482 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 207a_100000174948_100000188534 [0,1,0,0,0,1|2,0,0]=4 6483 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210812 [0,1,0,0,0,1|2,0,0]=4 6484 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 2230a_100000174948_100011261437 [0,1,0,0,0,1|2,0,0]=4 6485 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000230114 [0,1,0,0,0,1|2,0,0]=4 6486 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 270004a_100000174948_100000188534 [0,1,0,0,0,1|2,0,0]=4 6487 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210812 [0,1,0,0,0,1|2,0,0]=4 6488 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 34a_100000174948_100011261437 [0,1,0,0,0,1|2,0,0]=4 6489 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000187166 [0,1,0,0,0,1|2,0,0]=4 6490 B16R2.255 Fc1cccc(c1)CNCc2cn[nH]c2 207a_100000174948_100016992096 [0,1,0,0,0,1|2,0,0]=4 6491 B16R2.255 Fc1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000210812 [0,1,0,0,0,1|2,0,0]=4 6492 B16R2.255 Fc1cccc(c1)CNCc2cn[nH]c2 270004a_100000174948_100016992096 [0,1,0,0,0,1|2,0,0]=4 6493 B16R2.255 Fc1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000210812 [0,1,0,0,0,1|2,0,0]=4 6494 B16R2.255 Fc1cccc(c1)CNCc2cnc[nH]2 207a_100000174948_100000742939 [0,1,0,0,0,1|0,0,2]=4 6495 B16R2.255 Fc1cccc(c1)CNCc2cnco2 207a_100020634212_100000210812 [0,1,0,0,0,1|1,0,1]=4 6496 B16R2.255 Fc1cccc(c1)CNCc2cnco2 270004a_100000174948_100000064291 [0,1,0,0,0,1|1,0,1]=4 6497 B16R2.255 Fc1cccc(c1)CNCc2cnco2 270004a_100020634212_100000210812 [0,1,0,0,0,1|1,0,1]=4 6498 B16R2.255 Fc1cccc(c1)CNCc2cncs2 207a_100000174948_100000749870 [0,1,0,0,0,1|1,0,1]=4 6499 B16R2.255 Fc1cccc(c1)CNCc2cncs2 207a_100016987365_100000210812 [0,1,0,0,0,1|1,0,1]=4 6500 B16R2.255 Fc1cccc(c1)CNCc2cncs2 2230a_100000174948_100015185245 [0,1,0,0,0,1|1,0,1]=4 6501 B16R2.255 Fc1cccc(c1)CNCc2cncs2 2230a_100016987365_100000230114 [0,1,0,0,0,1|1,0,1]=4 6502 B16R2.255 Fc1cccc(c1)CNCc2cncs2 270004a_100000174948_100000749870 [0,1,0,0,0,1|1,0,1]=4 6503 B16R2.255 Fc1cccc(c1)CNCc2cncs2 270004a_100016987365_100000210812 [0,1,0,0,0,1|1,0,1]=4 6504 B16R2.255 Fc1cccc(c1)CNCc2cncs2 34a_100000174948_100015185245 [0,1,0,0,0,1|1,0,1]=4 6505 B16R2.255 Fc1cccc(c1)CNCc2cocn2 207a_100015188801_100000210812 [0,1,0,0,0,1|1,0,0]=3 6506 B16R2.255 Fc1cccc(c1)CNCc2cocn2 270004a_100000174948_100000050382 [0,1,0,0,0,1|1,0,0]=3 6507 B16R2.255 Fc1cccc(c1)CNCc2cocn2 270004a_100015188801_100000210812 [0,1,0,0,0,1|1,0,0]=3 6508 B16R2.255 Fc1cccc(c1)CNCc2cscn2 207a_100000174948_100000743575 [0,1,0,0,0,1|1,0,0]=3 6509 B16R2.255 Fc1cccc(c1)CNCc2cscn2 207a_100015185402_100000210812 [0,1,0,0,0,1|1,0,0]=3 6510 B16R2.255 Fc1cccc(c1)CNCc2cscn2 2230a_100000174948_100000205941 [0,1,0,0,0,1|1,0,0]=3 6511 B16R2.255 Fc1cccc(c1)CNCc2cscn2 2230a_100015185402_100000230114 [0,1,0,0,0,1|1,0,0]=3 6512 B16R2.255 Fc1cccc(c1)CNCc2cscn2 270004a_100000174948_100000743575 [0,1,0,0,0,1|1,0,0]=3 6513 B16R2.255 Fc1cccc(c1)CNCc2cscn2 34a_100000174948_100000205941 [0,1,0,0,0,1|1,0,0]=3 6514 B16R2.255 Fc1cccc(c1)CNCc2csnn2 270004a_100000174948_100000738508 [0,1,0,0,0,1|2,0,0]=4 6515 B16R2.255 Fc1cccc(c1)CNCc2ncc[nH]2 207a_100000174948_100000743867 [0,1,0,0,0,1|2,0,0]=4 6516 B16R2.255 Fc1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000210812 [0,1,0,0,0,1|2,0,0]=4 6517 B16R2.255 Fc1cccc(c1)CNCc2ncc[nH]2 2230a_100000174948_100016991755 [0,1,0,0,0,1|2,0,0]=4 6518 B16R2.255 Fc1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000210812 [0,1,0,0,0,1|2,0,0]=4 6519 B16R2.255 Fc1cccc(c1)CNCc2ncc[nH]2 34a_100000174948_100016991755 [0,1,0,0,0,1|2,0,0]=4 6520 B16R2.255 Fc1cccc(c1)CNCc2ncco2 207a_100016994969_100000210812 [0,1,0,0,0,1|2,0,0]=4 6521 B16R2.255 Fc1cccc(c1)CNCc2ncco2 2230a_100000174948_103436540062 [0,1,0,0,0,1|2,0,0]=4 6522 B16R2.255 Fc1cccc(c1)CNCc2ncco2 2230a_100016994969_100000230114 [0,1,0,0,0,1|2,0,0]=4 6523 B16R2.255 Fc1cccc(c1)CNCc2ncco2 270004a_100000174948_100000064290 [0,1,0,0,0,1|2,0,0]=4 6524 B16R2.255 Fc1cccc(c1)CNCc2ncco2 34a_100000174948_103436540062 [0,1,0,0,0,1|2,0,0]=4 6525 B16R2.255 Fc1cccc(c1)CNCc2nccs2 207a_100000174948_100000750902 [0,1,0,0,0,1|2,0,0]=4 6526 B16R2.255 Fc1cccc(c1)CNCc2nccs2 207a_100000740555_100000210812 [0,1,0,0,0,1|2,0,0]=4 6527 B16R2.255 Fc1cccc(c1)CNCc2nccs2 2230a_100000174948_100015184050 [0,1,0,0,0,1|2,0,0]=4 6528 B16R2.255 Fc1cccc(c1)CNCc2nccs2 2230a_100000740555_100000230114 [0,1,0,0,0,1|2,0,0]=4 6529 B16R2.255 Fc1cccc(c1)CNCc2nccs2 270004a_100000174948_100000750902 [0,1,0,0,0,1|2,0,0]=4 6530 B16R2.255 Fc1cccc(c1)CNCc2nccs2 270004a_100000740555_100000210812 [0,1,0,0,0,1|2,0,0]=4 6531 B16R2.255 Fc1cccc(c1)CNCc2nccs2 34a_100000174948_100015184050 [0,1,0,0,0,1|2,0,0]=4 6532 B16R2.255 Fc1cccc(c1)CNCc2ncon2 34a_100000174948_100000233494 [0,1,0,0,0,1|2,0,0]=4 6533 B16R2.255 Fc1cccc(c1)CNCn2cncn2 2230a_100000174948_200020645497 [0,1,0,0,0,1|1,0,1]=4 6534 B16R2.255 Fc1cccc(c1)CNCn2cncn2 34a_100000174948_200020645497 [0,1,0,0,0,1|1,0,1]=4 6535 B16R2.255 Fc1cccc(c1)COCc2c[nH]cn2 34a_100000210976_100000707719 [0,1,0,0,0,1|1,0,0]=3 6536 B16R2.255 Fc1cccc(c1)COCc2cscn2 34a_100000210976_100000205941 [0,1,0,0,0,1|2,0,0]=4 6537 B16R2.255 Fc1cccc(c1)COCc2cscn2 7a_100000210976_100000205941 [0,1,0,0,0,1|2,0,0]=4 6538 B16R2.255 Fc1cccc(c1)CSCc2c[nH]cn2 62a_100000230114_100000707719 [0,1,0,0,0,1|1,0,0]=3 6539 B16R2.255 Fc1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100000230114 [0,1,0,0,0,1|1,0,0]=3 6540 B16R2.255 Fc1cccc(c1)CSCc2cscn2 62a_100000205941_100000230114 [0,1,0,0,0,1|2,0,0]=4 6541 B16R2.255 Fc1cccc(c1)CSCc2cscn2 62a_100000230114_100000205941 [0,1,0,0,0,1|2,0,0]=4 6542 B16R2.255 Fc1cccc(c1)NCCc2cccs2 34a_100000210047_100000748579 [0,1,0,0,0,1|2,0,0]=4 6543 B16R2.255 Fc1cccc(c1)NCCn2cccn2 34a_100000210047_100015204718 [0,1,0,0,0,1|2,0,0]=4 6544 B16R2.255 Fc1cccc(c1)NCCn2cncn2 34a_100000210047_200000749826 [0,1,0,0,0,1|1,0,1]=4 6545 B16R2.255 Fc1cccc(c1)NN=Cc2cc[nH]c2 4a_100000745080_100000760201 [0,1,0,0,0,1|1,0,1]=4 6546 B16R2.255 Fc1cccc(c1)NN=Cc2cocn2 4a_100000745080_100000050382 [0,1,0,0,0,1|1,0,1]=4 6547 B16R2.255 Fc1cccc(c1)NN=Cc2cscn2 4a_100000745080_100000743575 [0,1,0,0,0,1|1,0,1]=4 6548 B16R2.255 Fc1cccc(c1)OCCc2c[nH]cn2 7a_100000210426_100020628418 [0,1,0,0,0,1|1,0,0]=3 6549 B16R2.255 Fc1cccc(c1)SCCc2c[nH]cn2 62a_100000685547_100020628418 [0,1,0,0,0,1|1,0,0]=3 6550 B16R2.255 Fc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100000685547 [0,1,0,0,0,1|1,0,0]=3 6551 B16R2.255 Fc1cccc(n1)CNCc2c[nH]cn2 2230a_100015188798_100000707719 [0,1,0,0,0,1|1,0,0]=3 6552 B16R2.255 Fc1cccc(n1)CNCc2c[nH]cn2 34a_100015188798_100000707719 [0,1,0,0,0,1|1,0,0]=3 6553 B16R2.255 Fc1cccc(n1)CNCc2c[nH]nn2 270004a_100020620823_100000050434 [0,1,0,0,0,1|2,0,0]=4 6554 B16R2.255 Fc1cccc(n1)CNCc2cocn2 270004a_100015188801_100000050434 [0,1,0,0,0,1|2,0,0]=4 6555 B16R2.255 Fc1cccc(n1)CNCc2cscn2 2230a_100015185402_100009819644 [0,1,0,0,0,1|2,0,0]=4 6556 B16R2.255 Fc1cccc(n1)CNCc2cscn2 2230a_100015188798_100000205941 [0,1,0,0,0,1|2,0,0]=4 6557 B16R2.255 Fc1cccc(n1)CNCc2cscn2 34a_100015188798_100000205941 [0,1,0,0,0,1|2,0,0]=4 6558 B16R2.255 Fc1cccc(n1)COCc2c[nH]cn2 34a_100000086748_100000707719 [0,1,0,0,0,1|2,0,0]=4 6559 B16R2.255 Fc1cccc(n1)CSCc2c[nH]cn2 62a_100000707719_100009819644 [0,1,0,0,0,1|2,0,0]=4 6560 B16R2.255 Fc1cccc(n1)CSCc2c[nH]cn2 62a_100009819644_100000707719 [0,1,0,0,0,1|2,0,0]=4 6561 B16R2.255 Fc1cccc(n1)NCCc2c[nH]cn2 27a_100000755092_100009815982 [0,1,0,0,0,1|1,0,0]=3 6562 B16R2.255 Fc1cccc(n1)SCCc2c[nH]cn2 62a_100009815982_100020628418 [0,1,0,0,0,1|2,0,0]=4 6563 B16R2.255 Fc1cccc(n1)SCCc2c[nH]cn2 62a_100020628418_100009815982 [0,1,0,0,0,1|2,0,0]=4 6564 B16R2.255 Fc1ccnc(c1)NCCc2c[nH]cn2 27a_100000755092_100000764206 [0,1,0,0,0,1|1,0,0]=3 6565 B16R2.255 Fc1ccnc(c1)SCCc2c[nH]cn2 62a_100000764206_100020628418 [0,1,0,0,0,1|2,0,0]=4 6566 B16R2.255 Fc1ccnc(c1)SCCc2c[nH]cn2 62a_100020628418_100000764206 [0,1,0,0,0,1|2,0,0]=4 6567 B16R2.255 Fc1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100011361476 [0,1,0,0,0,1|1,0,0]=3 6568 B16R2.255 Fc1cncc(c1)CNCc2c[nH]cn2 2230a_100011962886_100000707719 [0,1,0,0,0,1|1,0,0]=3 6569 B16R2.255 Fc1cncc(c1)CNCc2c[nH]cn2 34a_100011962886_100000707719 [0,1,0,0,0,1|1,0,0]=3 6570 B16R2.255 Fc1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100011361476 [0,1,0,0,0,1|2,0,0]=4 6571 B16R2.255 Fc1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100011361476 [0,1,0,0,0,1|2,0,0]=4 6572 B16R2.255 Fc1cncc(c1)CNCc2cocn2 207a_100015188801_100011361476 [0,1,0,0,0,1|2,0,0]=4 6573 B16R2.255 Fc1cncc(c1)CNCc2cocn2 270004a_100011962886_100000050382 [0,1,0,0,0,1|2,0,0]=4 6574 B16R2.255 Fc1cncc(c1)CNCc2cocn2 270004a_100015188801_100011361476 [0,1,0,0,0,1|2,0,0]=4 6575 B16R2.255 Fc1cncc(c1)CNCc2cscn2 207a_100011962886_100000743575 [0,1,0,0,0,1|2,0,0]=4 6576 B16R2.255 Fc1cncc(c1)CNCc2cscn2 207a_100015185402_100011361476 [0,1,0,0,0,1|2,0,0]=4 6577 B16R2.255 Fc1cncc(c1)CNCc2cscn2 2230a_100011962886_100000205941 [0,1,0,0,0,1|2,0,0]=4 6578 B16R2.255 Fc1cncc(c1)CNCc2cscn2 2230a_100015185402_100000725299 [0,1,0,0,0,1|2,0,0]=4 6579 B16R2.255 Fc1cncc(c1)CNCc2cscn2 270004a_100011962886_100000743575 [0,1,0,0,0,1|2,0,0]=4 6580 B16R2.255 Fc1cncc(c1)CNCc2cscn2 34a_100011962886_100000205941 [0,1,0,0,0,1|2,0,0]=4 6581 B16R2.255 Fc1cncc(c1)COCc2c[nH]cn2 34a_100011962875_100000707719 [0,1,0,0,0,1|2,0,0]=4 6582 B16R2.255 Fc1cncc(c1)CSCc2c[nH]cn2 62a_100000707719_100000725299 [0,1,0,0,0,1|2,0,0]=4 6583 B16R2.255 Fc1cncc(c1)CSCc2c[nH]cn2 62a_100000725299_100000707719 [0,1,0,0,0,1|2,0,0]=4 6584 B16R2.255 Fc1cncc(c1)OCCc2c[nH]cn2 7a_100011830296_100020628418 [0,1,0,0,0,1|2,0,0]=4 6585 B16R2.255 Fc1cncc(c1)SCCc2c[nH]cn2 62a_100000744099_100020628418 [0,1,0,0,0,1|2,0,0]=4 6586 B16R2.255 Fc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000744099 [0,1,0,0,0,1|2,0,0]=4 6587 B16R2.255 Fc1cncc(n1)NCCc2c[nH]cn2 27a_100000755092_200009863489 [0,1,0,0,0,1|2,0,0]=4 6588 B16R2.255 Ic1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000014684 [0,1,0,0,0,1|0,0,0]=2 6589 B16R2.255 Ic1cccc(c1)CNCc2c[nH]cn2 2230a_100000106179_100000707719 [0,1,0,0,0,1|0,0,0]=2 6590 B16R2.255 Ic1cccc(c1)CNCc2c[nH]cn2 34a_100000106179_100000707719 [0,1,0,0,0,1|0,0,0]=2 6591 B16R2.255 Ic1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000014684 [0,1,0,0,0,1|1,0,0]=3 6592 B16R2.255 Ic1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000014684 [0,1,0,0,0,1|1,0,0]=3 6593 B16R2.255 Ic1cccc(c1)CNCc2cc[nH]n2 207a_100000106179_100000738523 [0,1,0,0,0,1|2,0,0]=4 6594 B16R2.255 Ic1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000014684 [0,1,0,0,0,1|2,0,0]=4 6595 B16R2.255 Ic1cccc(c1)CNCc2cc[nH]n2 270004a_100000106179_100000738523 [0,1,0,0,0,1|2,0,0]=4 6596 B16R2.255 Ic1cccc(c1)CNCc2ccco2 207a_100000106179_100000186105 [0,1,0,0,0,1|2,0,0]=4 6597 B16R2.255 Ic1cccc(c1)CNCc2ccco2 207a_100000185738_100000014684 [0,1,0,0,0,1|2,0,0]=4 6598 B16R2.255 Ic1cccc(c1)CNCc2ccco2 2230a_100000185738_100011218688 [0,1,0,0,0,1|2,0,0]=4 6599 B16R2.255 Ic1cccc(c1)CNCc2ccco2 270004a_100000106179_100000186105 [0,1,0,0,0,1|2,0,0]=4 6600 B16R2.255 Ic1cccc(c1)CNCc2ccco2 270004a_100000185738_100000014684 [0,1,0,0,0,1|2,0,0]=4 6601 B16R2.255 Ic1cccc(c1)CNCc2ccco2 34a_100000185738_100011218688 [0,1,0,0,0,1|2,0,0]=4 6602 B16R2.255 Ic1cccc(c1)CNCc2cccs2 207a_100000106179_100000209959 [0,1,0,0,0,1|2,0,0]=4 6603 B16R2.255 Ic1cccc(c1)CNCc2cccs2 207a_100000211653_100000014684 [0,1,0,0,0,1|2,0,0]=4 6604 B16R2.255 Ic1cccc(c1)CNCc2cccs2 2230a_100000211653_100011218688 [0,1,0,0,0,1|2,0,0]=4 6605 B16R2.255 Ic1cccc(c1)CNCc2cccs2 270004a_100000106179_100000209959 [0,1,0,0,0,1|2,0,0]=4 6606 B16R2.255 Ic1cccc(c1)CNCc2cccs2 270004a_100000211653_100000014684 [0,1,0,0,0,1|2,0,0]=4 6607 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 207a_100000106179_100011215517 [0,1,0,0,0,1|2,0,0]=4 6608 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 207a_100015206860_100000014684 [0,1,0,0,0,1|2,0,0]=4 6609 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 2230a_100015206860_100011218688 [0,1,0,0,0,1|2,0,0]=4 6610 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 270004a_100000106179_100011215517 [0,1,0,0,0,1|2,0,0]=4 6611 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000014684 [0,1,0,0,0,1|2,0,0]=4 6612 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 34a_100015206860_100011218688 [0,1,0,0,0,1|2,0,0]=4 6613 B16R2.255 Ic1cccc(c1)CNCc2ccon2 207a_100000688301_100000014684 [0,1,0,0,0,1|2,0,0]=4 6614 B16R2.255 Ic1cccc(c1)CNCc2ccon2 2230a_100000106179_100000234950 [0,1,0,0,0,1|2,0,0]=4 6615 B16R2.255 Ic1cccc(c1)CNCc2ccon2 270004a_100000688301_100000014684 [0,1,0,0,0,1|2,0,0]=4 6616 B16R2.255 Ic1cccc(c1)CNCc2ccon2 34a_100000106179_100000234950 [0,1,0,0,0,1|2,0,0]=4 6617 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 207a_100000106179_100000188534 [0,1,0,0,0,1|2,0,0]=4 6618 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 207a_100000186416_100000014684 [0,1,0,0,0,1|2,0,0]=4 6619 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 2230a_100000106179_100011261437 [0,1,0,0,0,1|2,0,0]=4 6620 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 2230a_100000186416_100011218688 [0,1,0,0,0,1|2,0,0]=4 6621 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 270004a_100000106179_100000188534 [0,1,0,0,0,1|2,0,0]=4 6622 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000014684 [0,1,0,0,0,1|2,0,0]=4 6623 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 34a_100000106179_100011261437 [0,1,0,0,0,1|2,0,0]=4 6624 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 34a_100000186416_100011218688 [0,1,0,0,0,1|2,0,0]=4 6625 B16R2.255 Ic1cccc(c1)CNCc2cn[nH]c2 207a_100000106179_100016992096 [0,1,0,0,0,1|2,0,0]=4 6626 B16R2.255 Ic1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000014684 [0,1,0,0,0,1|2,0,0]=4 6627 B16R2.255 Ic1cccc(c1)CNCc2cn[nH]c2 270004a_100000106179_100016992096 [0,1,0,0,0,1|2,0,0]=4 6628 B16R2.255 Ic1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000014684 [0,1,0,0,0,1|2,0,0]=4 6629 B16R2.255 Ic1cccc(c1)CNCc2cnc[nH]2 207a_100000106179_100000742939 [0,1,0,0,0,1|0,0,2]=4 6630 B16R2.255 Ic1cccc(c1)CNCc2cnco2 207a_100020634212_100000014684 [0,1,0,0,0,1|1,0,1]=4 6631 B16R2.255 Ic1cccc(c1)CNCc2cnco2 270004a_100000106179_100000064291 [0,1,0,0,0,1|1,0,1]=4 6632 B16R2.255 Ic1cccc(c1)CNCc2cnco2 270004a_100020634212_100000014684 [0,1,0,0,0,1|1,0,1]=4 6633 B16R2.255 Ic1cccc(c1)CNCc2cncs2 207a_100000106179_100000749870 [0,1,0,0,0,1|1,0,1]=4 6634 B16R2.255 Ic1cccc(c1)CNCc2cncs2 207a_100016987365_100000014684 [0,1,0,0,0,1|1,0,1]=4 6635 B16R2.255 Ic1cccc(c1)CNCc2cncs2 2230a_100000106179_100015185245 [0,1,0,0,0,1|1,0,1]=4 6636 B16R2.255 Ic1cccc(c1)CNCc2cncs2 2230a_100016987365_100011218688 [0,1,0,0,0,1|1,0,1]=4 6637 B16R2.255 Ic1cccc(c1)CNCc2cncs2 270004a_100000106179_100000749870 [0,1,0,0,0,1|1,0,1]=4 6638 B16R2.255 Ic1cccc(c1)CNCc2cncs2 270004a_100016987365_100000014684 [0,1,0,0,0,1|1,0,1]=4 6639 B16R2.255 Ic1cccc(c1)CNCc2cncs2 34a_100000106179_100015185245 [0,1,0,0,0,1|1,0,1]=4 6640 B16R2.255 Ic1cccc(c1)CNCc2cocn2 207a_100015188801_100000014684 [0,1,0,0,0,1|1,0,0]=3 6641 B16R2.255 Ic1cccc(c1)CNCc2cocn2 270004a_100000106179_100000050382 [0,1,0,0,0,1|1,0,0]=3 6642 B16R2.255 Ic1cccc(c1)CNCc2cocn2 270004a_100015188801_100000014684 [0,1,0,0,0,1|1,0,0]=3 6643 B16R2.255 Ic1cccc(c1)CNCc2cscn2 207a_100000106179_100000743575 [0,1,0,0,0,1|1,0,0]=3 6644 B16R2.255 Ic1cccc(c1)CNCc2cscn2 207a_100015185402_100000014684 [0,1,0,0,0,1|1,0,0]=3 6645 B16R2.255 Ic1cccc(c1)CNCc2cscn2 2230a_100000106179_100000205941 [0,1,0,0,0,1|1,0,0]=3 6646 B16R2.255 Ic1cccc(c1)CNCc2cscn2 2230a_100015185402_100011218688 [0,1,0,0,0,1|1,0,0]=3 6647 B16R2.255 Ic1cccc(c1)CNCc2cscn2 270004a_100000106179_100000743575 [0,1,0,0,0,1|1,0,0]=3 6648 B16R2.255 Ic1cccc(c1)CNCc2cscn2 34a_100000106179_100000205941 [0,1,0,0,0,1|1,0,0]=3 6649 B16R2.255 Ic1cccc(c1)CNCc2csnn2 270004a_100000106179_100000738508 [0,1,0,0,0,1|2,0,0]=4 6650 B16R2.255 Ic1cccc(c1)CNCc2ncc[nH]2 207a_100000106179_100000743867 [0,1,0,0,0,1|2,0,0]=4 6651 B16R2.255 Ic1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000014684 [0,1,0,0,0,1|2,0,0]=4 6652 B16R2.255 Ic1cccc(c1)CNCc2ncc[nH]2 2230a_100000106179_100016991755 [0,1,0,0,0,1|2,0,0]=4 6653 B16R2.255 Ic1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000014684 [0,1,0,0,0,1|2,0,0]=4 6654 B16R2.255 Ic1cccc(c1)CNCc2ncc[nH]2 34a_100000106179_100016991755 [0,1,0,0,0,1|2,0,0]=4 6655 B16R2.255 Ic1cccc(c1)CNCc2ncco2 207a_100016994969_100000014684 [0,1,0,0,0,1|2,0,0]=4 6656 B16R2.255 Ic1cccc(c1)CNCc2ncco2 2230a_100000106179_103436540062 [0,1,0,0,0,1|2,0,0]=4 6657 B16R2.255 Ic1cccc(c1)CNCc2ncco2 2230a_100016994969_100011218688 [0,1,0,0,0,1|2,0,0]=4 6658 B16R2.255 Ic1cccc(c1)CNCc2ncco2 270004a_100000106179_100000064290 [0,1,0,0,0,1|2,0,0]=4 6659 B16R2.255 Ic1cccc(c1)CNCc2ncco2 34a_100000106179_103436540062 [0,1,0,0,0,1|2,0,0]=4 6660 B16R2.255 Ic1cccc(c1)CNCc2nccs2 207a_100000106179_100000750902 [0,1,0,0,0,1|2,0,0]=4 6661 B16R2.255 Ic1cccc(c1)CNCc2nccs2 207a_100000740555_100000014684 [0,1,0,0,0,1|2,0,0]=4 6662 B16R2.255 Ic1cccc(c1)CNCc2nccs2 2230a_100000106179_100015184050 [0,1,0,0,0,1|2,0,0]=4 6663 B16R2.255 Ic1cccc(c1)CNCc2nccs2 2230a_100000740555_100011218688 [0,1,0,0,0,1|2,0,0]=4 6664 B16R2.255 Ic1cccc(c1)CNCc2nccs2 270004a_100000106179_100000750902 [0,1,0,0,0,1|2,0,0]=4 6665 B16R2.255 Ic1cccc(c1)CNCc2nccs2 270004a_100000740555_100000014684 [0,1,0,0,0,1|2,0,0]=4 6666 B16R2.255 Ic1cccc(c1)CNCc2nccs2 34a_100000106179_100015184050 [0,1,0,0,0,1|2,0,0]=4 6667 B16R2.255 Ic1cccc(c1)CNCc2ncon2 34a_100000106179_100000233494 [0,1,0,0,0,1|2,0,0]=4 6668 B16R2.255 Ic1cccc(c1)CNCn2cncn2 2230a_100000106179_200020645497 [0,1,0,0,0,1|1,0,1]=4 6669 B16R2.255 Ic1cccc(c1)CNCn2cncn2 34a_100000106179_200020645497 [0,1,0,0,0,1|1,0,1]=4 6670 B16R2.255 Ic1cccc(c1)COCc2c[nH]cn2 34a_100011215336_100000707719 [0,1,0,0,0,1|1,0,0]=3 6671 B16R2.255 Ic1cccc(c1)COCc2cscn2 34a_100011215336_100000205941 [0,1,0,0,0,1|2,0,0]=4 6672 B16R2.255 Ic1cccc(c1)COCc2cscn2 7a_100011215336_100000205941 [0,1,0,0,0,1|2,0,0]=4 6673 B16R2.255 Ic1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100011218688 [0,1,0,0,0,1|1,0,0]=3 6674 B16R2.255 Ic1cccc(c1)CSCc2c[nH]cn2 62a_100011218688_100000707719 [0,1,0,0,0,1|1,0,0]=3 6675 B16R2.255 Ic1cccc(c1)CSCc2cscn2 62a_100000205941_100011218688 [0,1,0,0,0,1|2,0,0]=4 6676 B16R2.255 Ic1cccc(c1)CSCc2cscn2 62a_100011218688_100000205941 [0,1,0,0,0,1|2,0,0]=4 6677 B16R2.255 Ic1cccc(c1)NCCc2cccs2 34a_100000211102_100000748579 [0,1,0,0,0,1|2,0,0]=4 6678 B16R2.255 Ic1cccc(c1)NCCn2cccn2 34a_100000211102_100015204718 [0,1,0,0,0,1|2,0,0]=4 6679 B16R2.255 Ic1cccc(c1)NCCn2cncn2 34a_100000211102_200000749826 [0,1,0,0,0,1|1,0,1]=4 6680 B16R2.255 Ic1cccc(c1)NN=Cc2cc[nH]c2 4a_100020605690_100000760201 [0,1,0,0,0,1|1,0,1]=4 6681 B16R2.255 Ic1cccc(c1)NN=Cc2cocn2 4a_100020605690_100000050382 [0,1,0,0,0,1|1,0,1]=4 6682 B16R2.255 Ic1cccc(c1)NN=Cc2cscn2 4a_100020605690_100000743575 [0,1,0,0,0,1|1,0,1]=4 6683 B16R2.255 Ic1cccc(c1)OCCc2c[nH]cn2 7a_100000211634_100020628418 [0,1,0,0,0,1|1,0,0]=3 6684 B16R2.255 Nc1cc(ccn1)SCCc2c[nH]cn2 62a_100000049665_100020628418 [0,1,0,0,0,1|2,0,0]=4 6685 B16R2.255 Nc1cc(ccn1)SCCc2c[nH]cn2 62a_100020628418_100000049665 [0,1,0,0,0,1|2,0,0]=4 6686 B16R2.255 Nc1cc(ncn1)NCCc2c[nH]cn2 27a_100000755092_100000701291 [0,1,0,0,0,1|2,0,0]=4 6687 B16R2.255 Nc1cccc(c1)COCc2c[nH]cn2 34a_100000211919_100000707719 [0,1,0,0,0,1|1,0,0]=3 6688 B16R2.255 Nc1cccc(c1)COCc2cscn2 34a_100000211919_100000205941 [0,1,0,0,0,1|2,0,0]=4 6689 B16R2.255 Nc1cccc(c1)SCCc2c[nH]cn2 62a_100000210019_100020628418 [0,1,0,0,0,1|1,0,0]=3 6690 B16R2.255 Nc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100000210019 [0,1,0,0,0,1|1,0,0]=3 6691 B16R2.255 Nc1cccc(n1)SCCc2c[nH]cn2 62a_100000740741_100020628418 [0,1,0,0,0,1|2,0,0]=4 6692 B16R2.255 Nc1cccc(n1)SCCc2c[nH]cn2 62a_100020628418_100000740741 [0,1,0,0,0,1|2,0,0]=4 6693 B16R2.255 Nc1ccnc(c1)COCc2c[nH]cn2 34a_100000692640_100000707719 [0,1,0,0,0,1|2,0,0]=4 6694 B16R2.255 Nc1ccnc(c1)SCCc2c[nH]cn2 62a_100009814236_100020628418 [0,1,0,0,0,1|2,0,0]=4 6695 B16R2.255 Nc1ccnc(c1)SCCc2c[nH]cn2 62a_100020628418_100009814236 [0,1,0,0,0,1|2,0,0]=4 6696 B16R2.255 Nc1ccnc(n1)NCCc2c[nH]cn2 27a_100000755092_100000757536 [0,1,0,0,0,1|2,0,0]=4 6697 B16R2.255 Nc1cncc(c1)COCc2c[nH]cn2 34a_100000085308_100000707719 [0,1,0,0,0,1|2,0,0]=4 6698 B16R2.255 Nc1cncc(c1)SCCc2c[nH]cn2 62a_100000687067_100020628418 [0,1,0,0,0,1|2,0,0]=4 6699 B16R2.255 Nc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000687067 [0,1,0,0,0,1|2,0,0]=4 6700 B16R2.255 Nc1nccc(n1)NCCc2c[nH]cn2 27a_100000755092_100000055538 [0,1,0,0,0,1|2,0,0]=4 6701 B16R2.255 O=c1cc(cc[nH]1)NCCc2c[nH]cn2 27a_100000755092_100000061649 [0,1,0,0,0,1|1,0,0]=3 6702 B16R2.255 O=c1cc(cc[nH]1)SCCc2c[nH]cn2 62a_100009816521_100020628418 [0,1,0,0,0,1|2,0,0]=4 6703 B16R2.255 O=c1cc(cc[nH]1)SCCc2c[nH]cn2 62a_100020628418_100009816521 [0,1,0,0,0,1|2,0,0]=4 6704 B16R2.255 O=c1cc[nH]c(c1)SCCc2c[nH]cn2 62a_100009817434_100020628418 [0,1,0,0,0,1|2,0,0]=4 6705 B16R2.255 O=c1cccc([nH]1)CNCc2c[nH]cn2 207a_100000758547_100011935257 [0,1,0,0,0,1|1,0,0]=3 6706 B16R2.255 O=c1cccc([nH]1)CNCc2c[nH]cn2 2230a_100000696482_100000707719 [0,1,0,0,0,1|1,0,0]=3 6707 B16R2.255 O=c1cccc([nH]1)CNCc2c[nH]nn2 207a_100020620823_100011935257 [0,1,0,0,0,1|2,0,0]=4 6708 B16R2.255 O=c1cccc([nH]1)CNCc2cocn2 207a_100015188801_100011935257 [0,1,0,0,0,1|2,0,0]=4 6709 B16R2.255 O=c1cccc([nH]1)CNCc2cscn2 207a_100015185402_100011935257 [0,1,0,0,0,1|2,0,0]=4 6710 B16R2.255 O=c1cccc([nH]1)CNCc2cscn2 2230a_100000696482_100000205941 [0,1,0,0,0,1|2,0,0]=4 6711 B16R2.255 O=c1cccc([nH]1)SCCc2c[nH]cn2 62a_100020628418_100000752884 [0,1,0,0,0,1|2,0,0]=4 6712 B16R2.255 O=c1nc(cc[nH]1)NCCc2c[nH]cn2 27a_100000755092_200000134032 [0,1,0,0,0,1|2,0,0]=4 6713 B16R2.255 Oc1cc(ccn1)CNCc2c[nH]cn2 207a_100000758547_100000688113 [0,1,0,0,0,1|1,0,0]=3 6714 B16R2.255 Oc1cc(ccn1)CNCc2c[nH]nn2 207a_100020620823_100000688113 [0,1,0,0,0,1|2,0,0]=4 6715 B16R2.255 Oc1cc(ccn1)CNCc2cocn2 207a_100015188801_100000688113 [0,1,0,0,0,1|2,0,0]=4 6716 B16R2.255 Oc1cc(ccn1)CNCc2cscn2 207a_100015185402_100000688113 [0,1,0,0,0,1|2,0,0]=4 6717 B16R2.255 Oc1cc(ncn1)NCCc2c[nH]cn2 27a_100000755092_100000765262 [0,1,0,0,0,1|2,0,0]=4 6718 B16R2.255 Oc1cccc(c1)CNCc2c[nH]cn2 207a_100000758547_100000188321 [0,1,0,0,0,1|0,0,0]=2 6719 B16R2.255 Oc1cccc(c1)CNCc2c[nH]cn2 2230a_100000743036_100000707719 [0,1,0,0,0,1|0,0,0]=2 6720 B16R2.255 Oc1cccc(c1)CNCc2c[nH]cn2 34a_100000743036_100000707719 [0,1,0,0,0,1|0,0,0]=2 6721 B16R2.255 Oc1cccc(c1)CNCc2c[nH]nn2 207a_100020620823_100000188321 [0,1,0,0,0,1|1,0,0]=3 6722 B16R2.255 Oc1cccc(c1)CNCc2c[nH]nn2 270004a_100020620823_100000188321 [0,1,0,0,0,1|1,0,0]=3 6723 B16R2.255 Oc1cccc(c1)CNCc2cc[nH]n2 207a_100000739516_100000188321 [0,1,0,0,0,1|2,0,0]=4 6724 B16R2.255 Oc1cccc(c1)CNCc2cc[nH]n2 207a_100000743036_100000738523 [0,1,0,0,0,1|2,0,0]=4 6725 B16R2.255 Oc1cccc(c1)CNCc2cc[nH]n2 270004a_100000743036_100000738523 [0,1,0,0,0,1|2,0,0]=4 6726 B16R2.255 Oc1cccc(c1)CNCc2ccco2 207a_100000185738_100000188321 [0,1,0,0,0,1|2,0,0]=4 6727 B16R2.255 Oc1cccc(c1)CNCc2ccco2 207a_100000743036_100000186105 [0,1,0,0,0,1|2,0,0]=4 6728 B16R2.255 Oc1cccc(c1)CNCc2ccco2 2230a_100000185738_100011660834 [0,1,0,0,0,1|2,0,0]=4 6729 B16R2.255 Oc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000188321 [0,1,0,0,0,1|2,0,0]=4 6730 B16R2.255 Oc1cccc(c1)CNCc2ccco2 270004a_100000743036_100000186105 [0,1,0,0,0,1|2,0,0]=4 6731 B16R2.255 Oc1cccc(c1)CNCc2ccco2 34a_100000185738_100011660834 [0,1,0,0,0,1|2,0,0]=4 6732 B16R2.255 Oc1cccc(c1)CNCc2cccs2 207a_100000211653_100000188321 [0,1,0,0,0,1|2,0,0]=4 6733 B16R2.255 Oc1cccc(c1)CNCc2cccs2 207a_100000743036_100000209959 [0,1,0,0,0,1|2,0,0]=4 6734 B16R2.255 Oc1cccc(c1)CNCc2cccs2 2230a_100000211653_100011660834 [0,1,0,0,0,1|2,0,0]=4 6735 B16R2.255 Oc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000188321 [0,1,0,0,0,1|2,0,0]=4 6736 B16R2.255 Oc1cccc(c1)CNCc2cccs2 270004a_100000743036_100000209959 [0,1,0,0,0,1|2,0,0]=4 6737 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 207a_100000743036_100011215517 [0,1,0,0,0,1|2,0,0]=4 6738 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000188321 [0,1,0,0,0,1|2,0,0]=4 6739 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100011660834 [0,1,0,0,0,1|2,0,0]=4 6740 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 270004a_100000743036_100011215517 [0,1,0,0,0,1|2,0,0]=4 6741 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000188321 [0,1,0,0,0,1|2,0,0]=4 6742 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 34a_100015206860_100011660834 [0,1,0,0,0,1|2,0,0]=4 6743 B16R2.255 Oc1cccc(c1)CNCc2ccon2 207a_100000688301_100000188321 [0,1,0,0,0,1|2,0,0]=4 6744 B16R2.255 Oc1cccc(c1)CNCc2ccon2 2230a_100000743036_100000234950 [0,1,0,0,0,1|2,0,0]=4 6745 B16R2.255 Oc1cccc(c1)CNCc2ccon2 270004a_100000688301_100000188321 [0,1,0,0,0,1|2,0,0]=4 6746 B16R2.255 Oc1cccc(c1)CNCc2ccon2 34a_100000743036_100000234950 [0,1,0,0,0,1|2,0,0]=4 6747 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000188321 [0,1,0,0,0,1|2,0,0]=4 6748 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 207a_100000743036_100000188534 [0,1,0,0,0,1|2,0,0]=4 6749 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100011660834 [0,1,0,0,0,1|2,0,0]=4 6750 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 2230a_100000743036_100011261437 [0,1,0,0,0,1|2,0,0]=4 6751 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000188321 [0,1,0,0,0,1|2,0,0]=4 6752 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 270004a_100000743036_100000188534 [0,1,0,0,0,1|2,0,0]=4 6753 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 34a_100000186416_100011660834 [0,1,0,0,0,1|2,0,0]=4 6754 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 34a_100000743036_100011261437 [0,1,0,0,0,1|2,0,0]=4 6755 B16R2.255 Oc1cccc(c1)CNCc2cn[nH]c2 207a_100000737208_100000188321 [0,1,0,0,0,1|2,0,0]=4 6756 B16R2.255 Oc1cccc(c1)CNCc2cn[nH]c2 207a_100000743036_100016992096 [0,1,0,0,0,1|2,0,0]=4 6757 B16R2.255 Oc1cccc(c1)CNCc2cn[nH]c2 270004a_100000737208_100000188321 [0,1,0,0,0,1|2,0,0]=4 6758 B16R2.255 Oc1cccc(c1)CNCc2cn[nH]c2 270004a_100000743036_100016992096 [0,1,0,0,0,1|2,0,0]=4 6759 B16R2.255 Oc1cccc(c1)CNCc2cnc[nH]2 207a_100000743036_100000742939 [0,1,0,0,0,1|0,0,2]=4 6760 B16R2.255 Oc1cccc(c1)CNCc2cnco2 207a_100020634212_100000188321 [0,1,0,0,0,1|1,0,1]=4 6761 B16R2.255 Oc1cccc(c1)CNCc2cnco2 270004a_100000743036_100000064291 [0,1,0,0,0,1|1,0,1]=4 6762 B16R2.255 Oc1cccc(c1)CNCc2cnco2 270004a_100020634212_100000188321 [0,1,0,0,0,1|1,0,1]=4 6763 B16R2.255 Oc1cccc(c1)CNCc2cncs2 207a_100000743036_100000749870 [0,1,0,0,0,1|1,0,1]=4 6764 B16R2.255 Oc1cccc(c1)CNCc2cncs2 207a_100016987365_100000188321 [0,1,0,0,0,1|1,0,1]=4 6765 B16R2.255 Oc1cccc(c1)CNCc2cncs2 2230a_100000743036_100015185245 [0,1,0,0,0,1|1,0,1]=4 6766 B16R2.255 Oc1cccc(c1)CNCc2cncs2 2230a_100016987365_100011660834 [0,1,0,0,0,1|1,0,1]=4 6767 B16R2.255 Oc1cccc(c1)CNCc2cncs2 270004a_100000743036_100000749870 [0,1,0,0,0,1|1,0,1]=4 6768 B16R2.255 Oc1cccc(c1)CNCc2cncs2 270004a_100016987365_100000188321 [0,1,0,0,0,1|1,0,1]=4 6769 B16R2.255 Oc1cccc(c1)CNCc2cncs2 34a_100000743036_100015185245 [0,1,0,0,0,1|1,0,1]=4 6770 B16R2.255 Oc1cccc(c1)CNCc2cocn2 207a_100015188801_100000188321 [0,1,0,0,0,1|1,0,0]=3 6771 B16R2.255 Oc1cccc(c1)CNCc2cocn2 270004a_100000743036_100000050382 [0,1,0,0,0,1|1,0,0]=3 6772 B16R2.255 Oc1cccc(c1)CNCc2cocn2 270004a_100015188801_100000188321 [0,1,0,0,0,1|1,0,0]=3 6773 B16R2.255 Oc1cccc(c1)CNCc2cscn2 207a_100000743036_100000743575 [0,1,0,0,0,1|1,0,0]=3 6774 B16R2.255 Oc1cccc(c1)CNCc2cscn2 207a_100015185402_100000188321 [0,1,0,0,0,1|1,0,0]=3 6775 B16R2.255 Oc1cccc(c1)CNCc2cscn2 2230a_100000743036_100000205941 [0,1,0,0,0,1|1,0,0]=3 6776 B16R2.255 Oc1cccc(c1)CNCc2cscn2 2230a_100015185402_100011660834 [0,1,0,0,0,1|1,0,0]=3 6777 B16R2.255 Oc1cccc(c1)CNCc2cscn2 270004a_100000743036_100000743575 [0,1,0,0,0,1|1,0,0]=3 6778 B16R2.255 Oc1cccc(c1)CNCc2cscn2 34a_100000743036_100000205941 [0,1,0,0,0,1|1,0,0]=3 6779 B16R2.255 Oc1cccc(c1)CNCc2csnn2 270004a_100000743036_100000738508 [0,1,0,0,0,1|2,0,0]=4 6780 B16R2.255 Oc1cccc(c1)CNCc2ncc[nH]2 207a_100000743036_100000743867 [0,1,0,0,0,1|2,0,0]=4 6781 B16R2.255 Oc1cccc(c1)CNCc2ncc[nH]2 207a_100000754540_100000188321 [0,1,0,0,0,1|2,0,0]=4 6782 B16R2.255 Oc1cccc(c1)CNCc2ncc[nH]2 2230a_100000743036_100016991755 [0,1,0,0,0,1|2,0,0]=4 6783 B16R2.255 Oc1cccc(c1)CNCc2ncc[nH]2 270004a_100000754540_100000188321 [0,1,0,0,0,1|2,0,0]=4 6784 B16R2.255 Oc1cccc(c1)CNCc2ncc[nH]2 34a_100000743036_100016991755 [0,1,0,0,0,1|2,0,0]=4 6785 B16R2.255 Oc1cccc(c1)CNCc2ncco2 207a_100016994969_100000188321 [0,1,0,0,0,1|2,0,0]=4 6786 B16R2.255 Oc1cccc(c1)CNCc2ncco2 2230a_100000743036_103436540062 [0,1,0,0,0,1|2,0,0]=4 6787 B16R2.255 Oc1cccc(c1)CNCc2ncco2 2230a_100016994969_100011660834 [0,1,0,0,0,1|2,0,0]=4 6788 B16R2.255 Oc1cccc(c1)CNCc2ncco2 270004a_100000743036_100000064290 [0,1,0,0,0,1|2,0,0]=4 6789 B16R2.255 Oc1cccc(c1)CNCc2ncco2 34a_100000743036_103436540062 [0,1,0,0,0,1|2,0,0]=4 6790 B16R2.255 Oc1cccc(c1)CNCc2nccs2 207a_100000740555_100000188321 [0,1,0,0,0,1|2,0,0]=4 6791 B16R2.255 Oc1cccc(c1)CNCc2nccs2 207a_100000743036_100000750902 [0,1,0,0,0,1|2,0,0]=4 6792 B16R2.255 Oc1cccc(c1)CNCc2nccs2 2230a_100000740555_100011660834 [0,1,0,0,0,1|2,0,0]=4 6793 B16R2.255 Oc1cccc(c1)CNCc2nccs2 2230a_100000743036_100015184050 [0,1,0,0,0,1|2,0,0]=4 6794 B16R2.255 Oc1cccc(c1)CNCc2nccs2 270004a_100000740555_100000188321 [0,1,0,0,0,1|2,0,0]=4 6795 B16R2.255 Oc1cccc(c1)CNCc2nccs2 270004a_100000743036_100000750902 [0,1,0,0,0,1|2,0,0]=4 6796 B16R2.255 Oc1cccc(c1)CNCc2nccs2 34a_100000743036_100015184050 [0,1,0,0,0,1|2,0,0]=4 6797 B16R2.255 Oc1cccc(c1)CNCc2ncon2 34a_100000743036_100000233494 [0,1,0,0,0,1|2,0,0]=4 6798 B16R2.255 Oc1cccc(c1)CNCn2cncn2 2230a_100000743036_200020645497 [0,1,0,0,0,1|1,0,1]=4 6799 B16R2.255 Oc1cccc(c1)CNCn2cncn2 34a_100000743036_200020645497 [0,1,0,0,0,1|1,0,1]=4 6800 B16R2.255 Oc1cccc(c1)CSCc2c[nH]cn2 62a_100000707719_100011660834 [0,1,0,0,0,1|1,0,0]=3 6801 B16R2.255 Oc1cccc(c1)CSCc2c[nH]cn2 62a_100011660834_100000707719 [0,1,0,0,0,1|1,0,0]=3 6802 B16R2.255 Oc1cccc(c1)CSCc2cscn2 62a_100000205941_100011660834 [0,1,0,0,0,1|2,0,0]=4 6803 B16R2.255 Oc1cccc(c1)CSCc2cscn2 62a_100011660834_100000205941 [0,1,0,0,0,1|2,0,0]=4 6804 B16R2.255 Oc1cccc(c1)NCCc2cccs2 34a_100000210217_100000748579 [0,1,0,0,0,1|2,0,0]=4 6805 B16R2.255 Oc1cccc(c1)NCCn2cccn2 34a_100000210217_100015204718 [0,1,0,0,0,1|2,0,0]=4 6806 B16R2.255 Oc1cccc(c1)NCCn2cncn2 34a_100000210217_200000749826 [0,1,0,0,0,1|1,0,1]=4 6807 B16R2.255 Oc1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100000211634 [0,1,0,0,0,1|1,0,0]=3 6808 B16R2.255 Oc1ccnc(c1)SCCc2c[nH]cn2 62a_100020628418_100000762945 [0,1,0,0,0,1|2,0,0]=4 6809 B16R2.255 Oc1ccnc(n1)NCCc2c[nH]cn2 27a_100000755092_100011649813 [0,1,0,0,0,1|2,0,0]=4 6810 B16R2.255 Oc1cncc(c1)CNCc2c[nH]cn2 207a_100000758547_100012187055 [0,1,0,0,0,1|1,0,0]=3 6811 B16R2.255 Oc1cncc(c1)CNCc2c[nH]nn2 207a_100020620823_100012187055 [0,1,0,0,0,1|2,0,0]=4 6812 B16R2.255 Oc1cncc(c1)CNCc2c[nH]nn2 270004a_100020620823_100012187055 [0,1,0,0,0,1|2,0,0]=4 6813 B16R2.255 Oc1cncc(c1)CNCc2cocn2 207a_100015188801_100012187055 [0,1,0,0,0,1|2,0,0]=4 6814 B16R2.255 Oc1cncc(c1)CNCc2cocn2 270004a_100015188801_100012187055 [0,1,0,0,0,1|2,0,0]=4 6815 B16R2.255 Oc1cncc(c1)CNCc2cscn2 207a_100015185402_100012187055 [0,1,0,0,0,1|2,0,0]=4 6816 B16R2.255 Oc1cncc(c1)SCCc2c[nH]cn2 62a_100000754920_100020628418 [0,1,0,0,0,1|2,0,0]=4 6817 B16R2.255 Oc1cncc(c1)SCCc2c[nH]cn2 62a_100020628418_100000754920 [0,1,0,0,0,1|2,0,0]=4 6818 B16R2.255 [O-][n+]1cccc(c1)COCc2c[nH]cn2 34a_100000037817_100000707719 [0,1,0,0,0,1|2,0,0]=4 6819 B16R2.255 [O-][n+]1cccc(c1)OCCc2c[nH]cn2 7a_100000039713_100020628418 [0,1,0,0,0,1|2,0,0]=4 6820 B16R2.255 [O-][n+]1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_100009815978 [0,1,0,0,0,1|2,0,0]=4 6821 B16R2.255 [O-][n+]1ccnc(c1)NCCc2c[nH]cn2 27a_100000755092_100009880115 [0,1,0,0,0,1|2,0,0]=4 6822 B16R2.255 [S]c1cccc(c1)SCCc2c[nH]cn2 62a_100020628418_114929384022 [0,1,0,0,0,1|1,0,0]=3 6823 B16R2.255 [S]c1cccc(c1)SCCc2c[nH]cn2 62a_114929384022_100020628418 [0,1,0,0,0,1|1,0,0]=3 6824 B16R2.524 CC(Cc1ccccc1)Sc2c[nH]cn2 62a_100000756875_200011218536 [0,1,0,0,0,1|1,0,0]=3 6825 B16R2.524 CC(Cc1ccccc1)Sc2c[nH]cn2 62a_200011218536_100000756875 [0,1,0,0,0,1|1,0,0]=3 6826 B16R2.524 CC(Cc1ccccc1)Sc2c[nH]nn2 62a_100009819707_200011218536 [0,1,0,0,0,1|2,0,0]=4 6827 B16R2.524 CC(Cc1ccccc1)Sc2c[nH]nn2 62a_200011218536_100009819707 [0,1,0,0,0,1|2,0,0]=4 6828 B16R2.524 CC(Cc1ccccc1)Sc2cscn2 62a_100000751502_200011218536 [0,1,0,0,0,1|2,0,0]=4 6829 B16R2.524 CC(Cc1ccccc1)Sc2cscn2 62a_200011218536_100000751502 [0,1,0,0,0,1|2,0,0]=4 6830 B16R2.524 CC(Cc1ccccc1)Sc2nc[nH]n2 62a_100000761765_200011218536 [0,1,0,0,0,1|2,0,0]=4 6831 B16R2.524 CC(Cc1ccccc1)Sc2nc[nH]n2 62a_200011218536_100000761765 [0,1,0,0,0,1|2,0,0]=4 6832 B16R2.524 CN(Cc1c[nH]cn1)Cc2ncccn2 2230a_100025716638_100000707719 [0,1,0,0,0,1|2,0,0]=4 6833 B16R2.524 CN(Cc1c[nH]cn1)Cc2ncccn2 269982a_100025716638_100000707719 [0,1,0,0,0,1|2,0,0]=4 6834 B16R2.524 CN(Cc1ccccc1)Cc2c[nH]cn2 2230a_100000186898_100000707719 [0,1,0,0,0,1|0,0,0]=2 6835 B16R2.524 CN(Cc1ccccc1)Cc2c[nH]cn2 269982a_100000186898_100000707719 [0,1,0,0,0,1|0,0,0]=2 6836 B16R2.524 CN(Cc1ccccc1)Cc2cc[nH]n2 270004a_100000186898_100000738523 [0,1,0,0,0,1|2,0,0]=4 6837 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 2230a_100000184096_200000210301 [0,1,0,0,0,1|2,0,0]=4 6838 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 2230a_100000185268_100015291786 [0,1,0,0,0,1|2,0,0]=4 6839 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 269982a_100000184096_200000210301 [0,1,0,0,0,1|2,0,0]=4 6840 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 269982a_100000185268_100000211182 [0,1,0,0,0,1|2,0,0]=4 6841 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 270004a_100000185268_100015611070 [0,1,0,0,0,1|2,0,0]=4 6842 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 270004a_100000186898_100000186105 [0,1,0,0,0,1|2,0,0]=4 6843 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 2230a_100000184426_100015291786 [0,1,0,0,0,1|2,0,0]=4 6844 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 269982a_100000184426_100000211182 [0,1,0,0,0,1|2,0,0]=4 6845 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 270004a_100000184426_100015611070 [0,1,0,0,0,1|2,0,0]=4 6846 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 270004a_100000186898_100000209959 [0,1,0,0,0,1|2,0,0]=4 6847 B16R2.524 CN(Cc1ccccc1)Cc2ccoc2 270004a_100000186898_100011215517 [0,1,0,0,0,1|2,0,0]=4 6848 B16R2.524 CN(Cc1ccccc1)Cc2ccon2 2230a_100000186898_100000234950 [0,1,0,0,0,1|2,0,0]=4 6849 B16R2.524 CN(Cc1ccccc1)Cc2ccon2 2230a_100000757864_100015291786 [0,1,0,0,0,1|2,0,0]=4 6850 B16R2.524 CN(Cc1ccccc1)Cc2ccon2 269982a_100000186898_100000234950 [0,1,0,0,0,1|2,0,0]=4 6851 B16R2.524 CN(Cc1ccccc1)Cc2ccon2 269982a_100000757864_100000211182 [0,1,0,0,0,1|2,0,0]=4 6852 B16R2.524 CN(Cc1ccccc1)Cc2ccon2 270004a_100000757864_100015611070 [0,1,0,0,0,1|2,0,0]=4 6853 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 2230a_100000186898_100011261437 [0,1,0,0,0,1|2,0,0]=4 6854 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 2230a_100020654213_100015291786 [0,1,0,0,0,1|2,0,0]=4 6855 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 269982a_100000186898_100011233845 [0,1,0,0,0,1|2,0,0]=4 6856 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 269982a_100020654213_100000211182 [0,1,0,0,0,1|2,0,0]=4 6857 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 270004a_100000186898_100000188534 [0,1,0,0,0,1|2,0,0]=4 6858 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 270004a_100020654213_100015611070 [0,1,0,0,0,1|2,0,0]=4 6859 B16R2.524 CN(Cc1ccccc1)Cc2cn[nH]c2 270004a_100000186898_100016992096 [0,1,0,0,0,1|2,0,0]=4 6860 B16R2.524 CN(Cc1ccccc1)Cc2cnco2 270004a_100000186898_100000064291 [0,1,0,0,0,1|1,0,1]=4 6861 B16R2.524 CN(Cc1ccccc1)Cc2cncs2 2230a_100000186898_100015185245 [0,1,0,0,0,1|1,0,1]=4 6862 B16R2.524 CN(Cc1ccccc1)Cc2cncs2 269982a_100000186898_100015185245 [0,1,0,0,0,1|1,0,1]=4 6863 B16R2.524 CN(Cc1ccccc1)Cc2cncs2 270004a_100000186898_100000749870 [0,1,0,0,0,1|1,0,1]=4 6864 B16R2.524 CN(Cc1ccccc1)Cc2cocn2 270004a_100000186898_100000050382 [0,1,0,0,0,1|1,0,0]=3 6865 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 2230a_100000186898_100000205941 [0,1,0,0,0,1|1,0,0]=3 6866 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 2230a_100000225794_100015291786 [0,1,0,0,0,1|1,0,0]=3 6867 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 269982a_100000186898_100000205941 [0,1,0,0,0,1|1,0,0]=3 6868 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 269982a_100000225794_100000211182 [0,1,0,0,0,1|1,0,0]=3 6869 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 270004a_100000186898_100000743575 [0,1,0,0,0,1|1,0,0]=3 6870 B16R2.524 CN(Cc1ccccc1)Cc2cscn2 270004a_100000225794_100015611070 [0,1,0,0,0,1|1,0,0]=3 6871 B16R2.524 CN(Cc1ccccc1)Cc2csnn2 270004a_100000186898_100000738508 [0,1,0,0,0,1|2,0,0]=4 6872 B16R2.524 CN(Cc1ccccc1)Cc2ncc[nH]2 2230a_100000186898_100016991755 [0,1,0,0,0,1|2,0,0]=4 6873 B16R2.524 CN(Cc1ccccc1)Cc2ncc[nH]2 2230a_100015184136_100015291786 [0,1,0,0,0,1|2,0,0]=4 6874 B16R2.524 CN(Cc1ccccc1)Cc2ncc[nH]2 269982a_100000186898_100016991755 [0,1,0,0,0,1|2,0,0]=4 6875 B16R2.524 CN(Cc1ccccc1)Cc2ncc[nH]2 269982a_100015184136_100000211182 [0,1,0,0,0,1|2,0,0]=4 6876 B16R2.524 CN(Cc1ccccc1)Cc2ncc[nH]2 270004a_100015184136_100015611070 [0,1,0,0,0,1|2,0,0]=4 6877 B16R2.524 CN(Cc1ccccc1)Cc2ncco2 2230a_100000186898_103436540062 [0,1,0,0,0,1|2,0,0]=4 6878 B16R2.524 CN(Cc1ccccc1)Cc2ncco2 269982a_100000186898_103436540062 [0,1,0,0,0,1|2,0,0]=4 6879 B16R2.524 CN(Cc1ccccc1)Cc2ncco2 270004a_100000186898_100000064290 [0,1,0,0,0,1|2,0,0]=4 6880 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 2230a_100000186898_100015184050 [0,1,0,0,0,1|2,0,0]=4 6881 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 2230a_100000765864_100015291786 [0,1,0,0,0,1|2,0,0]=4 6882 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 2230a_200020666727_200000210301 [0,1,0,0,0,1|2,0,0]=4 6883 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 269982a_100000186898_100015184050 [0,1,0,0,0,1|2,0,0]=4 6884 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 269982a_100000765864_100000211182 [0,1,0,0,0,1|2,0,0]=4 6885 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 269982a_200020666727_200000210301 [0,1,0,0,0,1|2,0,0]=4 6886 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 270004a_100000186898_100000750902 [0,1,0,0,0,1|2,0,0]=4 6887 B16R2.524 CN(Cc1ccccc1)Cc2nccs2 270004a_100000765864_100015611070 [0,1,0,0,0,1|2,0,0]=4 6888 B16R2.524 CN(Cc1ccccc1)Cc2ncon2 269982a_100000186898_100000233494 [0,1,0,0,0,1|2,0,0]=4 6889 B16R2.524 CN(Cc1ccccc1)Cc2ncon2 269982a_100000697192_100000211182 [0,1,0,0,0,1|2,0,0]=4 6890 B16R2.524 CN(Cc1ccccc1)Cn2cncn2 2230a_100000186898_200020645497 [0,1,0,0,0,1|1,0,1]=4 6891 B16R2.524 CN(Cc1ccccc1)Cn2cncn2 269982a_100000186898_200020645497 [0,1,0,0,0,1|1,0,1]=4 6892 B16R2.524 CN(Cc1ccccn1)Cc2c[nH]cn2 2230a_100000207498_100000707719 [0,1,0,0,0,1|1,0,0]=3 6893 B16R2.524 CN(Cc1ccccn1)Cc2c[nH]cn2 269982a_100000207498_100000707719 [0,1,0,0,0,1|1,0,0]=3 6894 B16R2.524 CN(Cc1ccccn1)Cc2cocn2 270004a_100000207498_100000050382 [0,1,0,0,0,1|2,0,0]=4 6895 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 2230a_100000207498_100000205941 [0,1,0,0,0,1|2,0,0]=4 6896 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 2230a_100000225794_100000721315 [0,1,0,0,0,1|2,0,0]=4 6897 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 269982a_100000207498_100000205941 [0,1,0,0,0,1|2,0,0]=4 6898 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 269982a_100000225794_100000721315 [0,1,0,0,0,1|2,0,0]=4 6899 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 270004a_100000207498_100000743575 [0,1,0,0,0,1|2,0,0]=4 6900 B16R2.524 CN(Cc1ccccn1)Cc2cscn2 270004a_100000225794_100000209966 [0,1,0,0,0,1|2,0,0]=4 6901 B16R2.524 CN(Cc1cccnc1)Cc2c[nH]cn2 2230a_100000184577_100000707719 [0,1,0,0,0,1|1,0,0]=3 6902 B16R2.524 CN(Cc1cccnc1)Cc2c[nH]cn2 269982a_100000184577_100000707719 [0,1,0,0,0,1|1,0,0]=3 6903 B16R2.524 CN(Cc1cccnc1)Cc2cocn2 270004a_100000184577_100000050382 [0,1,0,0,0,1|2,0,0]=4 6904 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 2230a_100000184577_100000205941 [0,1,0,0,0,1|2,0,0]=4 6905 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 2230a_100000225794_100000741622 [0,1,0,0,0,1|2,0,0]=4 6906 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 269982a_100000184577_100000205941 [0,1,0,0,0,1|2,0,0]=4 6907 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 269982a_100000225794_100000733263 [0,1,0,0,0,1|2,0,0]=4 6908 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 270004a_100000184577_100000743575 [0,1,0,0,0,1|2,0,0]=4 6909 B16R2.524 CN(Cc1cccnc1)Cc2cscn2 270004a_100000225794_100000209961 [0,1,0,0,0,1|2,0,0]=4 6910 B16R2.524 CN(Cc1ccncc1)Cc2c[nH]cn2 2230a_100000187231_100000707719 [0,1,0,0,0,1|1,0,0]=3 6911 B16R2.524 CN(Cc1ccncc1)Cc2c[nH]cn2 269982a_100000187231_100000707719 [0,1,0,0,0,1|1,0,0]=3 6912 B16R2.524 CN(Cc1ccncc1)Cc2cocn2 270004a_100000187231_100000050382 [0,1,0,0,0,1|2,0,0]=4 6913 B16R2.524 CN(Cc1ccncc1)Cc2cscn2 2230a_100000187231_100000205941 [0,1,0,0,0,1|2,0,0]=4 6914 B16R2.524 CN(Cc1ccncc1)Cc2cscn2 2230a_100000225794_100015193705 [0,1,0,0,0,1|2,0,0]=4 6915 B16R2.524 CN(Cc1ccncc1)Cc2cscn2 269982a_100000187231_100000205941 [0,1,0,0,0,1|2,0,0]=4 6916 B16R2.524 CN(Cc1ccncc1)Cc2cscn2 269982a_100000225794_100015193705 [0,1,0,0,0,1|2,0,0]=4 6917 B16R2.524 CN(Cc1ccncc1)Cc2cscn2 270004a_100000187231_100000743575 [0,1,0,0,0,1|2,0,0]=4 6918 B16R2.524 CN(Cc1cnccn1)Cc2c[nH]cn2 2230a_100011269079_100000707719 [0,1,0,0,0,1|2,0,0]=4 6919 B16R2.524 CN(Cc1cnccn1)Cc2c[nH]cn2 269982a_100011269079_100000707719 [0,1,0,0,0,1|2,0,0]=4 6920 B16R2.524 O=C(Cc1c[nH]cn1)C[n+]2ccccc2 1458a_200000086051_100000707719 [0,1,0,0,0,1|2,0,0]=4 6921 B16R2.524 O=C(Cc1c[nH]cn1)Nc2ccccc2 22a_100000106764_100015291406 [0,1,0,0,0,1|0,0,0]=2 6922 B16R2.524 O=C(Cc1ccc[nH]1)Nc2ccccc2 11a_100000106764_100000238377 [0,1,0,0,0,1|1,0,1]=4 6923 B16R2.524 O=C(Cc1ccc[nH]1)Nc2ccccc2 22a_100000106764_100000238377 [0,1,0,0,0,1|1,0,1]=4 6924 B16R2.524 O=C(Cc1ccc[nH]1)Nc2ccccc2 527a_100000106764_100000238377 [0,1,0,0,0,1|1,0,1]=4 6925 B16R2.524 O=C(Cc1ccccc1)Cc2c[nH]cn2 1458a_100015291406_100015291786 [0,1,0,0,0,1|1,0,0]=3 6926 B16R2.524 O=C(Cc1ccccc1)Cc2cscn2 1458a_100011438297_100015291786 [0,1,0,0,0,1|2,0,0]=4 6927 B16R2.524 O=C(Cc1ccccn1)Cc2c[nH]cn2 1458a_100000233486_100000707719 [0,1,0,0,0,1|2,0,0]=4 6928 B16R2.524 O=C(Cc1ccccn1)Cc2c[nH]cn2 1458a_100015291406_100000721315 [0,1,0,0,0,1|2,0,0]=4 6929 B16R2.524 O=C(Cc1cccnc1)Cc2c[nH]cn2 1458a_100000737805_100000707719 [0,1,0,0,0,1|2,0,0]=4 6930 B16R2.524 O=C(Cc1cccnc1)Cc2c[nH]cn2 1458a_100015291406_100000733263 [0,1,0,0,0,1|2,0,0]=4 6931 B16R2.524 O=C(Cc1ccco1)Nc2ccccc2 11a_100000106764_100011217309 [0,1,0,0,0,1|2,0,0]=4 6932 B16R2.524 O=C(Cc1ccco1)Nc2ccccc2 22a_100000106764_100011217309 [0,1,0,0,0,1|2,0,0]=4 6933 B16R2.524 O=C(Cc1ccco1)Nc2ccccc2 527a_100000106764_100011217309 [0,1,0,0,0,1|2,0,0]=4 6934 B16R2.524 O=C(Cc1cccs1)Nc2ccccc2 11a_100000106764_100000210189 [0,1,0,0,0,1|2,0,0]=4 6935 B16R2.524 O=C(Cc1cccs1)Nc2ccccc2 1626a_100000106764_100000210189 [0,1,0,0,0,1|2,0,0]=4 6936 B16R2.524 O=C(Cc1cccs1)Nc2ccccc2 22a_100000106764_100000210189 [0,1,0,0,0,1|2,0,0]=4 6937 B16R2.524 O=C(Cc1ccncc1)Cc2c[nH]cn2 1458a_100015291406_100000705612 [0,1,0,0,0,1|2,0,0]=4 6938 B16R2.524 O=C(Cc1ccoc1)Nc2ccccc2 11a_100000106764_100000684892 [0,1,0,0,0,1|2,0,0]=4 6939 B16R2.524 O=C(Cc1ccoc1)Nc2ccccc2 1626a_100000106764_100000684892 [0,1,0,0,0,1|2,0,0]=4 6940 B16R2.524 O=C(Cc1ccoc1)Nc2ccccc2 22a_100000106764_100000684892 [0,1,0,0,0,1|2,0,0]=4 6941 B16R2.524 O=C(Cc1ccoc1)Nc2ccccc2 527a_100000106764_100000684892 [0,1,0,0,0,1|2,0,0]=4 6942 B16R2.524 O=C(Cc1ccsc1)Nc2ccccc2 11a_100000106764_100000184062 [0,1,0,0,0,1|2,0,0]=4 6943 B16R2.524 O=C(Cc1ccsc1)Nc2ccccc2 1626a_100000106764_100000184062 [0,1,0,0,0,1|2,0,0]=4 6944 B16R2.524 O=C(Cc1ccsc1)Nc2ccccc2 22a_100000106764_100000184062 [0,1,0,0,0,1|2,0,0]=4 6945 B16R2.524 O=C(Cc1ccsc1)Nc2ccccc2 527a_100000106764_100000184062 [0,1,0,0,0,1|2,0,0]=4 6946 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 11a_100000106764_100011438297 [0,1,0,0,0,1|1,0,0]=3 6947 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 1626a_100000106764_100011438297 [0,1,0,0,0,1|1,0,0]=3 6948 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 22a_100000106764_100011438297 [0,1,0,0,0,1|1,0,0]=3 6949 B16R2.524 O=C(Cc1cscn1)Nc2ccccc2 527a_100000106764_100011438297 [0,1,0,0,0,1|1,0,0]=3 6950 B16R2.524 O=C(Cn1cccn1)Nc2ccccc2 11a_100000106764_100000233772 [0,1,0,0,0,1|2,0,0]=4 6951 B16R2.524 O=C(Cn1cccn1)Nc2ccccc2 1626a_100000106764_100000233772 [0,1,0,0,0,1|2,0,0]=4 6952 B16R2.524 O=C(Cn1cccn1)Nc2ccccc2 22a_100000106764_100000233772 [0,1,0,0,0,1|2,0,0]=4 6953 B16R2.524 O=C(Cn1cccn1)Nc2ccccc2 527a_100000106764_100000233772 [0,1,0,0,0,1|2,0,0]=4 6954 B16R2.524 O=C(Cn1cncn1)Nc2ccccc2 11a_100000106764_100000699347 [0,1,0,0,0,1|1,0,1]=4 6955 B16R2.524 O=C(Cn1cncn1)Nc2ccccc2 1626a_100000106764_100000699347 [0,1,0,0,0,1|1,0,1]=4 6956 B16R2.524 O=C(Cn1cncn1)Nc2ccccc2 22a_100000106764_100000699347 [0,1,0,0,0,1|1,0,1]=4 6957 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2ccco2 2230a_100000184096_200025704644 [0,1,0,0,0,1|2,0,0]=4 6958 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2ccco2 269982a_100000184096_200025704644 [0,1,0,0,0,1|2,0,0]=4 6959 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2nccs2 2230a_200020666727_200025704644 [0,1,0,0,0,1|2,0,0]=4 6960 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2nccs2 269982a_200020666727_200025704644 [0,1,0,0,0,1|2,0,0]=4 6961 B16R2.2238 CC(=NNc1ccccc1)c2c[nH]cn2 4a_100015195140_100011246050 [0,1,0,0,0,1|0,0,1]=3 6962 B16R2.2238 CC(=NNc1ccccc1)c2cc[nH]c2 4a_100015195140_100000753940 [0,1,0,0,0,1|1,0,1]=4 6963 B16R2.2238 CC(=NNc1ccccc1)c2cocn2 4a_100015195140_100009869376 [0,1,0,0,0,1|1,0,1]=4 6964 B16R2.2238 CC(=NNc1ccccc1)c2cscn2 4a_100015195140_100000693406 [0,1,0,0,0,1|1,0,1]=4 6965 B16R2.2238 CC(=NNc1ccccn1)c2c[nH]cn2 4a_100000183288_100011246050 [0,1,0,0,0,1|1,0,1]=4 6966 B16R2.2238 CC(=NNc1cccnc1)c2c[nH]cn2 4a_100000728903_100011246050 [0,1,0,0,0,1|1,0,1]=4 6967 B16R2.2238 CC(=NNc1ccncc1)c2c[nH]cn2 4a_100000698918_100011246050 [0,1,0,0,0,1|1,0,1]=4 6968 B16R2.2238 CC(CNc1ccccc1)n2cncn2 34a_100000106764_200015185000 [0,1,0,0,0,1|1,0,1]=4 6969 B16R2.2238 CC(NCc1ccccc1)c2cc[nH]c2 269862a_100015324214_100000753940 [0,1,0,0,0,1|1,0,0]=3 6970 B16R2.2238 CC(NCc1ccccc1)c2ccc[nH]2 269862a_100015324214_100000183661 [0,1,0,0,0,1|1,0,1]=4 6971 B16R2.2238 CC(NCc1ccccc1)c2cccs2 207a_100000703493_100015611070 [0,1,0,0,0,1|2,0,0]=4 6972 B16R2.2238 CC(NCc1ccccc1)c2cccs2 2230a_100000703493_100015291786 [0,1,0,0,0,1|2,0,0]=4 6973 B16R2.2238 CC(NCc1ccccc1)c2cccs2 269862a_100015324214_100000185736 [0,1,0,0,0,1|2,0,0]=4 6974 B16R2.2238 CC(NCc1ccccc1)c2cccs2 270004a_100000703493_100015611070 [0,1,0,0,0,1|2,0,0]=4 6975 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 207a_100000690049_100015611070 [0,1,0,0,0,1|2,0,0]=4 6976 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 2230a_100000690049_100015291786 [0,1,0,0,0,1|2,0,0]=4 6977 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 270004a_100000690049_100015611070 [0,1,0,0,0,1|2,0,0]=4 6978 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 207a_100000748604_100015611070 [0,1,0,0,0,1|2,0,0]=4 6979 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 2230a_100000748604_100015291786 [0,1,0,0,0,1|2,0,0]=4 6980 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 269862a_100015324214_100000747891 [0,1,0,0,0,1|2,0,0]=4 6981 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 270004a_100000748604_100015611070 [0,1,0,0,0,1|2,0,0]=4 6982 B16R2.2238 CC(NCc1ccccc1)c2cn[nH]c2 269862a_100015324214_100000725364 [0,1,0,0,0,1|2,0,0]=4 6983 B16R2.2238 CC(NCc1ccccc1)c2cscn2 269862a_100015324214_100000693406 [0,1,0,0,0,1|1,0,0]=3 6984 B16R2.2238 CC(NCc1ccccc1)c2ncc[nH]2 269862a_100015324214_100000718901 [0,1,0,0,0,1|2,0,0]=4 6985 B16R2.2238 CC(NCc1ccccc1)c2nccs2 207a_100000725601_100015611070 [0,1,0,0,0,1|2,0,0]=4 6986 B16R2.2238 CC(NCc1ccccc1)c2nccs2 2230a_100000725601_100015291786 [0,1,0,0,0,1|2,0,0]=4 6987 B16R2.2238 CC(NCc1ccccc1)c2nccs2 270004a_100000725601_100015611070 [0,1,0,0,0,1|2,0,0]=4 6988 B16R2.2238 CC(NCc1cccnc1)c2cc[nH]c2 269862a_100000210453_100000753940 [0,1,0,0,0,1|2,0,0]=4 6989 B16R2.2238 CC(NCc1cccnc1)c2cscn2 269862a_100000210453_100000693406 [0,1,0,0,0,1|2,0,0]=4 6990 B16R2.2238 CC(NCc1ccncc1)c2cc[nH]c2 269862a_100000210450_100000753940 [0,1,0,0,0,1|2,0,0]=4 6991 B16R2.2238 CC(NCc1ccncc1)c2cscn2 269862a_100000210450_100000693406 [0,1,0,0,0,1|2,0,0]=4 6992 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 207a_100160469435_100015611070 [0,1,0,0,0,1|2,0,0]=4 6993 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 2230a_100160469435_100015291786 [0,1,0,0,0,1|2,0,0]=4 6994 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 270004a_100160469435_100015611070 [0,1,0,0,0,1|2,0,0]=4 6995 B16R2.2238 O=C(CNc1ccccc1)c2ccsc2 34a_100000106764_100011219462 [0,1,0,0,0,1|2,0,0]=4 6996 B16R2.2832 Brc1c[nH]c(c1)CNCc2ccccc2 270004a_100015324214_100000720742 [0,1,0,0,0,1|1,0,1]=4 6997 B16R2.2832 Brc1cc(c[nH]1)C=NNc2ccccc2 4a_100015195140_100009882863 [0,1,0,0,0,1|1,0,1]=4 6998 B16R2.2832 Brc1cc(cs1)CNCc2ccccc2 207a_100015324214_100000737087 [0,1,0,0,0,1|2,0,0]=4 6999 B16R2.2832 Brc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100000737087 [0,1,0,0,0,1|2,0,0]=4 7000 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 207a_100000708654_100015611070 [0,1,0,0,0,1|2,0,0]=4 7001 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000185145 [0,1,0,0,0,1|2,0,0]=4 7002 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 270004a_100000708654_100015611070 [0,1,0,0,0,1|2,0,0]=4 7003 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000185145 [0,1,0,0,0,1|2,0,0]=4 7004 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 34a_100000708654_100015291786 [0,1,0,0,0,1|2,0,0]=4 7005 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 207a_100000737305_100015611070 [0,1,0,0,0,1|2,0,0]=4 7006 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000179771 [0,1,0,0,0,1|2,0,0]=4 7007 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 2230a_100015324214_100000708592 [0,1,0,0,0,1|2,0,0]=4 7008 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 270004a_100000737305_100015611070 [0,1,0,0,0,1|2,0,0]=4 7009 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000179771 [0,1,0,0,0,1|2,0,0]=4 7010 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 34a_100015324214_100000708592 [0,1,0,0,0,1|2,0,0]=4 7011 B16R2.2832 Brc1cnc(s1)CNCc2ccccc2 207a_100016991807_100015611070 [0,1,0,0,0,1|2,0,0]=4 7012 B16R2.2832 Brc1cnc(s1)CNCc2ccccc2 270004a_100015324214_100000699580 [0,1,0,0,0,1|2,0,0]=4 7013 B16R2.2832 Brc1cnc(s1)CNCc2ccccc2 270004a_100016991807_100015611070 [0,1,0,0,0,1|2,0,0]=4 7014 B16R2.2832 Brc1coc(c1)CNCc2ccccc2 270004a_100015324214_100000747035 [0,1,0,0,0,1|2,0,0]=4 7015 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 207a_100000741024_100015611070 [0,1,0,0,0,1|2,0,0]=4 7016 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 207a_100015324214_100000211722 [0,1,0,0,0,1|2,0,0]=4 7017 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 2230a_100000741024_100015291786 [0,1,0,0,0,1|2,0,0]=4 7018 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 2230a_100015324214_100000746031 [0,1,0,0,0,1|2,0,0]=4 7019 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 270004a_100000741024_100015611070 [0,1,0,0,0,1|2,0,0]=4 7020 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 270004a_100015324214_100000211722 [0,1,0,0,0,1|2,0,0]=4 7021 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 34a_100000741024_100015291786 [0,1,0,0,0,1|2,0,0]=4 7022 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 34a_100015324214_100000746031 [0,1,0,0,0,1|2,0,0]=4 7023 B16R2.2832 Brc1csc(n1)CNCc2ccccc2 270004a_100015324214_100009816814 [0,1,0,0,0,1|2,0,0]=4 7024 B16R2.2832 Brc1nc(cs1)C=NNc2ccccc2 4a_100015195140_100009816748 [0,1,0,0,0,1|1,0,1]=4 7025 B16R2.2832 Brc1nc(cs1)CNCc2ccccc2 270004a_100015324214_100009816748 [0,1,0,0,0,1|1,0,0]=3 7026 B16R2.2832 Brc1nc(cs1)CNCc2ccccn2 270004a_100000210449_100009816748 [0,1,0,0,0,1|2,0,0]=4 7027 B16R2.2832 Brc1nc(cs1)CNCc2cccnc2 270004a_100000210453_100009816748 [0,1,0,0,0,1|2,0,0]=4 7028 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 207a_100000726991_100015611070 [0,1,0,0,0,1|1,0,1]=4 7029 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 2230a_100000726991_100015291786 [0,1,0,0,0,1|1,0,1]=4 7030 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 2230a_100015324214_100000717027 [0,1,0,0,0,1|1,0,1]=4 7031 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 270004a_100000726991_100015611070 [0,1,0,0,0,1|1,0,1]=4 7032 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 270004a_100015324214_100009814069 [0,1,0,0,0,1|1,0,1]=4 7033 B16R2.2832 Brc1ncc(s1)CNCc2ccccc2 34a_100015324214_100000717027 [0,1,0,0,0,1|1,0,1]=4 7034 B16R2.2832 Cc1c[nH]c(n1)CNCc2ccccc2 207a_100015324214_100000082322 [0,1,0,0,0,1|2,0,0]=4 7035 B16R2.2832 Cc1c[nH]c(n1)CNCc2ccccc2 270004a_100015324214_100000082322 [0,1,0,0,0,1|2,0,0]=4 7036 B16R2.2832 Cc1cc(cs1)CNCc2ccccc2 207a_100015324214_100011998532 [0,1,0,0,0,1|2,0,0]=4 7037 B16R2.2832 Cc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100011998532 [0,1,0,0,0,1|2,0,0]=4 7038 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 207a_100000745230_100015611070 [0,1,0,0,0,1|2,0,0]=4 7039 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 207a_100015324214_100011217994 [0,1,0,0,0,1|2,0,0]=4 7040 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 2230a_100000745230_100015291786 [0,1,0,0,0,1|2,0,0]=4 7041 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 2230a_100015324214_100000199038 [0,1,0,0,0,1|2,0,0]=4 7042 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 270004a_100000745230_100015611070 [0,1,0,0,0,1|2,0,0]=4 7043 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 270004a_100015324214_100011217994 [0,1,0,0,0,1|2,0,0]=4 7044 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 34a_100000745230_100015291786 [0,1,0,0,0,1|2,0,0]=4 7045 B16R2.2832 Cc1cc(no1)CNCc2ccccc2 34a_100015324214_100000199038 [0,1,0,0,0,1|2,0,0]=4 7046 B16R2.2832 Cc1cc(ns1)CNCc2ccccc2 207a_100015324214_200000100279 [0,1,0,0,0,1|2,0,0]=4 7047 B16R2.2832 Cc1cc(ns1)CNCc2ccccc2 270004a_100015324214_200000100279 [0,1,0,0,0,1|2,0,0]=4 7048 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 207a_100011194323_100015611070 [0,1,0,0,0,1|2,0,0]=4 7049 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000183696 [0,1,0,0,0,1|2,0,0]=4 7050 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 270004a_100011194323_100015611070 [0,1,0,0,0,1|2,0,0]=4 7051 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000183696 [0,1,0,0,0,1|2,0,0]=4 7052 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 34a_100011194323_100015291786 [0,1,0,0,0,1|2,0,0]=4 7053 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 207a_100000238518_100015611070 [0,1,0,0,0,1|2,0,0]=4 7054 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000211121 [0,1,0,0,0,1|2,0,0]=4 7055 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 2230a_100000238518_100015291786 [0,1,0,0,0,1|2,0,0]=4 7056 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 270004a_100000238518_100015611070 [0,1,0,0,0,1|2,0,0]=4 7057 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000211121 [0,1,0,0,0,1|2,0,0]=4 7058 B16R2.2832 Cc1cnc(o1)CNCc2ccccc2 207a_100138411809_100015611070 [0,1,0,0,0,1|2,0,0]=4 7059 B16R2.2832 Cc1cnc(o1)CNCc2ccccc2 2230a_100138411809_100015291786 [0,1,0,0,0,1|2,0,0]=4 7060 B16R2.2832 Cc1cnc(o1)CNCc2ccccc2 34a_100138411809_100015291786 [0,1,0,0,0,1|2,0,0]=4 7061 B16R2.2832 Cc1cnc(s1)CNCc2ccccc2 207a_100015324214_100011361622 [0,1,0,0,0,1|2,0,0]=4 7062 B16R2.2832 Cc1cnc(s1)CNCc2ccccc2 270004a_100015324214_100011361622 [0,1,0,0,0,1|2,0,0]=4 7063 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 207a_100015204214_100015611070 [0,1,0,0,0,1|2,0,0]=4 7064 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 207a_100015324214_100102525248 [0,1,0,0,0,1|2,0,0]=4 7065 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 2230a_100015204214_100015291786 [0,1,0,0,0,1|2,0,0]=4 7066 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 270004a_100015204214_100015611070 [0,1,0,0,0,1|2,0,0]=4 7067 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 270004a_100015324214_100102525248 [0,1,0,0,0,1|2,0,0]=4 7068 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 34a_100015204214_100015291786 [0,1,0,0,0,1|2,0,0]=4 7069 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 207a_100015183719_100015611070 [0,1,0,0,0,1|2,0,0]=4 7070 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 207a_100015324214_100000756994 [0,1,0,0,0,1|2,0,0]=4 7071 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 2230a_100015183719_100015291786 [0,1,0,0,0,1|2,0,0]=4 7072 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 270004a_100015183719_100015611070 [0,1,0,0,0,1|2,0,0]=4 7073 B16R2.2832 Cc1csc(n1)CNCc2ccccc2 270004a_100015324214_100000756994 [0,1,0,0,0,1|2,0,0]=4 7074 B16R2.2832 Cc1nc(c[nH]1)C=CCc2ccccc2 271570a_200016263579_100009814057 [0,1,0,0,0,1|1,0,1]=4 7075 B16R2.2832 Cc1nc(c[nH]1)C=NNc2ccccc2 4a_100015195140_100011219055 [0,1,0,0,0,1|0,0,1]=3 7076 B16R2.2832 Cc1nc(c[nH]1)C=NNc2ccccn2 4a_100000183288_100011219055 [0,1,0,0,0,1|1,0,1]=4 7077 B16R2.2832 Cc1nc(c[nH]1)C=NNc2cccnc2 4a_100000728903_100011219055 [0,1,0,0,0,1|1,0,1]=4 7078 B16R2.2832 Cc1nc(c[nH]1)C=NNc2ccncc2 4a_100000698918_100011219055 [0,1,0,0,0,1|1,0,1]=4 7079 B16R2.2832 Cc1nc(c[nH]1)CNCc2ccccc2 207a_100015324214_100011219055 [0,1,0,0,0,1|0,0,0]=2 7080 B16R2.2832 Cc1nc(c[nH]1)CNCc2cccnc2 207a_100000210453_100011219055 [0,1,0,0,0,1|1,0,0]=3 7081 B16R2.2832 Cc1nc(c[nH]1)CNCc2cncnc2 207a_100011243677_100011219055 [0,1,0,0,0,1|2,0,0]=4 7082 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccccc2 62a_100000765856_100009814057 [0,1,0,0,0,1|1,0,0]=3 7083 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccccc2 62a_100009814057_100011218657 [0,1,0,0,0,1|1,0,0]=3 7084 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccccn2 62a_100009814057_100015183660 [0,1,0,0,0,1|2,0,0]=4 7085 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccccn2 62a_100015183660_100009814057 [0,1,0,0,0,1|2,0,0]=4 7086 B16R2.2832 Cc1nc(c[nH]1)SCCc2cccnc2 62a_100009814057_200011713674 [0,1,0,0,0,1|2,0,0]=4 7087 B16R2.2832 Cc1nc(c[nH]1)SCCc2cccnc2 62a_200011713674_100009814057 [0,1,0,0,0,1|2,0,0]=4 7088 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccncc2 62a_100000723409_100009814057 [0,1,0,0,0,1|2,0,0]=4 7089 B16R2.2832 Cc1nc(c[nH]1)SCCc2ccncc2 62a_100009814057_100000723409 [0,1,0,0,0,1|2,0,0]=4 7090 B16R2.2832 Cc1nc(c[nH]1)SCSc2ccccc2 62a_100009814057_100011218342 [0,1,0,0,0,1|1,0,0]=3 7091 B16R2.2832 Cc1nc(c[nH]1)SCSc2ccccc2 62a_100011218342_100009814057 [0,1,0,0,0,1|1,0,0]=3 7092 B16R2.2832 Cc1nc(co1)C=NNc2ccccc2 4a_100015195140_100011361629 [0,1,0,0,0,1|1,0,1]=4 7093 B16R2.2832 Cc1nc(co1)CNCc2ccccc2 207a_100015324214_100011361629 [0,1,0,0,0,1|1,0,0]=3 7094 B16R2.2832 Cc1nc(co1)CNCc2ccccc2 270004a_100015324214_100011361629 [0,1,0,0,0,1|1,0,0]=3 7095 B16R2.2832 Cc1nc(co1)CNCc2ccccn2 270004a_100000210449_100011361629 [0,1,0,0,0,1|2,0,0]=4 7096 B16R2.2832 Cc1nc(co1)CNCc2cccnc2 207a_100000210453_100011361629 [0,1,0,0,0,1|2,0,0]=4 7097 B16R2.2832 Cc1nc(co1)CNCc2cccnc2 270004a_100000210453_100011361629 [0,1,0,0,0,1|2,0,0]=4 7098 B16R2.2832 Cc1nc(co1)COCc2ccccc2 34a_100012017233_100015291786 [0,1,0,0,0,1|2,0,0]=4 7099 B16R2.2832 Cc1nc(cs1)C=NNc2ccccc2 4a_100015195140_100000203724 [0,1,0,0,0,1|1,0,1]=4 7100 B16R2.2832 Cc1nc(cs1)CCNc2ccccc2 34a_100000106764_100000695623 [0,1,0,0,0,1|1,0,0]=3 7101 B16R2.2832 Cc1nc(cs1)CCOc2ccccc2 34a_100000210340_100000695623 [0,1,0,0,0,1|2,0,0]=4 7102 B16R2.2832 Cc1nc(cs1)CCOc2ccccc2 7a_100000210340_100000695623 [0,1,0,0,0,1|2,0,0]=4 7103 B16R2.2832 Cc1nc(cs1)CCSc2ccccc2 62a_100000695623_100000041952 [0,1,0,0,0,1|2,0,0]=4 7104 B16R2.2832 Cc1nc(cs1)CCSc2ccccc2 62a_100000719477_100000695623 [0,1,0,0,0,1|2,0,0]=4 7105 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 207a_100000707933_100015611070 [0,1,0,0,0,1|1,0,0]=3 7106 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 207a_100015324214_100000203724 [0,1,0,0,0,1|1,0,0]=3 7107 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 2230a_100015324214_100015186478 [0,1,0,0,0,1|1,0,0]=3 7108 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 270004a_100015324214_100000203724 [0,1,0,0,0,1|1,0,0]=3 7109 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 34a_100000707933_100015291786 [0,1,0,0,0,1|1,0,0]=3 7110 B16R2.2832 Cc1nc(cs1)CNCc2ccccc2 34a_100015324214_100015186478 [0,1,0,0,0,1|1,0,0]=3 7111 B16R2.2832 Cc1nc(cs1)CNCc2ccccn2 207a_100000707933_100000209966 [0,1,0,0,0,1|2,0,0]=4 7112 B16R2.2832 Cc1nc(cs1)CNCc2ccccn2 270004a_100000210449_100000203724 [0,1,0,0,0,1|2,0,0]=4 7113 B16R2.2832 Cc1nc(cs1)CNCc2ccccn2 34a_100000707933_100000721315 [0,1,0,0,0,1|2,0,0]=4 7114 B16R2.2832 Cc1nc(cs1)CNCc2cccnc2 207a_100000210453_100000203724 [0,1,0,0,0,1|2,0,0]=4 7115 B16R2.2832 Cc1nc(cs1)CNCc2cccnc2 207a_100000707933_100000209961 [0,1,0,0,0,1|2,0,0]=4 7116 B16R2.2832 Cc1nc(cs1)CNCc2cccnc2 270004a_100000210453_100000203724 [0,1,0,0,0,1|2,0,0]=4 7117 B16R2.2832 Cc1nc(cs1)CNCc2cccnc2 34a_100000707933_100000733263 [0,1,0,0,0,1|2,0,0]=4 7118 B16R2.2832 Cc1nc(cs1)CNCc2ccncc2 207a_100000707933_100000186114 [0,1,0,0,0,1|2,0,0]=4 7119 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 34a_100000210790_100015186478 [0,1,0,0,0,1|2,0,0]=4 7120 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 34a_100000735831_100015291786 [0,1,0,0,0,1|2,0,0]=4 7121 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 7a_100000210790_100015186478 [0,1,0,0,0,1|2,0,0]=4 7122 B16R2.2832 Cc1nc(cs1)CSCc2ccccc2 62a_100000211182_100015186478 [0,1,0,0,0,1|2,0,0]=4 7123 B16R2.2832 Cc1nc(cs1)CSCc2ccccc2 62a_100015186478_100015291786 [0,1,0,0,0,1|2,0,0]=4 7124 B16R2.2832 Cc1nc(cs1)SCCc2ccccc2 62a_100000765856_100011934587 [0,1,0,0,0,1|2,0,0]=4 7125 B16R2.2832 Cc1nc(cs1)SCCc2ccccc2 62a_100011934587_100011218657 [0,1,0,0,0,1|2,0,0]=4 7126 B16R2.2832 Cc1nc(cs1)SCSc2ccccc2 62a_100011218342_100011934587 [0,1,0,0,0,1|2,0,0]=4 7127 B16R2.2832 Cc1nc(cs1)SCSc2ccccc2 62a_100011934587_100011218342 [0,1,0,0,0,1|2,0,0]=4 7128 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccccc2 207a_100000752542_100015611070 [0,1,0,0,0,1|1,0,0]=3 7129 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccccc2 2230a_100000752542_100015291786 [0,1,0,0,0,1|1,0,0]=3 7130 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccccn2 207a_100000752542_100000209966 [0,1,0,0,0,1|2,0,0]=4 7131 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccccn2 2230a_100000752542_100000721315 [0,1,0,0,0,1|2,0,0]=4 7132 B16R2.2832 Cc1nc(n[nH]1)CNCc2cccnc2 207a_100000752542_100000209961 [0,1,0,0,0,1|2,0,0]=4 7133 B16R2.2832 Cc1nc(n[nH]1)CNCc2cccnc2 2230a_100000752542_100000741622 [0,1,0,0,0,1|2,0,0]=4 7134 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccncc2 207a_100000752542_100000186114 [0,1,0,0,0,1|2,0,0]=4 7135 B16R2.2832 Cc1nc(n[nH]1)CNCc2ccncc2 2230a_100000752542_100015193705 [0,1,0,0,0,1|2,0,0]=4 7136 B16R2.2832 Cc1nc(n[nH]1)SCCc2ccccc2 62a_100000732540_100011218657 [0,1,0,0,0,1|2,0,0]=4 7137 B16R2.2832 Cc1nc(n[nH]1)SCCc2ccccc2 62a_100000765856_100000732540 [0,1,0,0,0,1|2,0,0]=4 7138 B16R2.2832 Cc1nc(n[nH]1)SCSc2ccccc2 62a_100000732540_100011218342 [0,1,0,0,0,1|2,0,0]=4 7139 B16R2.2832 Cc1nc(n[nH]1)SCSc2ccccc2 62a_100011218342_100000732540 [0,1,0,0,0,1|2,0,0]=4 7140 B16R2.2832 Cc1nc(no1)CNCc2ccccc2 2230a_100015324214_100000231061 [0,1,0,0,0,1|2,0,0]=4 7141 B16R2.2832 Cc1nc(no1)CNCc2ccccc2 34a_100015324214_100000231061 [0,1,0,0,0,1|2,0,0]=4 7142 B16R2.2832 Cc1ncc(o1)CNCc2ccccc2 207a_100015324214_100000084308 [0,1,0,0,0,1|1,0,1]=4 7143 B16R2.2832 Cc1ncc(o1)CNCc2ccccc2 270004a_100015324214_100000084308 [0,1,0,0,0,1|1,0,1]=4 7144 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 207a_100015324214_100000740557 [0,1,0,0,0,1|1,0,1]=4 7145 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 207a_200000743601_100015611070 [0,1,0,0,0,1|1,0,1]=4 7146 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 2230a_100015324214_100020635045 [0,1,0,0,0,1|1,0,1]=4 7147 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 2230a_200000743601_100015291786 [0,1,0,0,0,1|1,0,1]=4 7148 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 270004a_100015324214_100000740557 [0,1,0,0,0,1|1,0,1]=4 7149 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 270004a_200000743601_100015611070 [0,1,0,0,0,1|1,0,1]=4 7150 B16R2.2832 Cc1ncc(s1)CNCc2ccccc2 34a_100015324214_100020635045 [0,1,0,0,0,1|1,0,1]=4 7151 B16R2.2832 Cc1noc(n1)CNCc2ccccc2 2230a_100015324214_100000735555 [0,1,0,0,0,1|1,0,1]=4 7152 B16R2.2832 Cc1noc(n1)CNCc2ccccc2 34a_100015324214_100000735555 [0,1,0,0,0,1|1,0,1]=4 7153 B16R2.2832 Clc1cc(cs1)CNCc2ccccc2 207a_100015324214_100009844934 [0,1,0,0,0,1|2,0,0]=4 7154 B16R2.2832 Clc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100009844934 [0,1,0,0,0,1|2,0,0]=4 7155 B16R2.2832 Clc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000188459 [0,1,0,0,0,1|2,0,0]=4 7156 B16R2.2832 Clc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000188459 [0,1,0,0,0,1|2,0,0]=4 7157 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 207a_100000737310_100015611070 [0,1,0,0,0,1|2,0,0]=4 7158 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000242774 [0,1,0,0,0,1|2,0,0]=4 7159 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 2230a_100000737310_100015291786 [0,1,0,0,0,1|2,0,0]=4 7160 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 2230a_100015324214_100000185097 [0,1,0,0,0,1|2,0,0]=4 7161 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 270004a_100000737310_100015611070 [0,1,0,0,0,1|2,0,0]=4 7162 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000242774 [0,1,0,0,0,1|2,0,0]=4 7163 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 34a_100015324214_100000185097 [0,1,0,0,0,1|2,0,0]=4 7164 B16R2.2832 Clc1cnc(s1)CNCc2ccccc2 270004a_100015324214_100000699884 [0,1,0,0,0,1|2,0,0]=4 7165 B16R2.2832 Clc1csc(c1)CNCc2ccccc2 207a_100015324214_100000102487 [0,1,0,0,0,1|2,0,0]=4 7166 B16R2.2832 Clc1csc(c1)CNCc2ccccc2 270004a_100015324214_100000102487 [0,1,0,0,0,1|2,0,0]=4 7167 B16R2.2832 Clc1nc(cs1)C=NNc2ccccc2 4a_100015195140_100011935135 [0,1,0,0,0,1|1,0,1]=4 7168 B16R2.2832 Clc1nc(cs1)CNCc2ccccc2 2230a_100015324214_100000024076 [0,1,0,0,0,1|1,0,0]=3 7169 B16R2.2832 Clc1nc(cs1)CNCc2ccccc2 270004a_100015324214_100011935135 [0,1,0,0,0,1|1,0,0]=3 7170 B16R2.2832 Clc1nc(cs1)CNCc2ccccc2 34a_100015324214_100000024076 [0,1,0,0,0,1|1,0,0]=3 7171 B16R2.2832 Clc1nc(cs1)CNCc2ccccn2 270004a_100000210449_100011935135 [0,1,0,0,0,1|2,0,0]=4 7172 B16R2.2832 Clc1nc(cs1)CNCc2cccnc2 270004a_100000210453_100011935135 [0,1,0,0,0,1|2,0,0]=4 7173 B16R2.2832 Clc1nc(cs1)COCc2ccccc2 34a_100000210790_100000024076 [0,1,0,0,0,1|2,0,0]=4 7174 B16R2.2832 Clc1nc(cs1)COCc2ccccc2 7a_100000210790_100000024076 [0,1,0,0,0,1|2,0,0]=4 7175 B16R2.2832 Clc1nc(cs1)CSCc2ccccc2 62a_100000024076_100015291786 [0,1,0,0,0,1|2,0,0]=4 7176 B16R2.2832 Clc1nc(cs1)CSCc2ccccc2 62a_100000211182_100000024076 [0,1,0,0,0,1|2,0,0]=4 7177 B16R2.2832 Clc1nc(ns1)CNCc2ccccc2 2230a_100015324214_100000043760 [0,1,0,0,0,1|2,0,0]=4 7178 B16R2.2832 Clc1nc(ns1)CNCc2ccccc2 34a_100015324214_100000043760 [0,1,0,0,0,1|2,0,0]=4 7179 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 207a_100000726635_100015611070 [0,1,0,0,0,1|1,0,1]=4 7180 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 2230a_100000726635_100015291786 [0,1,0,0,0,1|1,0,1]=4 7181 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 2230a_100015324214_100000058068 [0,1,0,0,0,1|1,0,1]=4 7182 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 270004a_100000726635_100015611070 [0,1,0,0,0,1|1,0,1]=4 7183 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 270004a_100015324214_100000696999 [0,1,0,0,0,1|1,0,1]=4 7184 B16R2.2832 Clc1ncc(s1)CNCc2ccccc2 34a_100015324214_100000058068 [0,1,0,0,0,1|1,0,1]=4 7185 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 207a_100000744365_100015611070 [0,1,0,0,0,1|2,0,0]=4 7186 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 207a_100015324214_100000206001 [0,1,0,0,0,1|2,0,0]=4 7187 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 2230a_100015324214_100000744441 [0,1,0,0,0,1|2,0,0]=4 7188 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 270004a_100000744365_100015611070 [0,1,0,0,0,1|2,0,0]=4 7189 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 270004a_100015324214_100000206001 [0,1,0,0,0,1|2,0,0]=4 7190 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 34a_100000744365_100015291786 [0,1,0,0,0,1|2,0,0]=4 7191 B16R2.2832 Cn1cc(cn1)CNCc2ccccc2 34a_100015324214_100000744441 [0,1,0,0,0,1|2,0,0]=4 7192 B16R2.2832 Cn1cc(nn1)C=NNc2ccccc2 4a_100015195140_100000749909 [0,1,0,0,0,1|1,0,1]=4 7193 B16R2.2832 Cn1cc(nn1)CCCc2ccccc2 274090a_200000210301_100000034183 [0,1,0,0,0,1|2,0,0]=4 7194 B16R2.2832 Cn1cc(nn1)CNCc2ccccc2 207a_100015324214_100000749909 [0,1,0,0,0,1|1,0,0]=3 7195 B16R2.2832 Cn1cc(nn1)CNCc2ccccc2 270004a_100015324214_100000749909 [0,1,0,0,0,1|1,0,0]=3 7196 B16R2.2832 Cn1cc(nn1)CNCc2ccccc2 274090a_200000210301_100000730907 [0,1,0,0,0,1|1,0,0]=3 7197 B16R2.2832 Cn1cc(nn1)CNCc2ccccn2 270004a_100000210449_100000749909 [0,1,0,0,0,1|2,0,0]=4 7198 B16R2.2832 Cn1cc(nn1)CNCc2cccnc2 207a_100000210453_100000749909 [0,1,0,0,0,1|2,0,0]=4 7199 B16R2.2832 Cn1cc(nn1)CNCc2cccnc2 270004a_100000210453_100000749909 [0,1,0,0,0,1|2,0,0]=4 7200 B16R2.2832 Cn1cc(nn1)COCc2ccccc2 274090a_200000210301_100000054601 [0,1,0,0,0,1|2,0,0]=4 7201 B16R2.2832 Cn1cc(nn1)SCCc2ccccc2 62a_100000760339_100011218657 [0,1,0,0,0,1|2,0,0]=4 7202 B16R2.2832 Cn1cc(nn1)SCCc2ccccc2 62a_100000765856_100000760339 [0,1,0,0,0,1|2,0,0]=4 7203 B16R2.2832 Cn1cc(nn1)SCSc2ccccc2 62a_100000760339_100011218342 [0,1,0,0,0,1|2,0,0]=4 7204 B16R2.2832 Cn1cc(nn1)SCSc2ccccc2 62a_100011218342_100000760339 [0,1,0,0,0,1|2,0,0]=4 7205 B16R2.2832 Cn1ccc(c1)C=NNc2ccccc2 4a_100015195140_100000765639 [0,1,0,0,0,1|1,0,1]=4 7206 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 207a_100015324214_100000750880 [0,1,0,0,0,1|2,0,0]=4 7207 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 207a_100020636201_100015611070 [0,1,0,0,0,1|2,0,0]=4 7208 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 2230a_100015324214_100000726502 [0,1,0,0,0,1|2,0,0]=4 7209 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 2230a_100020636201_100015291786 [0,1,0,0,0,1|2,0,0]=4 7210 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 270004a_100015324214_100000750880 [0,1,0,0,0,1|2,0,0]=4 7211 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 270004a_100020636201_100015611070 [0,1,0,0,0,1|2,0,0]=4 7212 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 34a_100015324214_100000726502 [0,1,0,0,0,1|2,0,0]=4 7213 B16R2.2832 Cn1ccc(n1)CNCc2ccccc2 34a_100020636201_100015291786 [0,1,0,0,0,1|2,0,0]=4 7214 B16R2.2832 Cn1cnc(c1)C=CCc2ccccc2 271570a_200016263579_100000040308 [0,1,0,0,0,1|1,0,1]=4 7215 B16R2.2832 Cn1cnc(c1)C=NNc2ccccc2 4a_100015195140_100000684808 [0,1,0,0,0,1|0,0,1]=3 7216 B16R2.2832 Cn1cnc(c1)C=NNc2ccccn2 4a_100000183288_100000684808 [0,1,0,0,0,1|1,0,1]=4 7217 B16R2.2832 Cn1cnc(c1)C=NNc2cccnc2 4a_100000728903_100000684808 [0,1,0,0,0,1|1,0,1]=4 7218 B16R2.2832 Cn1cnc(c1)C=NNc2ccncc2 4a_100000698918_100000684808 [0,1,0,0,0,1|1,0,1]=4 7219 B16R2.2832 Cn1cnc(c1)CCNc2cccnn2 27a_106430523030_100016991348 [0,1,0,0,0,1|2,0,0]=4 7220 B16R2.2832 Cn1cnc(c1)CCNc2ccncn2 27a_106430523030_100000703185 [0,1,0,0,0,1|2,0,0]=4 7221 B16R2.2832 Cn1cnc(c1)CCNc2cnccn2 27a_106430523030_100000211759 [0,1,0,0,0,1|2,0,0]=4 7222 B16R2.2832 Cn1cnc(c1)CCNc2ncccn2 27a_106430523030_100000211032 [0,1,0,0,0,1|2,0,0]=4 7223 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 207a_100011834058_100015611070 [0,1,0,0,0,1|0,0,0]=2 7224 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 207a_100015324214_100000684808 [0,1,0,0,0,1|0,0,0]=2 7225 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 2230a_100015324214_100000717665 [0,1,0,0,0,1|0,0,0]=2 7226 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 270004a_100011834058_100015611070 [0,1,0,0,0,1|0,0,0]=2 7227 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 270004a_100015324214_100000684808 [0,1,0,0,0,1|0,0,0]=2 7228 B16R2.2832 Cn1cnc(c1)CNCc2ccccc2 34a_100015324214_100000717665 [0,1,0,0,0,1|0,0,0]=2 7229 B16R2.2832 Cn1cnc(c1)CNCc2ccccn2 207a_100011834058_100000209966 [0,1,0,0,0,1|1,0,0]=3 7230 B16R2.2832 Cn1cnc(c1)CNCc2ccccn2 270004a_100000210449_100000684808 [0,1,0,0,0,1|1,0,0]=3 7231 B16R2.2832 Cn1cnc(c1)CNCc2ccccn2 270004a_100011834058_100000209966 [0,1,0,0,0,1|1,0,0]=3 7232 B16R2.2832 Cn1cnc(c1)CNCc2cccnc2 207a_100000210453_100000684808 [0,1,0,0,0,1|1,0,0]=3 7233 B16R2.2832 Cn1cnc(c1)CNCc2cccnc2 207a_100011834058_100000209961 [0,1,0,0,0,1|1,0,0]=3 7234 B16R2.2832 Cn1cnc(c1)CNCc2cccnc2 270004a_100000210453_100000684808 [0,1,0,0,0,1|1,0,0]=3 7235 B16R2.2832 Cn1cnc(c1)CNCc2cccnc2 270004a_100011834058_100000209961 [0,1,0,0,0,1|1,0,0]=3 7236 B16R2.2832 Cn1cnc(c1)CNCc2cccnn2 2230a_100159270163_100000717665 [0,1,0,0,0,1|2,0,0]=4 7237 B16R2.2832 Cn1cnc(c1)CNCc2ccncc2 207a_100011834058_100000186114 [0,1,0,0,0,1|1,0,0]=3 7238 B16R2.2832 Cn1cnc(c1)CNCc2ccnnc2 270004a_100011834058_100011934578 [0,1,0,0,0,1|2,0,0]=4 7239 B16R2.2832 Cn1cnc(c1)CNCc2cnccn2 270004a_100011834058_100000749867 [0,1,0,0,0,1|2,0,0]=4 7240 B16R2.2832 Cn1cnc(c1)CNCc2cncnc2 207a_100011243677_100000684808 [0,1,0,0,0,1|2,0,0]=4 7241 B16R2.2832 Cn1cnc(c1)CNCc2cncnc2 2230a_100011243677_100000717665 [0,1,0,0,0,1|2,0,0]=4 7242 B16R2.2832 Cn1cnc(c1)CNCc2cncnc2 270004a_100011243677_100000684808 [0,1,0,0,0,1|2,0,0]=4 7243 B16R2.2832 Cn1cnc(c1)CNCc2cncnc2 270004a_100011834058_100000749868 [0,1,0,0,0,1|2,0,0]=4 7244 B16R2.2832 Cn1cnc(c1)CNCc2ncccn2 270004a_100011834058_100011532527 [0,1,0,0,0,1|2,0,0]=4 7245 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 34a_100000210790_100000717665 [0,1,0,0,0,1|1,0,0]=3 7246 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 34a_100000710007_100015291786 [0,1,0,0,0,1|1,0,0]=3 7247 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 7a_100000210790_100000717665 [0,1,0,0,0,1|1,0,0]=3 7248 B16R2.2832 Cn1cnc(c1)COCc2ccccn2 34a_100000710007_100000721315 [0,1,0,0,0,1|2,0,0]=4 7249 B16R2.2832 Cn1cnc(c1)COCc2cccnc2 34a_100000710007_100000733263 [0,1,0,0,0,1|2,0,0]=4 7250 B16R2.2832 Cn1cnc(c1)CSCc2ccccc2 62a_100000211182_100000717665 [0,1,0,0,0,1|1,0,0]=3 7251 B16R2.2832 Cn1cnc(c1)CSCc2ccccc2 62a_100000717665_100015291786 [0,1,0,0,0,1|1,0,0]=3 7252 B16R2.2832 Cn1cnc(c1)CSCc2ccccn2 62a_100000717665_100000721315 [0,1,0,0,0,1|2,0,0]=4 7253 B16R2.2832 Cn1cnc(c1)CSCc2ccccn2 62a_100000721315_100000717665 [0,1,0,0,0,1|2,0,0]=4 7254 B16R2.2832 Cn1cnc(c1)CSCc2cccnc2 62a_100000717665_100000741622 [0,1,0,0,0,1|2,0,0]=4 7255 B16R2.2832 Cn1cnc(c1)CSCc2cccnc2 62a_100000741622_100000717665 [0,1,0,0,0,1|2,0,0]=4 7256 B16R2.2832 Cn1cnc(c1)CSCc2ccncc2 62a_100000717665_100015193705 [0,1,0,0,0,1|2,0,0]=4 7257 B16R2.2832 Cn1cnc(c1)CSCc2ccncc2 62a_100015193705_100000717665 [0,1,0,0,0,1|2,0,0]=4 7258 B16R2.2832 Cn1cnc(c1)SCCc2ccccc2 62a_100000040308_100011218657 [0,1,0,0,0,1|1,0,0]=3 7259 B16R2.2832 Cn1cnc(c1)SCCc2ccccc2 62a_100000765856_100000040308 [0,1,0,0,0,1|1,0,0]=3 7260 B16R2.2832 Cn1cnc(c1)SCCc2ccccn2 62a_100000040308_100015183660 [0,1,0,0,0,1|2,0,0]=4 7261 B16R2.2832 Cn1cnc(c1)SCCc2ccccn2 62a_100015183660_100000040308 [0,1,0,0,0,1|2,0,0]=4 7262 B16R2.2832 Cn1cnc(c1)SCCc2cccnc2 62a_100000040308_200011713674 [0,1,0,0,0,1|2,0,0]=4 7263 B16R2.2832 Cn1cnc(c1)SCCc2cccnc2 62a_200011713674_100000040308 [0,1,0,0,0,1|2,0,0]=4 7264 B16R2.2832 Cn1cnc(c1)SCCc2ccncc2 62a_100000040308_100000723409 [0,1,0,0,0,1|2,0,0]=4 7265 B16R2.2832 Cn1cnc(c1)SCCc2ccncc2 62a_100000723409_100000040308 [0,1,0,0,0,1|2,0,0]=4 7266 B16R2.2832 Cn1cnc(c1)SCSc2ccccc2 62a_100000040308_100011218342 [0,1,0,0,0,1|1,0,0]=3 7267 B16R2.2832 Cn1cnc(c1)SCSc2ccccc2 62a_100011218342_100000040308 [0,1,0,0,0,1|1,0,0]=3 7268 B16R2.2832 Cn1cnc(n1)C=NNc2ccccc2 4a_100015195140_100010630104 [0,1,0,0,0,1|1,0,1]=4 7269 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 207a_100000695864_100015611070 [0,1,0,0,0,1|1,0,0]=3 7270 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 207a_100015324214_100010630104 [0,1,0,0,0,1|1,0,0]=3 7271 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 2230a_100000695864_100015291786 [0,1,0,0,0,1|1,0,0]=3 7272 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 2230a_100015324214_100016995526 [0,1,0,0,0,1|1,0,0]=3 7273 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 270004a_100015324214_100010630104 [0,1,0,0,0,1|1,0,0]=3 7274 B16R2.2832 Cn1cnc(n1)CNCc2ccccc2 34a_100015324214_100016995526 [0,1,0,0,0,1|1,0,0]=3 7275 B16R2.2832 Cn1cnc(n1)CNCc2ccccn2 207a_100000695864_100000209966 [0,1,0,0,0,1|2,0,0]=4 7276 B16R2.2832 Cn1cnc(n1)CNCc2ccccn2 2230a_100000695864_100000721315 [0,1,0,0,0,1|2,0,0]=4 7277 B16R2.2832 Cn1cnc(n1)CNCc2ccccn2 270004a_100000210449_100010630104 [0,1,0,0,0,1|2,0,0]=4 7278 B16R2.2832 Cn1cnc(n1)CNCc2cccnc2 207a_100000210453_100010630104 [0,1,0,0,0,1|2,0,0]=4 7279 B16R2.2832 Cn1cnc(n1)CNCc2cccnc2 207a_100000695864_100000209961 [0,1,0,0,0,1|2,0,0]=4 7280 B16R2.2832 Cn1cnc(n1)CNCc2cccnc2 2230a_100000695864_100000741622 [0,1,0,0,0,1|2,0,0]=4 7281 B16R2.2832 Cn1cnc(n1)CNCc2cccnc2 270004a_100000210453_100010630104 [0,1,0,0,0,1|2,0,0]=4 7282 B16R2.2832 Cn1cnc(n1)CNCc2ccncc2 207a_100000695864_100000186114 [0,1,0,0,0,1|2,0,0]=4 7283 B16R2.2832 Cn1cnc(n1)CNCc2ccncc2 2230a_100000695864_100015193705 [0,1,0,0,0,1|2,0,0]=4 7284 B16R2.2832 Cn1cnc(n1)COCc2ccccc2 34a_100000210790_100016995526 [0,1,0,0,0,1|2,0,0]=4 7285 B16R2.2832 Cn1cnc(n1)COCc2ccccc2 7a_100000210790_100016995526 [0,1,0,0,0,1|2,0,0]=4 7286 B16R2.2832 Cn1cnc(n1)CSCc2ccccc2 62a_100000211182_100016995526 [0,1,0,0,0,1|2,0,0]=4 7287 B16R2.2832 Cn1cnc(n1)CSCc2ccccc2 62a_100016995526_100015291786 [0,1,0,0,0,1|2,0,0]=4 7288 B16R2.2832 Cn1cnc(n1)SCCc2ccccc2 62a_100000765856_100009819955 [0,1,0,0,0,1|2,0,0]=4 7289 B16R2.2832 Cn1cnc(n1)SCCc2ccccc2 62a_100009819955_100011218657 [0,1,0,0,0,1|2,0,0]=4 7290 B16R2.2832 Cn1cnc(n1)SCSc2ccccc2 62a_100009819955_100011218342 [0,1,0,0,0,1|2,0,0]=4 7291 B16R2.2832 Cn1cnc(n1)SCSc2ccccc2 62a_100011218342_100009819955 [0,1,0,0,0,1|2,0,0]=4 7292 B16R2.2832 Ic1ccc(o1)CNCc2ccccc2 207a_100015324214_100000186757 [0,1,0,0,0,1|2,0,0]=4 7293 B16R2.2832 Ic1csc(c1)CNCc2ccccc2 207a_100015324214_100010179861 [0,1,0,0,0,1|2,0,0]=4 7294 B16R2.2832 Nc1nc(cs1)SCCc2ccccc2 62a_100000765856_100011998049 [0,1,0,0,0,1|2,0,0]=4 7295 B16R2.2832 Nc1nc(cs1)SCCc2ccccc2 62a_100011998049_100011218657 [0,1,0,0,0,1|2,0,0]=4 7296 B16R2.2832 Nc1nc(cs1)SCSc2ccccc2 62a_100011218342_100011998049 [0,1,0,0,0,1|2,0,0]=4 7297 B16R2.2832 Nc1nc(cs1)SCSc2ccccc2 62a_100011998049_100011218342 [0,1,0,0,0,1|2,0,0]=4 7298 B16R2.2832 Nc1nc(n[nH]1)SCCc2ccccc2 62a_100000765856_100015184587 [0,1,0,0,0,1|2,0,0]=4 7299 B16R2.2832 Nc1nc(n[nH]1)SCCc2ccccc2 62a_100015184587_100011218657 [0,1,0,0,0,1|2,0,0]=4 7300 B16R2.2832 Nc1nc(n[nH]1)SCSc2ccccc2 62a_100011218342_100015184587 [0,1,0,0,0,1|2,0,0]=4 7301 B16R2.2832 Nc1nc(n[nH]1)SCSc2ccccc2 62a_100015184587_100011218342 [0,1,0,0,0,1|2,0,0]=4 7302 B16R2.2832 O=c1[nH]nc([nH]1)CNCc2ccccc2 2230a_100000766346_100015291786 [0,1,0,0,0,1|1,0,1]=4 7303 B16R2.2832 O=c1[nH]nc([nH]1)CNCc2ccccc2 2230a_100015324214_100000754189 [0,1,0,0,0,1|1,0,1]=4 7304 B16R2.2832 [13CH3]n1cc(nn1)CCCc2ccccc2 274090a_200025704644_100000034183 [0,1,0,0,0,1|2,0,0]=4 7305 B16R2.2832 [13CH3]n1cc(nn1)CNCc2ccccc2 274090a_200025704644_100000730907 [0,1,0,0,0,1|1,0,0]=3 7306 B16R2.2832 [13CH3]n1cc(nn1)COCc2ccccc2 274090a_200025704644_100000054601 [0,1,0,0,0,1|2,0,0]=4 7307 B16R2.2959 Brc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100012161201 [0,1,0,0,0,1|1,0,0]=3 7308 B16R2.2959 Brc1ccccc1CCSc2c[nH]cn2 62a_100012161201_100000756875 [0,1,0,0,0,1|1,0,0]=3 7309 B16R2.2959 Brc1ccccc1CCSc2c[nH]nn2 62a_100009819707_100012161201 [0,1,0,0,0,1|2,0,0]=4 7310 B16R2.2959 Brc1ccccc1CCSc2c[nH]nn2 62a_100012161201_100009819707 [0,1,0,0,0,1|2,0,0]=4 7311 B16R2.2959 Brc1ccccc1CCSc2cscn2 62a_100000751502_100012161201 [0,1,0,0,0,1|2,0,0]=4 7312 B16R2.2959 Brc1ccccc1CCSc2cscn2 62a_100012161201_100000751502 [0,1,0,0,0,1|2,0,0]=4 7313 B16R2.2959 Brc1ccccc1CCSc2nc[nH]n2 62a_100000761765_100012161201 [0,1,0,0,0,1|2,0,0]=4 7314 B16R2.2959 Brc1ccccc1CCSc2nc[nH]n2 62a_100012161201_100000761765 [0,1,0,0,0,1|2,0,0]=4 7315 B16R2.2959 Brc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000211189 [0,1,0,0,0,1|0,0,0]=2 7316 B16R2.2959 Brc1ccccc1CNCc2c[nH]cn2 2230a_100000689332_100000707719 [0,1,0,0,0,1|0,0,0]=2 7317 B16R2.2959 Brc1ccccc1CNCc2c[nH]cn2 34a_100000689332_100000707719 [0,1,0,0,0,1|0,0,0]=2 7318 B16R2.2959 Brc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000211189 [0,1,0,0,0,1|1,0,0]=3 7319 B16R2.2959 Brc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000211189 [0,1,0,0,0,1|1,0,0]=3 7320 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 207a_100000689332_100000738523 [0,1,0,0,0,1|2,0,0]=4 7321 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000211189 [0,1,0,0,0,1|2,0,0]=4 7322 B16R2.2959 Brc1ccccc1CNCc2cc[nH]n2 270004a_100000689332_100000738523 [0,1,0,0,0,1|2,0,0]=4 7323 B16R2.2959 Brc1ccccc1CNCc2ccco2 207a_100000185738_100000211189 [0,1,0,0,0,1|2,0,0]=4 7324 B16R2.2959 Brc1ccccc1CNCc2ccco2 207a_100000689332_100000186105 [0,1,0,0,0,1|2,0,0]=4 7325 B16R2.2959 Brc1ccccc1CNCc2ccco2 2230a_100000185738_100000184730 [0,1,0,0,0,1|2,0,0]=4 7326 B16R2.2959 Brc1ccccc1CNCc2ccco2 270004a_100000185738_100000211189 [0,1,0,0,0,1|2,0,0]=4 7327 B16R2.2959 Brc1ccccc1CNCc2ccco2 270004a_100000689332_100000186105 [0,1,0,0,0,1|2,0,0]=4 7328 B16R2.2959 Brc1ccccc1CNCc2ccco2 34a_100000185738_100000184730 [0,1,0,0,0,1|2,0,0]=4 7329 B16R2.2959 Brc1ccccc1CNCc2cccs2 207a_100000211653_100000211189 [0,1,0,0,0,1|2,0,0]=4 7330 B16R2.2959 Brc1ccccc1CNCc2cccs2 207a_100000689332_100000209959 [0,1,0,0,0,1|2,0,0]=4 7331 B16R2.2959 Brc1ccccc1CNCc2cccs2 2230a_100000211653_100000184730 [0,1,0,0,0,1|2,0,0]=4 7332 B16R2.2959 Brc1ccccc1CNCc2cccs2 270004a_100000211653_100000211189 [0,1,0,0,0,1|2,0,0]=4 7333 B16R2.2959 Brc1ccccc1CNCc2cccs2 270004a_100000689332_100000209959 [0,1,0,0,0,1|2,0,0]=4 7334 B16R2.2959 Brc1ccccc1CNCc2ccoc2 207a_100000689332_100011215517 [0,1,0,0,0,1|2,0,0]=4 7335 B16R2.2959 Brc1ccccc1CNCc2ccoc2 207a_100015206860_100000211189 [0,1,0,0,0,1|2,0,0]=4 7336 B16R2.2959 Brc1ccccc1CNCc2ccoc2 2230a_100015206860_100000184730 [0,1,0,0,0,1|2,0,0]=4 7337 B16R2.2959 Brc1ccccc1CNCc2ccoc2 270004a_100000689332_100011215517 [0,1,0,0,0,1|2,0,0]=4 7338 B16R2.2959 Brc1ccccc1CNCc2ccoc2 270004a_100015206860_100000211189 [0,1,0,0,0,1|2,0,0]=4 7339 B16R2.2959 Brc1ccccc1CNCc2ccoc2 34a_100015206860_100000184730 [0,1,0,0,0,1|2,0,0]=4 7340 B16R2.2959 Brc1ccccc1CNCc2ccon2 207a_100000688301_100000211189 [0,1,0,0,0,1|2,0,0]=4 7341 B16R2.2959 Brc1ccccc1CNCc2ccon2 2230a_100000689332_100000234950 [0,1,0,0,0,1|2,0,0]=4 7342 B16R2.2959 Brc1ccccc1CNCc2ccon2 270004a_100000688301_100000211189 [0,1,0,0,0,1|2,0,0]=4 7343 B16R2.2959 Brc1ccccc1CNCc2ccon2 34a_100000689332_100000234950 [0,1,0,0,0,1|2,0,0]=4 7344 B16R2.2959 Brc1ccccc1CNCc2ccsc2 207a_100000186416_100000211189 [0,1,0,0,0,1|2,0,0]=4 7345 B16R2.2959 Brc1ccccc1CNCc2ccsc2 207a_100000689332_100000188534 [0,1,0,0,0,1|2,0,0]=4 7346 B16R2.2959 Brc1ccccc1CNCc2ccsc2 2230a_100000186416_100000184730 [0,1,0,0,0,1|2,0,0]=4 7347 B16R2.2959 Brc1ccccc1CNCc2ccsc2 2230a_100000689332_100011261437 [0,1,0,0,0,1|2,0,0]=4 7348 B16R2.2959 Brc1ccccc1CNCc2ccsc2 270004a_100000186416_100000211189 [0,1,0,0,0,1|2,0,0]=4 7349 B16R2.2959 Brc1ccccc1CNCc2ccsc2 270004a_100000689332_100000188534 [0,1,0,0,0,1|2,0,0]=4 7350 B16R2.2959 Brc1ccccc1CNCc2ccsc2 34a_100000186416_100000184730 [0,1,0,0,0,1|2,0,0]=4 7351 B16R2.2959 Brc1ccccc1CNCc2ccsc2 34a_100000689332_100011261437 [0,1,0,0,0,1|2,0,0]=4 7352 B16R2.2959 Brc1ccccc1CNCc2cn[nH]c2 207a_100000689332_100016992096 [0,1,0,0,0,1|2,0,0]=4 7353 B16R2.2959 Brc1ccccc1CNCc2cn[nH]c2 207a_100000737208_100000211189 [0,1,0,0,0,1|2,0,0]=4 7354 B16R2.2959 Brc1ccccc1CNCc2cn[nH]c2 270004a_100000689332_100016992096 [0,1,0,0,0,1|2,0,0]=4 7355 B16R2.2959 Brc1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100000211189 [0,1,0,0,0,1|2,0,0]=4 7356 B16R2.2959 Brc1ccccc1CNCc2cnc[nH]2 207a_100000689332_100000742939 [0,1,0,0,0,1|0,0,2]=4 7357 B16R2.2959 Brc1ccccc1CNCc2cnco2 207a_100020634212_100000211189 [0,1,0,0,0,1|1,0,1]=4 7358 B16R2.2959 Brc1ccccc1CNCc2cnco2 270004a_100000689332_100000064291 [0,1,0,0,0,1|1,0,1]=4 7359 B16R2.2959 Brc1ccccc1CNCc2cnco2 270004a_100020634212_100000211189 [0,1,0,0,0,1|1,0,1]=4 7360 B16R2.2959 Brc1ccccc1CNCc2cncs2 207a_100000689332_100000749870 [0,1,0,0,0,1|1,0,1]=4 7361 B16R2.2959 Brc1ccccc1CNCc2cncs2 207a_100016987365_100000211189 [0,1,0,0,0,1|1,0,1]=4 7362 B16R2.2959 Brc1ccccc1CNCc2cncs2 2230a_100000689332_100015185245 [0,1,0,0,0,1|1,0,1]=4 7363 B16R2.2959 Brc1ccccc1CNCc2cncs2 2230a_100016987365_100000184730 [0,1,0,0,0,1|1,0,1]=4 7364 B16R2.2959 Brc1ccccc1CNCc2cncs2 270004a_100000689332_100000749870 [0,1,0,0,0,1|1,0,1]=4 7365 B16R2.2959 Brc1ccccc1CNCc2cncs2 270004a_100016987365_100000211189 [0,1,0,0,0,1|1,0,1]=4 7366 B16R2.2959 Brc1ccccc1CNCc2cncs2 34a_100000689332_100015185245 [0,1,0,0,0,1|1,0,1]=4 7367 B16R2.2959 Brc1ccccc1CNCc2cocn2 207a_100015188801_100000211189 [0,1,0,0,0,1|1,0,0]=3 7368 B16R2.2959 Brc1ccccc1CNCc2cocn2 270004a_100000689332_100000050382 [0,1,0,0,0,1|1,0,0]=3 7369 B16R2.2959 Brc1ccccc1CNCc2cocn2 270004a_100015188801_100000211189 [0,1,0,0,0,1|1,0,0]=3 7370 B16R2.2959 Brc1ccccc1CNCc2cscn2 207a_100000689332_100000743575 [0,1,0,0,0,1|1,0,0]=3 7371 B16R2.2959 Brc1ccccc1CNCc2cscn2 207a_100015185402_100000211189 [0,1,0,0,0,1|1,0,0]=3 7372 B16R2.2959 Brc1ccccc1CNCc2cscn2 2230a_100000689332_100000205941 [0,1,0,0,0,1|1,0,0]=3 7373 B16R2.2959 Brc1ccccc1CNCc2cscn2 2230a_100015185402_100000184730 [0,1,0,0,0,1|1,0,0]=3 7374 B16R2.2959 Brc1ccccc1CNCc2cscn2 270004a_100000689332_100000743575 [0,1,0,0,0,1|1,0,0]=3 7375 B16R2.2959 Brc1ccccc1CNCc2cscn2 34a_100000689332_100000205941 [0,1,0,0,0,1|1,0,0]=3 7376 B16R2.2959 Brc1ccccc1CNCc2csnn2 270004a_100000689332_100000738508 [0,1,0,0,0,1|2,0,0]=4 7377 B16R2.2959 Brc1ccccc1CNCc2ncc[nH]2 207a_100000689332_100000743867 [0,1,0,0,0,1|2,0,0]=4 7378 B16R2.2959 Brc1ccccc1CNCc2ncc[nH]2 207a_100000754540_100000211189 [0,1,0,0,0,1|2,0,0]=4 7379 B16R2.2959 Brc1ccccc1CNCc2ncc[nH]2 2230a_100000689332_100016991755 [0,1,0,0,0,1|2,0,0]=4 7380 B16R2.2959 Brc1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100000211189 [0,1,0,0,0,1|2,0,0]=4 7381 B16R2.2959 Brc1ccccc1CNCc2ncc[nH]2 34a_100000689332_100016991755 [0,1,0,0,0,1|2,0,0]=4 7382 B16R2.2959 Brc1ccccc1CNCc2ncco2 207a_100016994969_100000211189 [0,1,0,0,0,1|2,0,0]=4 7383 B16R2.2959 Brc1ccccc1CNCc2ncco2 2230a_100000689332_103436540062 [0,1,0,0,0,1|2,0,0]=4 7384 B16R2.2959 Brc1ccccc1CNCc2ncco2 2230a_100016994969_100000184730 [0,1,0,0,0,1|2,0,0]=4 7385 B16R2.2959 Brc1ccccc1CNCc2ncco2 270004a_100000689332_100000064290 [0,1,0,0,0,1|2,0,0]=4 7386 B16R2.2959 Brc1ccccc1CNCc2ncco2 34a_100000689332_103436540062 [0,1,0,0,0,1|2,0,0]=4 7387 B16R2.2959 Brc1ccccc1CNCc2nccs2 207a_100000689332_100000750902 [0,1,0,0,0,1|2,0,0]=4 7388 B16R2.2959 Brc1ccccc1CNCc2nccs2 207a_100000740555_100000211189 [0,1,0,0,0,1|2,0,0]=4 7389 B16R2.2959 Brc1ccccc1CNCc2nccs2 2230a_100000689332_100015184050 [0,1,0,0,0,1|2,0,0]=4 7390 B16R2.2959 Brc1ccccc1CNCc2nccs2 2230a_100000740555_100000184730 [0,1,0,0,0,1|2,0,0]=4 7391 B16R2.2959 Brc1ccccc1CNCc2nccs2 270004a_100000689332_100000750902 [0,1,0,0,0,1|2,0,0]=4 7392 B16R2.2959 Brc1ccccc1CNCc2nccs2 270004a_100000740555_100000211189 [0,1,0,0,0,1|2,0,0]=4 7393 B16R2.2959 Brc1ccccc1CNCc2nccs2 34a_100000689332_100015184050 [0,1,0,0,0,1|2,0,0]=4 7394 B16R2.2959 Brc1ccccc1CNCc2ncon2 34a_100000689332_100000233494 [0,1,0,0,0,1|2,0,0]=4 7395 B16R2.2959 Brc1ccccc1CNCn2cncn2 2230a_100000689332_200020645497 [0,1,0,0,0,1|1,0,1]=4 7396 B16R2.2959 Brc1ccccc1CNCn2cncn2 34a_100000689332_200020645497 [0,1,0,0,0,1|1,0,1]=4 7397 B16R2.2959 Brc1ccccc1COCc2c[nH]cn2 34a_100000756307_100000707719 [0,1,0,0,0,1|1,0,0]=3 7398 B16R2.2959 Brc1ccccc1COCc2cscn2 34a_100000756307_100000205941 [0,1,0,0,0,1|2,0,0]=4 7399 B16R2.2959 Brc1ccccc1COCc2cscn2 7a_100000756307_100000205941 [0,1,0,0,0,1|2,0,0]=4 7400 B16R2.2959 Brc1ccccc1CSCc2c[nH]cn2 62a_100000184730_100000707719 [0,1,0,0,0,1|1,0,0]=3 7401 B16R2.2959 Brc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000184730 [0,1,0,0,0,1|1,0,0]=3 7402 B16R2.2959 Brc1ccccc1CSCc2cscn2 62a_100000184730_100000205941 [0,1,0,0,0,1|2,0,0]=4 7403 B16R2.2959 Brc1ccccc1CSCc2cscn2 62a_100000205941_100000184730 [0,1,0,0,0,1|2,0,0]=4 7404 B16R2.2959 Brc1ccccc1NCCc2cccs2 34a_100000210017_100000748579 [0,1,0,0,0,1|2,0,0]=4 7405 B16R2.2959 Brc1ccccc1NCCn2cccn2 34a_100000210017_100015204718 [0,1,0,0,0,1|2,0,0]=4 7406 B16R2.2959 Brc1ccccc1NCCn2cncn2 34a_100000210017_200000749826 [0,1,0,0,0,1|1,0,1]=4 7407 B16R2.2959 Brc1ccccc1NN=Cc2cc[nH]c2 4a_100000241748_100000760201 [0,1,0,0,0,1|1,0,1]=4 7408 B16R2.2959 Brc1ccccc1NN=Cc2cocn2 4a_100000241748_100000050382 [0,1,0,0,0,1|1,0,1]=4 7409 B16R2.2959 Brc1ccccc1NN=Cc2cscn2 4a_100000241748_100000743575 [0,1,0,0,0,1|1,0,1]=4 7410 B16R2.2959 Brc1ccccc1OCCc2c[nH]cn2 7a_100000181306_100020628418 [0,1,0,0,0,1|1,0,0]=3 7411 B16R2.2959 Brc1ccccc1SCCc2c[nH]cn2 62a_100000695589_100020628418 [0,1,0,0,0,1|1,0,0]=3 7412 B16R2.2959 Brc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000695589 [0,1,0,0,0,1|1,0,0]=3 7413 B16R2.2959 Brc1cccnc1CNCc2c[nH]cn2 207a_100000758547_100011934733 [0,1,0,0,0,1|1,0,0]=3 7414 B16R2.2959 Brc1cccnc1CNCc2c[nH]nn2 207a_100020620823_100011934733 [0,1,0,0,0,1|2,0,0]=4 7415 B16R2.2959 Brc1cccnc1CNCc2c[nH]nn2 270004a_100020620823_100011934733 [0,1,0,0,0,1|2,0,0]=4 7416 B16R2.2959 Brc1cccnc1CNCc2cocn2 207a_100015188801_100011934733 [0,1,0,0,0,1|2,0,0]=4 7417 B16R2.2959 Brc1cccnc1CNCc2cocn2 270004a_100015188801_100011934733 [0,1,0,0,0,1|2,0,0]=4 7418 B16R2.2959 Brc1cccnc1CNCc2cocn2 270004a_100020591323_100000050382 [0,1,0,0,0,1|2,0,0]=4 7419 B16R2.2959 Brc1cccnc1CNCc2cscn2 207a_100015185402_100011934733 [0,1,0,0,0,1|2,0,0]=4 7420 B16R2.2959 Brc1cccnc1CNCc2cscn2 2230a_100015185402_100025702911 [0,1,0,0,0,1|2,0,0]=4 7421 B16R2.2959 Brc1cccnc1CNCc2cscn2 270004a_100020591323_100000743575 [0,1,0,0,0,1|2,0,0]=4 7422 B16R2.2959 Brc1cccnc1COCc2c[nH]cn2 34a_100011996772_100000707719 [0,1,0,0,0,1|2,0,0]=4 7423 B16R2.2959 Brc1cccnc1CSCc2c[nH]cn2 62a_100000707719_100025702911 [0,1,0,0,0,1|2,0,0]=4 7424 B16R2.2959 Brc1cccnc1CSCc2c[nH]cn2 62a_100025702911_100000707719 [0,1,0,0,0,1|2,0,0]=4 7425 B16R2.2959 Brc1cccnc1NCCc2c[nH]cn2 27a_100000755092_100000696092 [0,1,0,0,0,1|1,0,0]=3 7426 B16R2.2959 Brc1cccnc1SCCc2c[nH]cn2 62a_100000696092_100020628418 [0,1,0,0,0,1|2,0,0]=4 7427 B16R2.2959 Brc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100000696092 [0,1,0,0,0,1|2,0,0]=4 7428 B16R2.2959 Brc1ccncc1CNCc2c[nH]nn2 270004a_100020620823_100009816821 [0,1,0,0,0,1|2,0,0]=4 7429 B16R2.2959 Brc1ccncc1CNCc2cocn2 270004a_100015188801_100009816821 [0,1,0,0,0,1|2,0,0]=4 7430 B16R2.2959 Brc1ccncc1SCCc2c[nH]cn2 62a_100010138639_100020628418 [0,1,0,0,0,1|2,0,0]=4 7431 B16R2.2959 Brc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100010138639 [0,1,0,0,0,1|2,0,0]=4 7432 B16R2.2959 Brc1cnccc1CNCc2c[nH]nn2 270004a_100020620823_100000755692 [0,1,0,0,0,1|2,0,0]=4 7433 B16R2.2959 Brc1cnccc1CNCc2cocn2 270004a_100015188801_100000755692 [0,1,0,0,0,1|2,0,0]=4 7434 B16R2.2959 Brc1cnccc1CNCc2cocn2 270004a_100020640021_100000050382 [0,1,0,0,0,1|2,0,0]=4 7435 B16R2.2959 Brc1cnccc1CNCc2cscn2 207a_100020640021_100000743575 [0,1,0,0,0,1|2,0,0]=4 7436 B16R2.2959 Brc1cnccc1CNCc2cscn2 270004a_100020640021_100000743575 [0,1,0,0,0,1|2,0,0]=4 7437 B16R2.2959 Brc1cnccc1NCCc2c[nH]cn2 27a_100000755092_100000726257 [0,1,0,0,0,1|1,0,0]=3 7438 B16R2.2959 Brc1cnccc1SCCc2c[nH]cn2 62a_100000726257_100020628418 [0,1,0,0,0,1|2,0,0]=4 7439 B16R2.2959 Brc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100000726257 [0,1,0,0,0,1|2,0,0]=4 7440 B16R2.2959 Brc1ncccc1CNCc2c[nH]cn2 2230a_100009818023_100000707719 [0,1,0,0,0,1|1,0,0]=3 7441 B16R2.2959 Brc1ncccc1CNCc2c[nH]cn2 34a_100009818023_100000707719 [0,1,0,0,0,1|1,0,0]=3 7442 B16R2.2959 Brc1ncccc1CNCc2cocn2 270004a_100009818023_100000050382 [0,1,0,0,0,1|2,0,0]=4 7443 B16R2.2959 Brc1ncccc1CNCc2cscn2 2230a_100009818023_100000205941 [0,1,0,0,0,1|2,0,0]=4 7444 B16R2.2959 Brc1ncccc1CNCc2cscn2 2230a_100015185402_100010140945 [0,1,0,0,0,1|2,0,0]=4 7445 B16R2.2959 Brc1ncccc1CNCc2cscn2 270004a_100009818023_100000743575 [0,1,0,0,0,1|2,0,0]=4 7446 B16R2.2959 Brc1ncccc1CNCc2cscn2 34a_100009818023_100000205941 [0,1,0,0,0,1|2,0,0]=4 7447 B16R2.2959 Brc1ncccc1COCc2c[nH]cn2 34a_100000719692_100000707719 [0,1,0,0,0,1|2,0,0]=4 7448 B16R2.2959 Brc1ncccc1CSCc2c[nH]cn2 62a_100000707719_100010140945 [0,1,0,0,0,1|2,0,0]=4 7449 B16R2.2959 Brc1ncccc1CSCc2c[nH]cn2 62a_100010140945_100000707719 [0,1,0,0,0,1|2,0,0]=4 7450 B16R2.2959 Brc1ncccc1OCCc2c[nH]cn2 7a_100000744436_100020628418 [0,1,0,0,0,1|2,0,0]=4 7451 B16R2.2959 Brc1ncccc1SCCc2c[nH]cn2 62a_100010202626_100020628418 [0,1,0,0,0,1|2,0,0]=4 7452 B16R2.2959 Brc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100010202626 [0,1,0,0,0,1|2,0,0]=4 7453 B16R2.2959 C[n+]1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000212160 [0,1,0,0,0,1|2,0,0]=4 7454 B16R2.2959 Cc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100011713688 [0,1,0,0,0,1|1,0,0]=3 7455 B16R2.2959 Cc1ccccc1CCSc2c[nH]cn2 62a_100011713688_100000756875 [0,1,0,0,0,1|1,0,0]=3 7456 B16R2.2959 Cc1ccccc1CCSc2c[nH]nn2 62a_100009819707_100011713688 [0,1,0,0,0,1|2,0,0]=4 7457 B16R2.2959 Cc1ccccc1CCSc2c[nH]nn2 62a_100011713688_100009819707 [0,1,0,0,0,1|2,0,0]=4 7458 B16R2.2959 Cc1ccccc1CCSc2cscn2 62a_100000751502_100011713688 [0,1,0,0,0,1|2,0,0]=4 7459 B16R2.2959 Cc1ccccc1CCSc2cscn2 62a_100011713688_100000751502 [0,1,0,0,0,1|2,0,0]=4 7460 B16R2.2959 Cc1ccccc1CCSc2nc[nH]n2 62a_100000761765_100011713688 [0,1,0,0,0,1|2,0,0]=4 7461 B16R2.2959 Cc1ccccc1CCSc2nc[nH]n2 62a_100011713688_100000761765 [0,1,0,0,0,1|2,0,0]=4 7462 B16R2.2959 Cc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000211143 [0,1,0,0,0,1|0,0,0]=2 7463 B16R2.2959 Cc1ccccc1CNCc2c[nH]cn2 34a_100000174972_100000707719 [0,1,0,0,0,1|0,0,0]=2 7464 B16R2.2959 Cc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000211143 [0,1,0,0,0,1|1,0,0]=3 7465 B16R2.2959 Cc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000211143 [0,1,0,0,0,1|1,0,0]=3 7466 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 207a_100000174972_100000738523 [0,1,0,0,0,1|2,0,0]=4 7467 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000211143 [0,1,0,0,0,1|2,0,0]=4 7468 B16R2.2959 Cc1ccccc1CNCc2cc[nH]n2 270004a_100000174972_100000738523 [0,1,0,0,0,1|2,0,0]=4 7469 B16R2.2959 Cc1ccccc1CNCc2ccco2 207a_100000174972_100000186105 [0,1,0,0,0,1|2,0,0]=4 7470 B16R2.2959 Cc1ccccc1CNCc2ccco2 207a_100000185738_100000211143 [0,1,0,0,0,1|2,0,0]=4 7471 B16R2.2959 Cc1ccccc1CNCc2ccco2 2230a_100000185738_100000211839 [0,1,0,0,0,1|2,0,0]=4 7472 B16R2.2959 Cc1ccccc1CNCc2ccco2 270004a_100000174972_100000186105 [0,1,0,0,0,1|2,0,0]=4 7473 B16R2.2959 Cc1ccccc1CNCc2ccco2 270004a_100000185738_100000211143 [0,1,0,0,0,1|2,0,0]=4 7474 B16R2.2959 Cc1ccccc1CNCc2ccco2 34a_100000185738_100000211839 [0,1,0,0,0,1|2,0,0]=4 7475 B16R2.2959 Cc1ccccc1CNCc2cccs2 207a_100000174972_100000209959 [0,1,0,0,0,1|2,0,0]=4 7476 B16R2.2959 Cc1ccccc1CNCc2cccs2 207a_100000211653_100000211143 [0,1,0,0,0,1|2,0,0]=4 7477 B16R2.2959 Cc1ccccc1CNCc2cccs2 2230a_100000211653_100000211839 [0,1,0,0,0,1|2,0,0]=4 7478 B16R2.2959 Cc1ccccc1CNCc2cccs2 270004a_100000174972_100000209959 [0,1,0,0,0,1|2,0,0]=4 7479 B16R2.2959 Cc1ccccc1CNCc2cccs2 270004a_100000211653_100000211143 [0,1,0,0,0,1|2,0,0]=4 7480 B16R2.2959 Cc1ccccc1CNCc2ccoc2 207a_100000174972_100011215517 [0,1,0,0,0,1|2,0,0]=4 7481 B16R2.2959 Cc1ccccc1CNCc2ccoc2 207a_100015206860_100000211143 [0,1,0,0,0,1|2,0,0]=4 7482 B16R2.2959 Cc1ccccc1CNCc2ccoc2 2230a_100015206860_100000211839 [0,1,0,0,0,1|2,0,0]=4 7483 B16R2.2959 Cc1ccccc1CNCc2ccoc2 270004a_100000174972_100011215517 [0,1,0,0,0,1|2,0,0]=4 7484 B16R2.2959 Cc1ccccc1CNCc2ccoc2 270004a_100015206860_100000211143 [0,1,0,0,0,1|2,0,0]=4 7485 B16R2.2959 Cc1ccccc1CNCc2ccoc2 34a_100015206860_100000211839 [0,1,0,0,0,1|2,0,0]=4 7486 B16R2.2959 Cc1ccccc1CNCc2ccon2 207a_100000688301_100000211143 [0,1,0,0,0,1|2,0,0]=4 7487 B16R2.2959 Cc1ccccc1CNCc2ccon2 270004a_100000688301_100000211143 [0,1,0,0,0,1|2,0,0]=4 7488 B16R2.2959 Cc1ccccc1CNCc2ccon2 34a_100000174972_100000234950 [0,1,0,0,0,1|2,0,0]=4 7489 B16R2.2959 Cc1ccccc1CNCc2ccsc2 207a_100000174972_100000188534 [0,1,0,0,0,1|2,0,0]=4 7490 B16R2.2959 Cc1ccccc1CNCc2ccsc2 207a_100000186416_100000211143 [0,1,0,0,0,1|2,0,0]=4 7491 B16R2.2959 Cc1ccccc1CNCc2ccsc2 2230a_100000186416_100000211839 [0,1,0,0,0,1|2,0,0]=4 7492 B16R2.2959 Cc1ccccc1CNCc2ccsc2 270004a_100000174972_100000188534 [0,1,0,0,0,1|2,0,0]=4 7493 B16R2.2959 Cc1ccccc1CNCc2ccsc2 270004a_100000186416_100000211143 [0,1,0,0,0,1|2,0,0]=4 7494 B16R2.2959 Cc1ccccc1CNCc2ccsc2 34a_100000174972_100011261437 [0,1,0,0,0,1|2,0,0]=4 7495 B16R2.2959 Cc1ccccc1CNCc2ccsc2 34a_100000186416_100000211839 [0,1,0,0,0,1|2,0,0]=4 7496 B16R2.2959 Cc1ccccc1CNCc2cn[nH]c2 207a_100000174972_100016992096 [0,1,0,0,0,1|2,0,0]=4 7497 B16R2.2959 Cc1ccccc1CNCc2cn[nH]c2 207a_100000737208_100000211143 [0,1,0,0,0,1|2,0,0]=4 7498 B16R2.2959 Cc1ccccc1CNCc2cn[nH]c2 270004a_100000174972_100016992096 [0,1,0,0,0,1|2,0,0]=4 7499 B16R2.2959 Cc1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100000211143 [0,1,0,0,0,1|2,0,0]=4 7500 B16R2.2959 Cc1ccccc1CNCc2cnc[nH]2 207a_100000174972_100000742939 [0,1,0,0,0,1|0,0,2]=4 7501 B16R2.2959 Cc1ccccc1CNCc2cnco2 207a_100020634212_100000211143 [0,1,0,0,0,1|1,0,1]=4 7502 B16R2.2959 Cc1ccccc1CNCc2cnco2 270004a_100000174972_100000064291 [0,1,0,0,0,1|1,0,1]=4 7503 B16R2.2959 Cc1ccccc1CNCc2cnco2 270004a_100020634212_100000211143 [0,1,0,0,0,1|1,0,1]=4 7504 B16R2.2959 Cc1ccccc1CNCc2cncs2 207a_100000174972_100000749870 [0,1,0,0,0,1|1,0,1]=4 7505 B16R2.2959 Cc1ccccc1CNCc2cncs2 207a_100016987365_100000211143 [0,1,0,0,0,1|1,0,1]=4 7506 B16R2.2959 Cc1ccccc1CNCc2cncs2 2230a_100016987365_100000211839 [0,1,0,0,0,1|1,0,1]=4 7507 B16R2.2959 Cc1ccccc1CNCc2cncs2 270004a_100000174972_100000749870 [0,1,0,0,0,1|1,0,1]=4 7508 B16R2.2959 Cc1ccccc1CNCc2cncs2 270004a_100016987365_100000211143 [0,1,0,0,0,1|1,0,1]=4 7509 B16R2.2959 Cc1ccccc1CNCc2cncs2 34a_100000174972_100015185245 [0,1,0,0,0,1|1,0,1]=4 7510 B16R2.2959 Cc1ccccc1CNCc2cocn2 207a_100015188801_100000211143 [0,1,0,0,0,1|1,0,0]=3 7511 B16R2.2959 Cc1ccccc1CNCc2cocn2 270004a_100000174972_100000050382 [0,1,0,0,0,1|1,0,0]=3 7512 B16R2.2959 Cc1ccccc1CNCc2cocn2 270004a_100015188801_100000211143 [0,1,0,0,0,1|1,0,0]=3 7513 B16R2.2959 Cc1ccccc1CNCc2cscn2 207a_100000174972_100000743575 [0,1,0,0,0,1|1,0,0]=3 7514 B16R2.2959 Cc1ccccc1CNCc2cscn2 207a_100015185402_100000211143 [0,1,0,0,0,1|1,0,0]=3 7515 B16R2.2959 Cc1ccccc1CNCc2cscn2 2230a_100015185402_100000211839 [0,1,0,0,0,1|1,0,0]=3 7516 B16R2.2959 Cc1ccccc1CNCc2cscn2 270004a_100000174972_100000743575 [0,1,0,0,0,1|1,0,0]=3 7517 B16R2.2959 Cc1ccccc1CNCc2cscn2 34a_100000174972_100000205941 [0,1,0,0,0,1|1,0,0]=3 7518 B16R2.2959 Cc1ccccc1CNCc2csnn2 270004a_100000174972_100000738508 [0,1,0,0,0,1|2,0,0]=4 7519 B16R2.2959 Cc1ccccc1CNCc2ncc[nH]2 207a_100000174972_100000743867 [0,1,0,0,0,1|2,0,0]=4 7520 B16R2.2959 Cc1ccccc1CNCc2ncc[nH]2 207a_100000754540_100000211143 [0,1,0,0,0,1|2,0,0]=4 7521 B16R2.2959 Cc1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100000211143 [0,1,0,0,0,1|2,0,0]=4 7522 B16R2.2959 Cc1ccccc1CNCc2ncc[nH]2 34a_100000174972_100016991755 [0,1,0,0,0,1|2,0,0]=4 7523 B16R2.2959 Cc1ccccc1CNCc2ncco2 207a_100016994969_100000211143 [0,1,0,0,0,1|2,0,0]=4 7524 B16R2.2959 Cc1ccccc1CNCc2ncco2 2230a_100016994969_100000211839 [0,1,0,0,0,1|2,0,0]=4 7525 B16R2.2959 Cc1ccccc1CNCc2ncco2 270004a_100000174972_100000064290 [0,1,0,0,0,1|2,0,0]=4 7526 B16R2.2959 Cc1ccccc1CNCc2ncco2 34a_100000174972_103436540062 [0,1,0,0,0,1|2,0,0]=4 7527 B16R2.2959 Cc1ccccc1CNCc2nccs2 207a_100000174972_100000750902 [0,1,0,0,0,1|2,0,0]=4 7528 B16R2.2959 Cc1ccccc1CNCc2nccs2 207a_100000740555_100000211143 [0,1,0,0,0,1|2,0,0]=4 7529 B16R2.2959 Cc1ccccc1CNCc2nccs2 2230a_100000740555_100000211839 [0,1,0,0,0,1|2,0,0]=4 7530 B16R2.2959 Cc1ccccc1CNCc2nccs2 270004a_100000174972_100000750902 [0,1,0,0,0,1|2,0,0]=4 7531 B16R2.2959 Cc1ccccc1CNCc2nccs2 270004a_100000740555_100000211143 [0,1,0,0,0,1|2,0,0]=4 7532 B16R2.2959 Cc1ccccc1CNCc2nccs2 34a_100000174972_100015184050 [0,1,0,0,0,1|2,0,0]=4 7533 B16R2.2959 Cc1ccccc1CNCc2ncon2 34a_100000174972_100000233494 [0,1,0,0,0,1|2,0,0]=4 7534 B16R2.2959 Cc1ccccc1CNCn2cncn2 34a_100000174972_200020645497 [0,1,0,0,0,1|1,0,1]=4 7535 B16R2.2959 Cc1ccccc1COCc2c[nH]cn2 34a_100000698903_100000707719 [0,1,0,0,0,1|1,0,0]=3 7536 B16R2.2959 Cc1ccccc1COCc2cscn2 34a_100000698903_100000205941 [0,1,0,0,0,1|2,0,0]=4 7537 B16R2.2959 Cc1ccccc1COCc2cscn2 7a_100000698903_100000205941 [0,1,0,0,0,1|2,0,0]=4 7538 B16R2.2959 Cc1ccccc1CSCc2c[nH]cn2 62a_100000211839_100000707719 [0,1,0,0,0,1|1,0,0]=3 7539 B16R2.2959 Cc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000211839 [0,1,0,0,0,1|1,0,0]=3 7540 B16R2.2959 Cc1ccccc1CSCc2cscn2 62a_100000205941_100000211839 [0,1,0,0,0,1|2,0,0]=4 7541 B16R2.2959 Cc1ccccc1CSCc2cscn2 62a_100000211839_100000205941 [0,1,0,0,0,1|2,0,0]=4 7542 B16R2.2959 Cc1ccccc1NCCc2cccs2 34a_100015192222_100000748579 [0,1,0,0,0,1|2,0,0]=4 7543 B16R2.2959 Cc1ccccc1NCCn2cccn2 34a_100015192222_100015204718 [0,1,0,0,0,1|2,0,0]=4 7544 B16R2.2959 Cc1ccccc1NCCn2cncn2 34a_100015192222_200000749826 [0,1,0,0,0,1|1,0,1]=4 7545 B16R2.2959 Cc1ccccc1NN=Cc2cc[nH]c2 4a_100000184220_100000760201 [0,1,0,0,0,1|1,0,1]=4 7546 B16R2.2959 Cc1ccccc1NN=Cc2cocn2 4a_100000184220_100000050382 [0,1,0,0,0,1|1,0,1]=4 7547 B16R2.2959 Cc1ccccc1NN=Cc2cscn2 4a_100000184220_100000743575 [0,1,0,0,0,1|1,0,1]=4 7548 B16R2.2959 Cc1ccccc1OCCc2c[nH]cn2 7a_100000210338_100020628418 [0,1,0,0,0,1|1,0,0]=3 7549 B16R2.2959 Cc1ccccc1SCCc2c[nH]cn2 62a_100000210755_100020628418 [0,1,0,0,0,1|1,0,0]=3 7550 B16R2.2959 Cc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000210755 [0,1,0,0,0,1|1,0,0]=3 7551 B16R2.2959 Cc1cccnc1CNCc2c[nH]cn2 207a_100000758547_100000698913 [0,1,0,0,0,1|1,0,0]=3 7552 B16R2.2959 Cc1cccnc1CNCc2c[nH]cn2 34a_100011223789_100000707719 [0,1,0,0,0,1|1,0,0]=3 7553 B16R2.2959 Cc1cccnc1CNCc2c[nH]nn2 207a_100020620823_100000698913 [0,1,0,0,0,1|2,0,0]=4 7554 B16R2.2959 Cc1cccnc1CNCc2c[nH]nn2 270004a_100020620823_100000698913 [0,1,0,0,0,1|2,0,0]=4 7555 B16R2.2959 Cc1cccnc1CNCc2cocn2 207a_100015188801_100000698913 [0,1,0,0,0,1|2,0,0]=4 7556 B16R2.2959 Cc1cccnc1CNCc2cocn2 270004a_100015188801_100000698913 [0,1,0,0,0,1|2,0,0]=4 7557 B16R2.2959 Cc1cccnc1CNCc2cscn2 207a_100015185402_100000698913 [0,1,0,0,0,1|2,0,0]=4 7558 B16R2.2959 Cc1cccnc1CNCc2cscn2 2230a_100015185402_100000696600 [0,1,0,0,0,1|2,0,0]=4 7559 B16R2.2959 Cc1cccnc1CNCc2cscn2 34a_100011223789_100000205941 [0,1,0,0,0,1|2,0,0]=4 7560 B16R2.2959 Cc1cccnc1COCc2c[nH]cn2 34a_100000698912_100000707719 [0,1,0,0,0,1|2,0,0]=4 7561 B16R2.2959 Cc1cccnc1CSCc2c[nH]cn2 62a_100000696600_100000707719 [0,1,0,0,0,1|2,0,0]=4 7562 B16R2.2959 Cc1cccnc1CSCc2c[nH]cn2 62a_100000707719_100000696600 [0,1,0,0,0,1|2,0,0]=4 7563 B16R2.2959 Cc1cccnc1SCCc2c[nH]cn2 62a_100000751373_100020628418 [0,1,0,0,0,1|2,0,0]=4 7564 B16R2.2959 Cc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100000751373 [0,1,0,0,0,1|2,0,0]=4 7565 B16R2.2959 Cc1ccncc1CNCc2c[nH]cn2 207a_100000758547_100000685662 [0,1,0,0,0,1|1,0,0]=3 7566 B16R2.2959 Cc1ccncc1CNCc2c[nH]nn2 207a_100020620823_100000685662 [0,1,0,0,0,1|2,0,0]=4 7567 B16R2.2959 Cc1ccncc1CNCc2c[nH]nn2 270004a_100020620823_100000685662 [0,1,0,0,0,1|2,0,0]=4 7568 B16R2.2959 Cc1ccncc1CNCc2cocn2 207a_100015188801_100000685662 [0,1,0,0,0,1|2,0,0]=4 7569 B16R2.2959 Cc1ccncc1CNCc2cocn2 270004a_100011997553_100000050382 [0,1,0,0,0,1|2,0,0]=4 7570 B16R2.2959 Cc1ccncc1CNCc2cocn2 270004a_100015188801_100000685662 [0,1,0,0,0,1|2,0,0]=4 7571 B16R2.2959 Cc1ccncc1CNCc2cscn2 207a_100011997553_100000743575 [0,1,0,0,0,1|2,0,0]=4 7572 B16R2.2959 Cc1ccncc1CNCc2cscn2 207a_100015185402_100000685662 [0,1,0,0,0,1|2,0,0]=4 7573 B16R2.2959 Cc1ccncc1CNCc2cscn2 2230a_100015185402_100000690890 [0,1,0,0,0,1|2,0,0]=4 7574 B16R2.2959 Cc1ccncc1CNCc2cscn2 270004a_100011997553_100000743575 [0,1,0,0,0,1|2,0,0]=4 7575 B16R2.2959 Cc1ccncc1COCc2c[nH]cn2 34a_100011996381_100000707719 [0,1,0,0,0,1|2,0,0]=4 7576 B16R2.2959 Cc1ccncc1CSCc2c[nH]cn2 62a_100000690890_100000707719 [0,1,0,0,0,1|2,0,0]=4 7577 B16R2.2959 Cc1ccncc1CSCc2c[nH]cn2 62a_100000707719_100000690890 [0,1,0,0,0,1|2,0,0]=4 7578 B16R2.2959 Cc1ccncc1OCCc2c[nH]cn2 7a_100011997053_100020628418 [0,1,0,0,0,1|2,0,0]=4 7579 B16R2.2959 Cc1ccncc1SCCc2c[nH]cn2 62a_100000761580_100020628418 [0,1,0,0,0,1|2,0,0]=4 7580 B16R2.2959 Cc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100000761580 [0,1,0,0,0,1|2,0,0]=4 7581 B16R2.2959 Cc1ccnnc1NCCc2c[nH]cn2 27a_100000755092_100000089043 [0,1,0,0,0,1|2,0,0]=4 7582 B16R2.2959 Cc1cnccc1CNCc2cocn2 270004a_100000708811_100000050382 [0,1,0,0,0,1|2,0,0]=4 7583 B16R2.2959 Cc1cnccc1CNCc2cscn2 207a_100000708811_100000743575 [0,1,0,0,0,1|2,0,0]=4 7584 B16R2.2959 Cc1cnccc1CNCc2cscn2 2230a_100015185402_100020672808 [0,1,0,0,0,1|2,0,0]=4 7585 B16R2.2959 Cc1cnccc1CNCc2cscn2 270004a_100000708811_100000743575 [0,1,0,0,0,1|2,0,0]=4 7586 B16R2.2959 Cc1cnccc1COCc2c[nH]cn2 34a_100011997032_100000707719 [0,1,0,0,0,1|2,0,0]=4 7587 B16R2.2959 Cc1cnccc1CSCc2c[nH]cn2 62a_100000707719_100020672808 [0,1,0,0,0,1|2,0,0]=4 7588 B16R2.2959 Cc1cnccc1CSCc2c[nH]cn2 62a_100020672808_100000707719 [0,1,0,0,0,1|2,0,0]=4 7589 B16R2.2959 Cc1cnccc1NCCc2c[nH]cn2 27a_100000755092_100000765111 [0,1,0,0,0,1|1,0,0]=3 7590 B16R2.2959 Cc1cnccc1SCCc2c[nH]cn2 62a_100000765111_100020628418 [0,1,0,0,0,1|2,0,0]=4 7591 B16R2.2959 Cc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100000765111 [0,1,0,0,0,1|2,0,0]=4 7592 B16R2.2959 Cc1cncnc1NCCc2c[nH]cn2 27a_100000755092_100011998708 [0,1,0,0,0,1|2,0,0]=4 7593 B16R2.2959 Cc1ncccc1CNCc2c[nH]cn2 207a_100000758547_100000751968 [0,1,0,0,0,1|1,0,0]=3 7594 B16R2.2959 Cc1ncccc1CNCc2c[nH]nn2 207a_100020620823_100000751968 [0,1,0,0,0,1|2,0,0]=4 7595 B16R2.2959 Cc1ncccc1CNCc2c[nH]nn2 270004a_100020620823_100000751968 [0,1,0,0,0,1|2,0,0]=4 7596 B16R2.2959 Cc1ncccc1CNCc2cocn2 207a_100015188801_100000751968 [0,1,0,0,0,1|2,0,0]=4 7597 B16R2.2959 Cc1ncccc1CNCc2cocn2 270004a_100015188801_100000751968 [0,1,0,0,0,1|2,0,0]=4 7598 B16R2.2959 Cc1ncccc1CNCc2cscn2 207a_100015185402_100000751968 [0,1,0,0,0,1|2,0,0]=4 7599 B16R2.2959 Cc1ncccc1CNCc2cscn2 2230a_100015185402_100000732876 [0,1,0,0,0,1|2,0,0]=4 7600 B16R2.2959 Cc1ncccc1COCc2c[nH]cn2 34a_100000729262_100000707719 [0,1,0,0,0,1|2,0,0]=4 7601 B16R2.2959 Cc1ncccc1CSCc2c[nH]cn2 62a_100000707719_100000732876 [0,1,0,0,0,1|2,0,0]=4 7602 B16R2.2959 Cc1ncccc1CSCc2c[nH]cn2 62a_100000732876_100000707719 [0,1,0,0,0,1|2,0,0]=4 7603 B16R2.2959 Cc1ncccc1OCCc2c[nH]cn2 7a_100000745507_100020628418 [0,1,0,0,0,1|2,0,0]=4 7604 B16R2.2959 Cc1ncccc1SCCc2c[nH]cn2 62a_100000751574_100020628418 [0,1,0,0,0,1|2,0,0]=4 7605 B16R2.2959 Cc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100000751574 [0,1,0,0,0,1|2,0,0]=4 7606 B16R2.2959 Cc1nccnc1CNCc2c[nH]cn2 2230a_100020641712_100000707719 [0,1,0,0,0,1|2,0,0]=4 7607 B16R2.2959 Cc1nccnc1CNCc2c[nH]cn2 34a_100020641712_100000707719 [0,1,0,0,0,1|2,0,0]=4 7608 B16R2.2959 Cc1nccnc1NCCc2c[nH]cn2 27a_100000755092_100011999405 [0,1,0,0,0,1|2,0,0]=4 7609 B16R2.2959 Clc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100011713703 [0,1,0,0,0,1|1,0,0]=3 7610 B16R2.2959 Clc1ccccc1CCSc2c[nH]cn2 62a_100011713703_100000756875 [0,1,0,0,0,1|1,0,0]=3 7611 B16R2.2959 Clc1ccccc1CCSc2c[nH]nn2 62a_100009819707_100011713703 [0,1,0,0,0,1|2,0,0]=4 7612 B16R2.2959 Clc1ccccc1CCSc2c[nH]nn2 62a_100011713703_100009819707 [0,1,0,0,0,1|2,0,0]=4 7613 B16R2.2959 Clc1ccccc1CCSc2cscn2 62a_100000751502_100011713703 [0,1,0,0,0,1|2,0,0]=4 7614 B16R2.2959 Clc1ccccc1CCSc2cscn2 62a_100011713703_100000751502 [0,1,0,0,0,1|2,0,0]=4 7615 B16R2.2959 Clc1ccccc1CCSc2nc[nH]n2 62a_100000761765_100011713703 [0,1,0,0,0,1|2,0,0]=4 7616 B16R2.2959 Clc1ccccc1CCSc2nc[nH]n2 62a_100011713703_100000761765 [0,1,0,0,0,1|2,0,0]=4 7617 B16R2.2959 Clc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000210073 [0,1,0,0,0,1|0,0,0]=2 7618 B16R2.2959 Clc1ccccc1CNCc2c[nH]cn2 2230a_100000174879_100000707719 [0,1,0,0,0,1|0,0,0]=2 7619 B16R2.2959 Clc1ccccc1CNCc2c[nH]cn2 34a_100000174879_100000707719 [0,1,0,0,0,1|0,0,0]=2 7620 B16R2.2959 Clc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000210073 [0,1,0,0,0,1|1,0,0]=3 7621 B16R2.2959 Clc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000210073 [0,1,0,0,0,1|1,0,0]=3 7622 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 207a_100000174879_100000738523 [0,1,0,0,0,1|2,0,0]=4 7623 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000210073 [0,1,0,0,0,1|2,0,0]=4 7624 B16R2.2959 Clc1ccccc1CNCc2cc[nH]n2 270004a_100000174879_100000738523 [0,1,0,0,0,1|2,0,0]=4 7625 B16R2.2959 Clc1ccccc1CNCc2ccco2 207a_100000174879_100000186105 [0,1,0,0,0,1|2,0,0]=4 7626 B16R2.2959 Clc1ccccc1CNCc2ccco2 207a_100000185738_100000210073 [0,1,0,0,0,1|2,0,0]=4 7627 B16R2.2959 Clc1ccccc1CNCc2ccco2 2230a_100000185738_100000187162 [0,1,0,0,0,1|2,0,0]=4 7628 B16R2.2959 Clc1ccccc1CNCc2ccco2 270004a_100000174879_100000186105 [0,1,0,0,0,1|2,0,0]=4 7629 B16R2.2959 Clc1ccccc1CNCc2ccco2 270004a_100000185738_100000210073 [0,1,0,0,0,1|2,0,0]=4 7630 B16R2.2959 Clc1ccccc1CNCc2ccco2 34a_100000185738_100000187162 [0,1,0,0,0,1|2,0,0]=4 7631 B16R2.2959 Clc1ccccc1CNCc2cccs2 207a_100000174879_100000209959 [0,1,0,0,0,1|2,0,0]=4 7632 B16R2.2959 Clc1ccccc1CNCc2cccs2 207a_100000211653_100000210073 [0,1,0,0,0,1|2,0,0]=4 7633 B16R2.2959 Clc1ccccc1CNCc2cccs2 2230a_100000211653_100000187162 [0,1,0,0,0,1|2,0,0]=4 7634 B16R2.2959 Clc1ccccc1CNCc2cccs2 270004a_100000174879_100000209959 [0,1,0,0,0,1|2,0,0]=4 7635 B16R2.2959 Clc1ccccc1CNCc2cccs2 270004a_100000211653_100000210073 [0,1,0,0,0,1|2,0,0]=4 7636 B16R2.2959 Clc1ccccc1CNCc2ccoc2 207a_100000174879_100011215517 [0,1,0,0,0,1|2,0,0]=4 7637 B16R2.2959 Clc1ccccc1CNCc2ccoc2 207a_100015206860_100000210073 [0,1,0,0,0,1|2,0,0]=4 7638 B16R2.2959 Clc1ccccc1CNCc2ccoc2 2230a_100015206860_100000187162 [0,1,0,0,0,1|2,0,0]=4 7639 B16R2.2959 Clc1ccccc1CNCc2ccoc2 270004a_100000174879_100011215517 [0,1,0,0,0,1|2,0,0]=4 7640 B16R2.2959 Clc1ccccc1CNCc2ccoc2 270004a_100015206860_100000210073 [0,1,0,0,0,1|2,0,0]=4 7641 B16R2.2959 Clc1ccccc1CNCc2ccoc2 34a_100015206860_100000187162 [0,1,0,0,0,1|2,0,0]=4 7642 B16R2.2959 Clc1ccccc1CNCc2ccon2 207a_100000688301_100000210073 [0,1,0,0,0,1|2,0,0]=4 7643 B16R2.2959 Clc1ccccc1CNCc2ccon2 2230a_100000174879_100000234950 [0,1,0,0,0,1|2,0,0]=4 7644 B16R2.2959 Clc1ccccc1CNCc2ccon2 270004a_100000688301_100000210073 [0,1,0,0,0,1|2,0,0]=4 7645 B16R2.2959 Clc1ccccc1CNCc2ccon2 34a_100000174879_100000234950 [0,1,0,0,0,1|2,0,0]=4 7646 B16R2.2959 Clc1ccccc1CNCc2ccsc2 207a_100000174879_100000188534 [0,1,0,0,0,1|2,0,0]=4 7647 B16R2.2959 Clc1ccccc1CNCc2ccsc2 207a_100000186416_100000210073 [0,1,0,0,0,1|2,0,0]=4 7648 B16R2.2959 Clc1ccccc1CNCc2ccsc2 2230a_100000174879_100011261437 [0,1,0,0,0,1|2,0,0]=4 7649 B16R2.2959 Clc1ccccc1CNCc2ccsc2 2230a_100000186416_100000187162 [0,1,0,0,0,1|2,0,0]=4 7650 B16R2.2959 Clc1ccccc1CNCc2ccsc2 270004a_100000174879_100000188534 [0,1,0,0,0,1|2,0,0]=4 7651 B16R2.2959 Clc1ccccc1CNCc2ccsc2 270004a_100000186416_100000210073 [0,1,0,0,0,1|2,0,0]=4 7652 B16R2.2959 Clc1ccccc1CNCc2ccsc2 34a_100000174879_100011261437 [0,1,0,0,0,1|2,0,0]=4 7653 B16R2.2959 Clc1ccccc1CNCc2ccsc2 34a_100000186416_100000187162 [0,1,0,0,0,1|2,0,0]=4 7654 B16R2.2959 Clc1ccccc1CNCc2cn[nH]c2 207a_100000174879_100016992096 [0,1,0,0,0,1|2,0,0]=4 7655 B16R2.2959 Clc1ccccc1CNCc2cn[nH]c2 207a_100000737208_100000210073 [0,1,0,0,0,1|2,0,0]=4 7656 B16R2.2959 Clc1ccccc1CNCc2cn[nH]c2 270004a_100000174879_100016992096 [0,1,0,0,0,1|2,0,0]=4 7657 B16R2.2959 Clc1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100000210073 [0,1,0,0,0,1|2,0,0]=4 7658 B16R2.2959 Clc1ccccc1CNCc2cnc[nH]2 207a_100000174879_100000742939 [0,1,0,0,0,1|0,0,2]=4 7659 B16R2.2959 Clc1ccccc1CNCc2cnco2 207a_100020634212_100000210073 [0,1,0,0,0,1|1,0,1]=4 7660 B16R2.2959 Clc1ccccc1CNCc2cnco2 270004a_100000174879_100000064291 [0,1,0,0,0,1|1,0,1]=4 7661 B16R2.2959 Clc1ccccc1CNCc2cnco2 270004a_100020634212_100000210073 [0,1,0,0,0,1|1,0,1]=4 7662 B16R2.2959 Clc1ccccc1CNCc2cncs2 207a_100000174879_100000749870 [0,1,0,0,0,1|1,0,1]=4 7663 B16R2.2959 Clc1ccccc1CNCc2cncs2 207a_100016987365_100000210073 [0,1,0,0,0,1|1,0,1]=4 7664 B16R2.2959 Clc1ccccc1CNCc2cncs2 2230a_100000174879_100015185245 [0,1,0,0,0,1|1,0,1]=4 7665 B16R2.2959 Clc1ccccc1CNCc2cncs2 2230a_100016987365_100000187162 [0,1,0,0,0,1|1,0,1]=4 7666 B16R2.2959 Clc1ccccc1CNCc2cncs2 270004a_100000174879_100000749870 [0,1,0,0,0,1|1,0,1]=4 7667 B16R2.2959 Clc1ccccc1CNCc2cncs2 270004a_100016987365_100000210073 [0,1,0,0,0,1|1,0,1]=4 7668 B16R2.2959 Clc1ccccc1CNCc2cncs2 34a_100000174879_100015185245 [0,1,0,0,0,1|1,0,1]=4 7669 B16R2.2959 Clc1ccccc1CNCc2cocn2 207a_100015188801_100000210073 [0,1,0,0,0,1|1,0,0]=3 7670 B16R2.2959 Clc1ccccc1CNCc2cocn2 270004a_100000174879_100000050382 [0,1,0,0,0,1|1,0,0]=3 7671 B16R2.2959 Clc1ccccc1CNCc2cocn2 270004a_100015188801_100000210073 [0,1,0,0,0,1|1,0,0]=3 7672 B16R2.2959 Clc1ccccc1CNCc2cscn2 207a_100000174879_100000743575 [0,1,0,0,0,1|1,0,0]=3 7673 B16R2.2959 Clc1ccccc1CNCc2cscn2 207a_100015185402_100000210073 [0,1,0,0,0,1|1,0,0]=3 7674 B16R2.2959 Clc1ccccc1CNCc2cscn2 2230a_100000174879_100000205941 [0,1,0,0,0,1|1,0,0]=3 7675 B16R2.2959 Clc1ccccc1CNCc2cscn2 2230a_100015185402_100000187162 [0,1,0,0,0,1|1,0,0]=3 7676 B16R2.2959 Clc1ccccc1CNCc2cscn2 270004a_100000174879_100000743575 [0,1,0,0,0,1|1,0,0]=3 7677 B16R2.2959 Clc1ccccc1CNCc2cscn2 34a_100000174879_100000205941 [0,1,0,0,0,1|1,0,0]=3 7678 B16R2.2959 Clc1ccccc1CNCc2csnn2 270004a_100000174879_100000738508 [0,1,0,0,0,1|2,0,0]=4 7679 B16R2.2959 Clc1ccccc1CNCc2ncc[nH]2 207a_100000174879_100000743867 [0,1,0,0,0,1|2,0,0]=4 7680 B16R2.2959 Clc1ccccc1CNCc2ncc[nH]2 207a_100000754540_100000210073 [0,1,0,0,0,1|2,0,0]=4 7681 B16R2.2959 Clc1ccccc1CNCc2ncc[nH]2 2230a_100000174879_100016991755 [0,1,0,0,0,1|2,0,0]=4 7682 B16R2.2959 Clc1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100000210073 [0,1,0,0,0,1|2,0,0]=4 7683 B16R2.2959 Clc1ccccc1CNCc2ncc[nH]2 34a_100000174879_100016991755 [0,1,0,0,0,1|2,0,0]=4 7684 B16R2.2959 Clc1ccccc1CNCc2ncco2 207a_100016994969_100000210073 [0,1,0,0,0,1|2,0,0]=4 7685 B16R2.2959 Clc1ccccc1CNCc2ncco2 2230a_100000174879_103436540062 [0,1,0,0,0,1|2,0,0]=4 7686 B16R2.2959 Clc1ccccc1CNCc2ncco2 2230a_100016994969_100000187162 [0,1,0,0,0,1|2,0,0]=4 7687 B16R2.2959 Clc1ccccc1CNCc2ncco2 270004a_100000174879_100000064290 [0,1,0,0,0,1|2,0,0]=4 7688 B16R2.2959 Clc1ccccc1CNCc2ncco2 34a_100000174879_103436540062 [0,1,0,0,0,1|2,0,0]=4 7689 B16R2.2959 Clc1ccccc1CNCc2nccs2 207a_100000174879_100000750902 [0,1,0,0,0,1|2,0,0]=4 7690 B16R2.2959 Clc1ccccc1CNCc2nccs2 207a_100000740555_100000210073 [0,1,0,0,0,1|2,0,0]=4 7691 B16R2.2959 Clc1ccccc1CNCc2nccs2 2230a_100000174879_100015184050 [0,1,0,0,0,1|2,0,0]=4 7692 B16R2.2959 Clc1ccccc1CNCc2nccs2 2230a_100000740555_100000187162 [0,1,0,0,0,1|2,0,0]=4 7693 B16R2.2959 Clc1ccccc1CNCc2nccs2 270004a_100000174879_100000750902 [0,1,0,0,0,1|2,0,0]=4 7694 B16R2.2959 Clc1ccccc1CNCc2nccs2 270004a_100000740555_100000210073 [0,1,0,0,0,1|2,0,0]=4 7695 B16R2.2959 Clc1ccccc1CNCc2nccs2 34a_100000174879_100015184050 [0,1,0,0,0,1|2,0,0]=4 7696 B16R2.2959 Clc1ccccc1CNCc2ncon2 34a_100000174879_100000233494 [0,1,0,0,0,1|2,0,0]=4 7697 B16R2.2959 Clc1ccccc1CNCn2cncn2 2230a_100000174879_200020645497 [0,1,0,0,0,1|1,0,1]=4 7698 B16R2.2959 Clc1ccccc1CNCn2cncn2 34a_100000174879_200020645497 [0,1,0,0,0,1|1,0,1]=4 7699 B16R2.2959 Clc1ccccc1COCc2c[nH]cn2 34a_100000210847_100000707719 [0,1,0,0,0,1|1,0,0]=3 7700 B16R2.2959 Clc1ccccc1COCc2cscn2 34a_100000210847_100000205941 [0,1,0,0,0,1|2,0,0]=4 7701 B16R2.2959 Clc1ccccc1COCc2cscn2 7a_100000210847_100000205941 [0,1,0,0,0,1|2,0,0]=4 7702 B16R2.2959 Clc1ccccc1CSCc2c[nH]cn2 62a_100000187162_100000707719 [0,1,0,0,0,1|1,0,0]=3 7703 B16R2.2959 Clc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000187162 [0,1,0,0,0,1|1,0,0]=3 7704 B16R2.2959 Clc1ccccc1CSCc2cscn2 62a_100000187162_100000205941 [0,1,0,0,0,1|2,0,0]=4 7705 B16R2.2959 Clc1ccccc1CSCc2cscn2 62a_100000205941_100000187162 [0,1,0,0,0,1|2,0,0]=4 7706 B16R2.2959 Clc1ccccc1NCCc2cccs2 34a_100000185783_100000748579 [0,1,0,0,0,1|2,0,0]=4 7707 B16R2.2959 Clc1ccccc1NCCn2cccn2 34a_100000185783_100015204718 [0,1,0,0,0,1|2,0,0]=4 7708 B16R2.2959 Clc1ccccc1NCCn2cncn2 34a_100000185783_200000749826 [0,1,0,0,0,1|1,0,1]=4 7709 B16R2.2959 Clc1ccccc1NN=Cc2cc[nH]c2 4a_100000683529_100000760201 [0,1,0,0,0,1|1,0,1]=4 7710 B16R2.2959 Clc1ccccc1NN=Cc2cocn2 4a_100000683529_100000050382 [0,1,0,0,0,1|1,0,1]=4 7711 B16R2.2959 Clc1ccccc1NN=Cc2cscn2 4a_100000683529_100000743575 [0,1,0,0,0,1|1,0,1]=4 7712 B16R2.2959 Clc1ccccc1OCCc2c[nH]cn2 7a_100000210172_100020628418 [0,1,0,0,0,1|1,0,0]=3 7713 B16R2.2959 Clc1ccccc1SCCc2c[nH]cn2 62a_100000764095_100020628418 [0,1,0,0,0,1|1,0,0]=3 7714 B16R2.2959 Clc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000764095 [0,1,0,0,0,1|1,0,0]=3 7715 B16R2.2959 Clc1cccnc1CNCc2c[nH]cn2 207a_100000758547_100012001307 [0,1,0,0,0,1|1,0,0]=3 7716 B16R2.2959 Clc1cccnc1CNCc2c[nH]cn2 2230a_100015189233_100000707719 [0,1,0,0,0,1|1,0,0]=3 7717 B16R2.2959 Clc1cccnc1CNCc2c[nH]nn2 207a_100020620823_100012001307 [0,1,0,0,0,1|2,0,0]=4 7718 B16R2.2959 Clc1cccnc1CNCc2c[nH]nn2 270004a_100020620823_100012001307 [0,1,0,0,0,1|2,0,0]=4 7719 B16R2.2959 Clc1cccnc1CNCc2cocn2 207a_100015188801_100012001307 [0,1,0,0,0,1|2,0,0]=4 7720 B16R2.2959 Clc1cccnc1CNCc2cocn2 270004a_100015188801_100012001307 [0,1,0,0,0,1|2,0,0]=4 7721 B16R2.2959 Clc1cccnc1CNCc2cocn2 270004a_100015189233_100000050382 [0,1,0,0,0,1|2,0,0]=4 7722 B16R2.2959 Clc1cccnc1CNCc2cscn2 207a_100015185402_100012001307 [0,1,0,0,0,1|2,0,0]=4 7723 B16R2.2959 Clc1cccnc1CNCc2cscn2 2230a_100015185402_100000099807 [0,1,0,0,0,1|2,0,0]=4 7724 B16R2.2959 Clc1cccnc1CNCc2cscn2 2230a_100015189233_100000205941 [0,1,0,0,0,1|2,0,0]=4 7725 B16R2.2959 Clc1cccnc1CNCc2cscn2 270004a_100015189233_100000743575 [0,1,0,0,0,1|2,0,0]=4 7726 B16R2.2959 Clc1cccnc1COCc2c[nH]cn2 34a_100012002383_100000707719 [0,1,0,0,0,1|2,0,0]=4 7727 B16R2.2959 Clc1cccnc1CSCc2c[nH]cn2 62a_100000099807_100000707719 [0,1,0,0,0,1|2,0,0]=4 7728 B16R2.2959 Clc1cccnc1CSCc2c[nH]cn2 62a_100000707719_100000099807 [0,1,0,0,0,1|2,0,0]=4 7729 B16R2.2959 Clc1cccnc1SCCc2c[nH]cn2 62a_100011356963_100020628418 [0,1,0,0,0,1|2,0,0]=4 7730 B16R2.2959 Clc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100011356963 [0,1,0,0,0,1|2,0,0]=4 7731 B16R2.2959 Clc1ccncc1CNCc2c[nH]nn2 270004a_100020620823_100000050567 [0,1,0,0,0,1|2,0,0]=4 7732 B16R2.2959 Clc1ccncc1CNCc2cocn2 270004a_100015188801_100000050567 [0,1,0,0,0,1|2,0,0]=4 7733 B16R2.2959 Clc1ccncc1COCc2c[nH]cn2 34a_100000117392_100000707719 [0,1,0,0,0,1|2,0,0]=4 7734 B16R2.2959 Clc1ccncc1SCCc2c[nH]cn2 62a_100009995489_100020628418 [0,1,0,0,0,1|2,0,0]=4 7735 B16R2.2959 Clc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100009995489 [0,1,0,0,0,1|2,0,0]=4 7736 B16R2.2959 Clc1cnccc1CNCc2c[nH]cn2 207a_100000758547_100011934409 [0,1,0,0,0,1|1,0,0]=3 7737 B16R2.2959 Clc1cnccc1CNCc2c[nH]nn2 207a_100020620823_100011934409 [0,1,0,0,0,1|2,0,0]=4 7738 B16R2.2959 Clc1cnccc1CNCc2c[nH]nn2 270004a_100020620823_100011934409 [0,1,0,0,0,1|2,0,0]=4 7739 B16R2.2959 Clc1cnccc1CNCc2cocn2 207a_100015188801_100011934409 [0,1,0,0,0,1|2,0,0]=4 7740 B16R2.2959 Clc1cnccc1CNCc2cocn2 270004a_100015188801_100011934409 [0,1,0,0,0,1|2,0,0]=4 7741 B16R2.2959 Clc1cnccc1CNCc2cscn2 207a_100015185402_100011934409 [0,1,0,0,0,1|2,0,0]=4 7742 B16R2.2959 Clc1cnccc1CNCc2cscn2 2230a_100015185402_100000763264 [0,1,0,0,0,1|2,0,0]=4 7743 B16R2.2959 Clc1cnccc1CSCc2c[nH]cn2 62a_100000707719_100000763264 [0,1,0,0,0,1|2,0,0]=4 7744 B16R2.2959 Clc1cnccc1CSCc2c[nH]cn2 62a_100000763264_100000707719 [0,1,0,0,0,1|2,0,0]=4 7745 B16R2.2959 Clc1cnccc1SCCc2c[nH]cn2 62a_100000708259_100020628418 [0,1,0,0,0,1|2,0,0]=4 7746 B16R2.2959 Clc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100000708259 [0,1,0,0,0,1|2,0,0]=4 7747 B16R2.2959 Clc1ncccc1CNCc2c[nH]cn2 2230a_100015189234_100000707719 [0,1,0,0,0,1|1,0,0]=3 7748 B16R2.2959 Clc1ncccc1CNCc2c[nH]cn2 34a_100015189234_100000707719 [0,1,0,0,0,1|1,0,0]=3 7749 B16R2.2959 Clc1ncccc1CNCc2cscn2 207a_100015189234_100000743575 [0,1,0,0,0,1|2,0,0]=4 7750 B16R2.2959 Clc1ncccc1CNCc2cscn2 2230a_100015185402_100000045678 [0,1,0,0,0,1|2,0,0]=4 7751 B16R2.2959 Clc1ncccc1CNCc2cscn2 2230a_100015189234_100000205941 [0,1,0,0,0,1|2,0,0]=4 7752 B16R2.2959 Clc1ncccc1CNCc2cscn2 34a_100015189234_100000205941 [0,1,0,0,0,1|2,0,0]=4 7753 B16R2.2959 Clc1ncccc1COCc2c[nH]cn2 34a_100000748726_100000707719 [0,1,0,0,0,1|2,0,0]=4 7754 B16R2.2959 Clc1ncccc1CSCc2c[nH]cn2 62a_100000045678_100000707719 [0,1,0,0,0,1|2,0,0]=4 7755 B16R2.2959 Clc1ncccc1CSCc2c[nH]cn2 62a_100000707719_100000045678 [0,1,0,0,0,1|2,0,0]=4 7756 B16R2.2959 Clc1ncccc1OCCc2c[nH]cn2 7a_100000757616_100020628418 [0,1,0,0,0,1|2,0,0]=4 7757 B16R2.2959 Clc1ncccc1SCCc2c[nH]cn2 62a_100000036424_100020628418 [0,1,0,0,0,1|2,0,0]=4 7758 B16R2.2959 Clc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100000036424 [0,1,0,0,0,1|2,0,0]=4 7759 B16R2.2959 Clc1nccnc1CNCc2c[nH]cn2 2230a_100000729963_100000707719 [0,1,0,0,0,1|2,0,0]=4 7760 B16R2.2959 Fc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100011713696 [0,1,0,0,0,1|1,0,0]=3 7761 B16R2.2959 Fc1ccccc1CCSc2c[nH]cn2 62a_100011713696_100000756875 [0,1,0,0,0,1|1,0,0]=3 7762 B16R2.2959 Fc1ccccc1CCSc2c[nH]nn2 62a_100009819707_100011713696 [0,1,0,0,0,1|2,0,0]=4 7763 B16R2.2959 Fc1ccccc1CCSc2c[nH]nn2 62a_100011713696_100009819707 [0,1,0,0,0,1|2,0,0]=4 7764 B16R2.2959 Fc1ccccc1CCSc2cscn2 62a_100000751502_100011713696 [0,1,0,0,0,1|2,0,0]=4 7765 B16R2.2959 Fc1ccccc1CCSc2cscn2 62a_100011713696_100000751502 [0,1,0,0,0,1|2,0,0]=4 7766 B16R2.2959 Fc1ccccc1CCSc2nc[nH]n2 62a_100000761765_100011713696 [0,1,0,0,0,1|2,0,0]=4 7767 B16R2.2959 Fc1ccccc1CCSc2nc[nH]n2 62a_100011713696_100000761765 [0,1,0,0,0,1|2,0,0]=4 7768 B16R2.2959 Fc1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000210811 [0,1,0,0,0,1|0,0,0]=2 7769 B16R2.2959 Fc1ccccc1CNCc2c[nH]cn2 34a_100000174869_100000707719 [0,1,0,0,0,1|0,0,0]=2 7770 B16R2.2959 Fc1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000210811 [0,1,0,0,0,1|1,0,0]=3 7771 B16R2.2959 Fc1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000210811 [0,1,0,0,0,1|1,0,0]=3 7772 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 207a_100000174869_100000738523 [0,1,0,0,0,1|2,0,0]=4 7773 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000210811 [0,1,0,0,0,1|2,0,0]=4 7774 B16R2.2959 Fc1ccccc1CNCc2cc[nH]n2 270004a_100000174869_100000738523 [0,1,0,0,0,1|2,0,0]=4 7775 B16R2.2959 Fc1ccccc1CNCc2ccco2 207a_100000174869_100000186105 [0,1,0,0,0,1|2,0,0]=4 7776 B16R2.2959 Fc1ccccc1CNCc2ccco2 207a_100000185738_100000210811 [0,1,0,0,0,1|2,0,0]=4 7777 B16R2.2959 Fc1ccccc1CNCc2ccco2 2230a_100000185738_100000211605 [0,1,0,0,0,1|2,0,0]=4 7778 B16R2.2959 Fc1ccccc1CNCc2ccco2 270004a_100000174869_100000186105 [0,1,0,0,0,1|2,0,0]=4 7779 B16R2.2959 Fc1ccccc1CNCc2ccco2 270004a_100000185738_100000210811 [0,1,0,0,0,1|2,0,0]=4 7780 B16R2.2959 Fc1ccccc1CNCc2ccco2 34a_100000185738_100000211605 [0,1,0,0,0,1|2,0,0]=4 7781 B16R2.2959 Fc1ccccc1CNCc2cccs2 207a_100000174869_100000209959 [0,1,0,0,0,1|2,0,0]=4 7782 B16R2.2959 Fc1ccccc1CNCc2cccs2 207a_100000211653_100000210811 [0,1,0,0,0,1|2,0,0]=4 7783 B16R2.2959 Fc1ccccc1CNCc2cccs2 2230a_100000211653_100000211605 [0,1,0,0,0,1|2,0,0]=4 7784 B16R2.2959 Fc1ccccc1CNCc2cccs2 270004a_100000174869_100000209959 [0,1,0,0,0,1|2,0,0]=4 7785 B16R2.2959 Fc1ccccc1CNCc2cccs2 270004a_100000211653_100000210811 [0,1,0,0,0,1|2,0,0]=4 7786 B16R2.2959 Fc1ccccc1CNCc2ccoc2 207a_100000174869_100011215517 [0,1,0,0,0,1|2,0,0]=4 7787 B16R2.2959 Fc1ccccc1CNCc2ccoc2 207a_100015206860_100000210811 [0,1,0,0,0,1|2,0,0]=4 7788 B16R2.2959 Fc1ccccc1CNCc2ccoc2 2230a_100015206860_100000211605 [0,1,0,0,0,1|2,0,0]=4 7789 B16R2.2959 Fc1ccccc1CNCc2ccoc2 270004a_100000174869_100011215517 [0,1,0,0,0,1|2,0,0]=4 7790 B16R2.2959 Fc1ccccc1CNCc2ccoc2 270004a_100015206860_100000210811 [0,1,0,0,0,1|2,0,0]=4 7791 B16R2.2959 Fc1ccccc1CNCc2ccoc2 34a_100015206860_100000211605 [0,1,0,0,0,1|2,0,0]=4 7792 B16R2.2959 Fc1ccccc1CNCc2ccon2 207a_100000688301_100000210811 [0,1,0,0,0,1|2,0,0]=4 7793 B16R2.2959 Fc1ccccc1CNCc2ccon2 270004a_100000688301_100000210811 [0,1,0,0,0,1|2,0,0]=4 7794 B16R2.2959 Fc1ccccc1CNCc2ccon2 34a_100000174869_100000234950 [0,1,0,0,0,1|2,0,0]=4 7795 B16R2.2959 Fc1ccccc1CNCc2ccsc2 207a_100000174869_100000188534 [0,1,0,0,0,1|2,0,0]=4 7796 B16R2.2959 Fc1ccccc1CNCc2ccsc2 207a_100000186416_100000210811 [0,1,0,0,0,1|2,0,0]=4 7797 B16R2.2959 Fc1ccccc1CNCc2ccsc2 2230a_100000186416_100000211605 [0,1,0,0,0,1|2,0,0]=4 7798 B16R2.2959 Fc1ccccc1CNCc2ccsc2 270004a_100000174869_100000188534 [0,1,0,0,0,1|2,0,0]=4 7799 B16R2.2959 Fc1ccccc1CNCc2ccsc2 270004a_100000186416_100000210811 [0,1,0,0,0,1|2,0,0]=4 7800 B16R2.2959 Fc1ccccc1CNCc2ccsc2 34a_100000174869_100011261437 [0,1,0,0,0,1|2,0,0]=4 7801 B16R2.2959 Fc1ccccc1CNCc2ccsc2 34a_100000186416_100000211605 [0,1,0,0,0,1|2,0,0]=4 7802 B16R2.2959 Fc1ccccc1CNCc2cn[nH]c2 207a_100000174869_100016992096 [0,1,0,0,0,1|2,0,0]=4 7803 B16R2.2959 Fc1ccccc1CNCc2cn[nH]c2 207a_100000737208_100000210811 [0,1,0,0,0,1|2,0,0]=4 7804 B16R2.2959 Fc1ccccc1CNCc2cn[nH]c2 270004a_100000174869_100016992096 [0,1,0,0,0,1|2,0,0]=4 7805 B16R2.2959 Fc1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100000210811 [0,1,0,0,0,1|2,0,0]=4 7806 B16R2.2959 Fc1ccccc1CNCc2cnc[nH]2 207a_100000174869_100000742939 [0,1,0,0,0,1|0,0,2]=4 7807 B16R2.2959 Fc1ccccc1CNCc2cnco2 207a_100020634212_100000210811 [0,1,0,0,0,1|1,0,1]=4 7808 B16R2.2959 Fc1ccccc1CNCc2cnco2 270004a_100000174869_100000064291 [0,1,0,0,0,1|1,0,1]=4 7809 B16R2.2959 Fc1ccccc1CNCc2cnco2 270004a_100020634212_100000210811 [0,1,0,0,0,1|1,0,1]=4 7810 B16R2.2959 Fc1ccccc1CNCc2cncs2 207a_100000174869_100000749870 [0,1,0,0,0,1|1,0,1]=4 7811 B16R2.2959 Fc1ccccc1CNCc2cncs2 207a_100016987365_100000210811 [0,1,0,0,0,1|1,0,1]=4 7812 B16R2.2959 Fc1ccccc1CNCc2cncs2 2230a_100016987365_100000211605 [0,1,0,0,0,1|1,0,1]=4 7813 B16R2.2959 Fc1ccccc1CNCc2cncs2 270004a_100000174869_100000749870 [0,1,0,0,0,1|1,0,1]=4 7814 B16R2.2959 Fc1ccccc1CNCc2cncs2 270004a_100016987365_100000210811 [0,1,0,0,0,1|1,0,1]=4 7815 B16R2.2959 Fc1ccccc1CNCc2cncs2 34a_100000174869_100015185245 [0,1,0,0,0,1|1,0,1]=4 7816 B16R2.2959 Fc1ccccc1CNCc2cocn2 207a_100015188801_100000210811 [0,1,0,0,0,1|1,0,0]=3 7817 B16R2.2959 Fc1ccccc1CNCc2cocn2 270004a_100000174869_100000050382 [0,1,0,0,0,1|1,0,0]=3 7818 B16R2.2959 Fc1ccccc1CNCc2cocn2 270004a_100015188801_100000210811 [0,1,0,0,0,1|1,0,0]=3 7819 B16R2.2959 Fc1ccccc1CNCc2cscn2 207a_100000174869_100000743575 [0,1,0,0,0,1|1,0,0]=3 7820 B16R2.2959 Fc1ccccc1CNCc2cscn2 207a_100015185402_100000210811 [0,1,0,0,0,1|1,0,0]=3 7821 B16R2.2959 Fc1ccccc1CNCc2cscn2 2230a_100015185402_100000211605 [0,1,0,0,0,1|1,0,0]=3 7822 B16R2.2959 Fc1ccccc1CNCc2cscn2 270004a_100000174869_100000743575 [0,1,0,0,0,1|1,0,0]=3 7823 B16R2.2959 Fc1ccccc1CNCc2cscn2 34a_100000174869_100000205941 [0,1,0,0,0,1|1,0,0]=3 7824 B16R2.2959 Fc1ccccc1CNCc2csnn2 270004a_100000174869_100000738508 [0,1,0,0,0,1|2,0,0]=4 7825 B16R2.2959 Fc1ccccc1CNCc2ncc[nH]2 207a_100000174869_100000743867 [0,1,0,0,0,1|2,0,0]=4 7826 B16R2.2959 Fc1ccccc1CNCc2ncc[nH]2 207a_100000754540_100000210811 [0,1,0,0,0,1|2,0,0]=4 7827 B16R2.2959 Fc1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100000210811 [0,1,0,0,0,1|2,0,0]=4 7828 B16R2.2959 Fc1ccccc1CNCc2ncc[nH]2 34a_100000174869_100016991755 [0,1,0,0,0,1|2,0,0]=4 7829 B16R2.2959 Fc1ccccc1CNCc2ncco2 207a_100016994969_100000210811 [0,1,0,0,0,1|2,0,0]=4 7830 B16R2.2959 Fc1ccccc1CNCc2ncco2 2230a_100016994969_100000211605 [0,1,0,0,0,1|2,0,0]=4 7831 B16R2.2959 Fc1ccccc1CNCc2ncco2 270004a_100000174869_100000064290 [0,1,0,0,0,1|2,0,0]=4 7832 B16R2.2959 Fc1ccccc1CNCc2ncco2 34a_100000174869_103436540062 [0,1,0,0,0,1|2,0,0]=4 7833 B16R2.2959 Fc1ccccc1CNCc2nccs2 207a_100000174869_100000750902 [0,1,0,0,0,1|2,0,0]=4 7834 B16R2.2959 Fc1ccccc1CNCc2nccs2 207a_100000740555_100000210811 [0,1,0,0,0,1|2,0,0]=4 7835 B16R2.2959 Fc1ccccc1CNCc2nccs2 2230a_100000740555_100000211605 [0,1,0,0,0,1|2,0,0]=4 7836 B16R2.2959 Fc1ccccc1CNCc2nccs2 270004a_100000174869_100000750902 [0,1,0,0,0,1|2,0,0]=4 7837 B16R2.2959 Fc1ccccc1CNCc2nccs2 270004a_100000740555_100000210811 [0,1,0,0,0,1|2,0,0]=4 7838 B16R2.2959 Fc1ccccc1CNCc2nccs2 34a_100000174869_100015184050 [0,1,0,0,0,1|2,0,0]=4 7839 B16R2.2959 Fc1ccccc1CNCc2ncon2 34a_100000174869_100000233494 [0,1,0,0,0,1|2,0,0]=4 7840 B16R2.2959 Fc1ccccc1CNCn2cncn2 34a_100000174869_200020645497 [0,1,0,0,0,1|1,0,1]=4 7841 B16R2.2959 Fc1ccccc1COCc2c[nH]cn2 34a_100000211962_100000707719 [0,1,0,0,0,1|1,0,0]=3 7842 B16R2.2959 Fc1ccccc1COCc2cscn2 34a_100000211962_100000205941 [0,1,0,0,0,1|2,0,0]=4 7843 B16R2.2959 Fc1ccccc1COCc2cscn2 7a_100000211962_100000205941 [0,1,0,0,0,1|2,0,0]=4 7844 B16R2.2959 Fc1ccccc1CSCc2c[nH]cn2 62a_100000211605_100000707719 [0,1,0,0,0,1|1,0,0]=3 7845 B16R2.2959 Fc1ccccc1CSCc2c[nH]cn2 62a_100000707719_100000211605 [0,1,0,0,0,1|1,0,0]=3 7846 B16R2.2959 Fc1ccccc1CSCc2cscn2 62a_100000205941_100000211605 [0,1,0,0,0,1|2,0,0]=4 7847 B16R2.2959 Fc1ccccc1CSCc2cscn2 62a_100000211605_100000205941 [0,1,0,0,0,1|2,0,0]=4 7848 B16R2.2959 Fc1ccccc1NCCc2cccs2 34a_100000210422_100000748579 [0,1,0,0,0,1|2,0,0]=4 7849 B16R2.2959 Fc1ccccc1NCCn2cccn2 34a_100000210422_100015204718 [0,1,0,0,0,1|2,0,0]=4 7850 B16R2.2959 Fc1ccccc1NCCn2cncn2 34a_100000210422_200000749826 [0,1,0,0,0,1|1,0,1]=4 7851 B16R2.2959 Fc1ccccc1NN=Cc2cc[nH]c2 4a_100000239246_100000760201 [0,1,0,0,0,1|1,0,1]=4 7852 B16R2.2959 Fc1ccccc1NN=Cc2cocn2 4a_100000239246_100000050382 [0,1,0,0,0,1|1,0,1]=4 7853 B16R2.2959 Fc1ccccc1NN=Cc2cscn2 4a_100000239246_100000743575 [0,1,0,0,0,1|1,0,1]=4 7854 B16R2.2959 Fc1ccccc1OCCc2c[nH]cn2 7a_100000210171_100020628418 [0,1,0,0,0,1|1,0,0]=3 7855 B16R2.2959 Fc1ccccc1SCCc2c[nH]cn2 62a_100011215700_100020628418 [0,1,0,0,0,1|1,0,0]=3 7856 B16R2.2959 Fc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100011215700 [0,1,0,0,0,1|1,0,0]=3 7857 B16R2.2959 Fc1cccnc1CNCc2c[nH]cn2 207a_100000758547_100011934734 [0,1,0,0,0,1|1,0,0]=3 7858 B16R2.2959 Fc1cccnc1CNCc2c[nH]cn2 34a_100000690088_100000707719 [0,1,0,0,0,1|1,0,0]=3 7859 B16R2.2959 Fc1cccnc1CNCc2c[nH]nn2 207a_100020620823_100011934734 [0,1,0,0,0,1|2,0,0]=4 7860 B16R2.2959 Fc1cccnc1CNCc2c[nH]nn2 270004a_100020620823_100011934734 [0,1,0,0,0,1|2,0,0]=4 7861 B16R2.2959 Fc1cccnc1CNCc2cocn2 207a_100015188801_100011934734 [0,1,0,0,0,1|2,0,0]=4 7862 B16R2.2959 Fc1cccnc1CNCc2cocn2 270004a_100000690088_100000050382 [0,1,0,0,0,1|2,0,0]=4 7863 B16R2.2959 Fc1cccnc1CNCc2cocn2 270004a_100015188801_100011934734 [0,1,0,0,0,1|2,0,0]=4 7864 B16R2.2959 Fc1cccnc1CNCc2cscn2 207a_100015185402_100011934734 [0,1,0,0,0,1|2,0,0]=4 7865 B16R2.2959 Fc1cccnc1CNCc2cscn2 2230a_100015185402_100000104219 [0,1,0,0,0,1|2,0,0]=4 7866 B16R2.2959 Fc1cccnc1CNCc2cscn2 270004a_100000690088_100000743575 [0,1,0,0,0,1|2,0,0]=4 7867 B16R2.2959 Fc1cccnc1CNCc2cscn2 34a_100000690088_100000205941 [0,1,0,0,0,1|2,0,0]=4 7868 B16R2.2959 Fc1cccnc1COCc2c[nH]cn2 34a_100011934865_100000707719 [0,1,0,0,0,1|2,0,0]=4 7869 B16R2.2959 Fc1cccnc1CSCc2c[nH]cn2 62a_100000104219_100000707719 [0,1,0,0,0,1|2,0,0]=4 7870 B16R2.2959 Fc1cccnc1CSCc2c[nH]cn2 62a_100000707719_100000104219 [0,1,0,0,0,1|2,0,0]=4 7871 B16R2.2959 Fc1cccnc1SCCc2c[nH]cn2 62a_100000685392_100020628418 [0,1,0,0,0,1|2,0,0]=4 7872 B16R2.2959 Fc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100000685392 [0,1,0,0,0,1|2,0,0]=4 7873 B16R2.2959 Fc1ccncc1SCCc2c[nH]cn2 62a_100009820683_100020628418 [0,1,0,0,0,1|2,0,0]=4 7874 B16R2.2959 Fc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100009820683 [0,1,0,0,0,1|2,0,0]=4 7875 B16R2.2959 Fc1cnccc1CNCc2c[nH]cn2 34a_100011935246_100000707719 [0,1,0,0,0,1|1,0,0]=3 7876 B16R2.2959 Fc1cnccc1CNCc2cocn2 270004a_100011935246_100000050382 [0,1,0,0,0,1|2,0,0]=4 7877 B16R2.2959 Fc1cnccc1CNCc2cscn2 207a_100011935246_100000743575 [0,1,0,0,0,1|2,0,0]=4 7878 B16R2.2959 Fc1cnccc1CNCc2cscn2 270004a_100011935246_100000743575 [0,1,0,0,0,1|2,0,0]=4 7879 B16R2.2959 Fc1cnccc1CNCc2cscn2 34a_100011935246_100000205941 [0,1,0,0,0,1|2,0,0]=4 7880 B16R2.2959 Fc1cnccc1COCc2c[nH]cn2 34a_100012172863_100000707719 [0,1,0,0,0,1|2,0,0]=4 7881 B16R2.2959 Fc1cnccc1NCCc2c[nH]cn2 27a_100000755092_100000035921 [0,1,0,0,0,1|1,0,0]=3 7882 B16R2.2959 Fc1cnccc1SCCc2c[nH]cn2 62a_100000047030_100020628418 [0,1,0,0,0,1|2,0,0]=4 7883 B16R2.2959 Fc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100000047030 [0,1,0,0,0,1|2,0,0]=4 7884 B16R2.2959 Fc1cncnc1NCCc2c[nH]cn2 27a_100000755092_100000069762 [0,1,0,0,0,1|2,0,0]=4 7885 B16R2.2959 Fc1ncccc1CNCc2c[nH]cn2 34a_100000724633_100000707719 [0,1,0,0,0,1|1,0,0]=3 7886 B16R2.2959 Fc1ncccc1CNCc2cocn2 270004a_100000724633_100000050382 [0,1,0,0,0,1|2,0,0]=4 7887 B16R2.2959 Fc1ncccc1CNCc2cscn2 2230a_100015185402_100000099810 [0,1,0,0,0,1|2,0,0]=4 7888 B16R2.2959 Fc1ncccc1CNCc2cscn2 270004a_100000724633_100000743575 [0,1,0,0,0,1|2,0,0]=4 7889 B16R2.2959 Fc1ncccc1CNCc2cscn2 34a_100000724633_100000205941 [0,1,0,0,0,1|2,0,0]=4 7890 B16R2.2959 Fc1ncccc1COCc2c[nH]cn2 34a_100000079888_100000707719 [0,1,0,0,0,1|2,0,0]=4 7891 B16R2.2959 Fc1ncccc1CSCc2c[nH]cn2 62a_100000099810_100000707719 [0,1,0,0,0,1|2,0,0]=4 7892 B16R2.2959 Fc1ncccc1CSCc2c[nH]cn2 62a_100000707719_100000099810 [0,1,0,0,0,1|2,0,0]=4 7893 B16R2.2959 Fc1ncccc1OCCc2c[nH]cn2 7a_100000061740_100020628418 [0,1,0,0,0,1|2,0,0]=4 7894 B16R2.2959 Fc1ncccc1SCCc2c[nH]cn2 62a_100009816115_100020628418 [0,1,0,0,0,1|2,0,0]=4 7895 B16R2.2959 Fc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100009816115 [0,1,0,0,0,1|2,0,0]=4 7896 B16R2.2959 Fc1nccnc1NCCc2c[nH]cn2 27a_100000755092_200010125657 [0,1,0,0,0,1|2,0,0]=4 7897 B16R2.2959 Ic1ccccc1CNCc2c[nH]cn2 207a_100000758547_100000010305 [0,1,0,0,0,1|0,0,0]=2 7898 B16R2.2959 Ic1ccccc1CNCc2c[nH]nn2 207a_100020620823_100000010305 [0,1,0,0,0,1|1,0,0]=3 7899 B16R2.2959 Ic1ccccc1CNCc2c[nH]nn2 270004a_100020620823_100000010305 [0,1,0,0,0,1|1,0,0]=3 7900 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 207a_100000739516_100000010305 [0,1,0,0,0,1|2,0,0]=4 7901 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 207a_100015347259_100000738523 [0,1,0,0,0,1|2,0,0]=4 7902 B16R2.2959 Ic1ccccc1CNCc2cc[nH]n2 270004a_100015347259_100000738523 [0,1,0,0,0,1|2,0,0]=4 7903 B16R2.2959 Ic1ccccc1CNCc2ccco2 207a_100000185738_100000010305 [0,1,0,0,0,1|2,0,0]=4 7904 B16R2.2959 Ic1ccccc1CNCc2ccco2 207a_100015347259_100000186105 [0,1,0,0,0,1|2,0,0]=4 7905 B16R2.2959 Ic1ccccc1CNCc2ccco2 2230a_100000185738_100011215278 [0,1,0,0,0,1|2,0,0]=4 7906 B16R2.2959 Ic1ccccc1CNCc2ccco2 270004a_100000185738_100000010305 [0,1,0,0,0,1|2,0,0]=4 7907 B16R2.2959 Ic1ccccc1CNCc2ccco2 270004a_100015347259_100000186105 [0,1,0,0,0,1|2,0,0]=4 7908 B16R2.2959 Ic1ccccc1CNCc2ccco2 34a_100000185738_100011215278 [0,1,0,0,0,1|2,0,0]=4 7909 B16R2.2959 Ic1ccccc1CNCc2cccs2 207a_100000211653_100000010305 [0,1,0,0,0,1|2,0,0]=4 7910 B16R2.2959 Ic1ccccc1CNCc2cccs2 207a_100015347259_100000209959 [0,1,0,0,0,1|2,0,0]=4 7911 B16R2.2959 Ic1ccccc1CNCc2cccs2 2230a_100000211653_100011215278 [0,1,0,0,0,1|2,0,0]=4 7912 B16R2.2959 Ic1ccccc1CNCc2cccs2 270004a_100000211653_100000010305 [0,1,0,0,0,1|2,0,0]=4 7913 B16R2.2959 Ic1ccccc1CNCc2cccs2 270004a_100015347259_100000209959 [0,1,0,0,0,1|2,0,0]=4 7914 B16R2.2959 Ic1ccccc1CNCc2ccoc2 207a_100015206860_100000010305 [0,1,0,0,0,1|2,0,0]=4 7915 B16R2.2959 Ic1ccccc1CNCc2ccoc2 207a_100015347259_100011215517 [0,1,0,0,0,1|2,0,0]=4 7916 B16R2.2959 Ic1ccccc1CNCc2ccoc2 2230a_100015206860_100011215278 [0,1,0,0,0,1|2,0,0]=4 7917 B16R2.2959 Ic1ccccc1CNCc2ccoc2 270004a_100015206860_100000010305 [0,1,0,0,0,1|2,0,0]=4 7918 B16R2.2959 Ic1ccccc1CNCc2ccoc2 270004a_100015347259_100011215517 [0,1,0,0,0,1|2,0,0]=4 7919 B16R2.2959 Ic1ccccc1CNCc2ccoc2 34a_100015206860_100011215278 [0,1,0,0,0,1|2,0,0]=4 7920 B16R2.2959 Ic1ccccc1CNCc2ccon2 207a_100000688301_100000010305 [0,1,0,0,0,1|2,0,0]=4 7921 B16R2.2959 Ic1ccccc1CNCc2ccon2 270004a_100000688301_100000010305 [0,1,0,0,0,1|2,0,0]=4 7922 B16R2.2959 Ic1ccccc1CNCc2ccsc2 207a_100000186416_100000010305 [0,1,0,0,0,1|2,0,0]=4 7923 B16R2.2959 Ic1ccccc1CNCc2ccsc2 207a_100015347259_100000188534 [0,1,0,0,0,1|2,0,0]=4 7924 B16R2.2959 Ic1ccccc1CNCc2ccsc2 2230a_100000186416_100011215278 [0,1,0,0,0,1|2,0,0]=4 7925 B16R2.2959 Ic1ccccc1CNCc2ccsc2 270004a_100000186416_100000010305 [0,1,0,0,0,1|2,0,0]=4 7926 B16R2.2959 Ic1ccccc1CNCc2ccsc2 270004a_100015347259_100000188534 [0,1,0,0,0,1|2,0,0]=4 7927 B16R2.2959 Ic1ccccc1CNCc2ccsc2 34a_100000186416_100011215278 [0,1,0,0,0,1|2,0,0]=4 7928 B16R2.2959 Ic1ccccc1CNCc2cn[nH]c2 207a_100000737208_100000010305 [0,1,0,0,0,1|2,0,0]=4 7929 B16R2.2959 Ic1ccccc1CNCc2cn[nH]c2 207a_100015347259_100016992096 [0,1,0,0,0,1|2,0,0]=4 7930 B16R2.2959 Ic1ccccc1CNCc2cn[nH]c2 270004a_100000737208_100000010305 [0,1,0,0,0,1|2,0,0]=4 7931 B16R2.2959 Ic1ccccc1CNCc2cn[nH]c2 270004a_100015347259_100016992096 [0,1,0,0,0,1|2,0,0]=4 7932 B16R2.2959 Ic1ccccc1CNCc2cnc[nH]2 207a_100015347259_100000742939 [0,1,0,0,0,1|0,0,2]=4 7933 B16R2.2959 Ic1ccccc1CNCc2cnco2 207a_100020634212_100000010305 [0,1,0,0,0,1|1,0,1]=4 7934 B16R2.2959 Ic1ccccc1CNCc2cnco2 270004a_100015347259_100000064291 [0,1,0,0,0,1|1,0,1]=4 7935 B16R2.2959 Ic1ccccc1CNCc2cnco2 270004a_100020634212_100000010305 [0,1,0,0,0,1|1,0,1]=4 7936 B16R2.2959 Ic1ccccc1CNCc2cncs2 207a_100015347259_100000749870 [0,1,0,0,0,1|1,0,1]=4 7937 B16R2.2959 Ic1ccccc1CNCc2cncs2 207a_100016987365_100000010305 [0,1,0,0,0,1|1,0,1]=4 7938 B16R2.2959 Ic1ccccc1CNCc2cncs2 2230a_100016987365_100011215278 [0,1,0,0,0,1|1,0,1]=4 7939 B16R2.2959 Ic1ccccc1CNCc2cncs2 270004a_100015347259_100000749870 [0,1,0,0,0,1|1,0,1]=4 7940 B16R2.2959 Ic1ccccc1CNCc2cncs2 270004a_100016987365_100000010305 [0,1,0,0,0,1|1,0,1]=4 7941 B16R2.2959 Ic1ccccc1CNCc2cocn2 207a_100015188801_100000010305 [0,1,0,0,0,1|1,0,0]=3 7942 B16R2.2959 Ic1ccccc1CNCc2cocn2 270004a_100015188801_100000010305 [0,1,0,0,0,1|1,0,0]=3 7943 B16R2.2959 Ic1ccccc1CNCc2cocn2 270004a_100015347259_100000050382 [0,1,0,0,0,1|1,0,0]=3 7944 B16R2.2959 Ic1ccccc1CNCc2cscn2 207a_100015185402_100000010305 [0,1,0,0,0,1|1,0,0]=3 7945 B16R2.2959 Ic1ccccc1CNCc2cscn2 207a_100015347259_100000743575 [0,1,0,0,0,1|1,0,0]=3 7946 B16R2.2959 Ic1ccccc1CNCc2cscn2 2230a_100015185402_100011215278 [0,1,0,0,0,1|1,0,0]=3 7947 B16R2.2959 Ic1ccccc1CNCc2cscn2 270004a_100015347259_100000743575 [0,1,0,0,0,1|1,0,0]=3 7948 B16R2.2959 Ic1ccccc1CNCc2csnn2 270004a_100015347259_100000738508 [0,1,0,0,0,1|2,0,0]=4 7949 B16R2.2959 Ic1ccccc1CNCc2ncc[nH]2 207a_100000754540_100000010305 [0,1,0,0,0,1|2,0,0]=4 7950 B16R2.2959 Ic1ccccc1CNCc2ncc[nH]2 207a_100015347259_100000743867 [0,1,0,0,0,1|2,0,0]=4 7951 B16R2.2959 Ic1ccccc1CNCc2ncc[nH]2 270004a_100000754540_100000010305 [0,1,0,0,0,1|2,0,0]=4 7952 B16R2.2959 Ic1ccccc1CNCc2ncco2 207a_100016994969_100000010305 [0,1,0,0,0,1|2,0,0]=4 7953 B16R2.2959 Ic1ccccc1CNCc2ncco2 2230a_100016994969_100011215278 [0,1,0,0,0,1|2,0,0]=4 7954 B16R2.2959 Ic1ccccc1CNCc2ncco2 270004a_100015347259_100000064290 [0,1,0,0,0,1|2,0,0]=4 7955 B16R2.2959 Ic1ccccc1CNCc2nccs2 207a_100000740555_100000010305 [0,1,0,0,0,1|2,0,0]=4 7956 B16R2.2959 Ic1ccccc1CNCc2nccs2 207a_100015347259_100000750902 [0,1,0,0,0,1|2,0,0]=4 7957 B16R2.2959 Ic1ccccc1CNCc2nccs2 2230a_100000740555_100011215278 [0,1,0,0,0,1|2,0,0]=4 7958 B16R2.2959 Ic1ccccc1CNCc2nccs2 270004a_100000740555_100000010305 [0,1,0,0,0,1|2,0,0]=4 7959 B16R2.2959 Ic1ccccc1CNCc2nccs2 270004a_100015347259_100000750902 [0,1,0,0,0,1|2,0,0]=4 7960 B16R2.2959 Ic1ccccc1COCc2c[nH]cn2 34a_100000187465_100000707719 [0,1,0,0,0,1|1,0,0]=3 7961 B16R2.2959 Ic1ccccc1COCc2cscn2 34a_100000187465_100000205941 [0,1,0,0,0,1|2,0,0]=4 7962 B16R2.2959 Ic1ccccc1COCc2cscn2 7a_100000187465_100000205941 [0,1,0,0,0,1|2,0,0]=4 7963 B16R2.2959 Ic1ccccc1CSCc2c[nH]cn2 62a_100000707719_100011216222 [0,1,0,0,0,1|1,0,0]=3 7964 B16R2.2959 Ic1ccccc1CSCc2c[nH]cn2 62a_100011216222_100000707719 [0,1,0,0,0,1|1,0,0]=3 7965 B16R2.2959 Ic1ccccc1CSCc2cscn2 62a_100000205941_100011216222 [0,1,0,0,0,1|2,0,0]=4 7966 B16R2.2959 Ic1ccccc1CSCc2cscn2 62a_100011216222_100000205941 [0,1,0,0,0,1|2,0,0]=4 7967 B16R2.2959 Ic1ccccc1NCCc2cccs2 34a_100000210053_100000748579 [0,1,0,0,0,1|2,0,0]=4 7968 B16R2.2959 Ic1ccccc1NCCn2cccn2 34a_100000210053_100015204718 [0,1,0,0,0,1|2,0,0]=4 7969 B16R2.2959 Ic1ccccc1NCCn2cncn2 34a_100000210053_200000749826 [0,1,0,0,0,1|1,0,1]=4 7970 B16R2.2959 Ic1ccccc1NN=Cc2cc[nH]c2 4a_100011218156_100000760201 [0,1,0,0,0,1|1,0,1]=4 7971 B16R2.2959 Ic1ccccc1NN=Cc2cocn2 4a_100011218156_100000050382 [0,1,0,0,0,1|1,0,1]=4 7972 B16R2.2959 Ic1ccccc1NN=Cc2cscn2 4a_100011218156_100000743575 [0,1,0,0,0,1|1,0,1]=4 7973 B16R2.2959 Ic1ccccc1OCCc2c[nH]cn2 7a_100000739446_100020628418 [0,1,0,0,0,1|1,0,0]=3 7974 B16R2.2959 Ic1ncccc1OCCc2c[nH]cn2 7a_100000034122_100020628418 [0,1,0,0,0,1|2,0,0]=4 7975 B16R2.2959 Nc1ccccc1COCc2c[nH]cn2 34a_100000212039_100000707719 [0,1,0,0,0,1|1,0,0]=3 7976 B16R2.2959 Nc1ccccc1COCc2cscn2 34a_100000212039_100000205941 [0,1,0,0,0,1|2,0,0]=4 7977 B16R2.2959 Nc1ccccc1OCCc2c[nH]cn2 7a_100000185747_100020628418 [0,1,0,0,0,1|1,0,0]=3 7978 B16R2.2959 Nc1ccccc1SCCc2c[nH]cn2 62a_100000210017_100020628418 [0,1,0,0,0,1|1,0,0]=3 7979 B16R2.2959 Nc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000210017 [0,1,0,0,0,1|1,0,0]=3 7980 B16R2.2959 Nc1cccnc1COCc2c[nH]cn2 34a_114873767017_100000707719 [0,1,0,0,0,1|2,0,0]=4 7981 B16R2.2959 Nc1cccnc1SCCc2c[nH]cn2 62a_100000688686_100020628418 [0,1,0,0,0,1|2,0,0]=4 7982 B16R2.2959 Nc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100000688686 [0,1,0,0,0,1|2,0,0]=4 7983 B16R2.2959 Nc1ccncc1SCCc2c[nH]cn2 62a_100000047001_100020628418 [0,1,0,0,0,1|2,0,0]=4 7984 B16R2.2959 Nc1ccncc1SCCc2c[nH]cn2 62a_100020628418_100000047001 [0,1,0,0,0,1|2,0,0]=4 7985 B16R2.2959 Nc1cnccc1SCCc2c[nH]cn2 62a_100000756074_100020628418 [0,1,0,0,0,1|2,0,0]=4 7986 B16R2.2959 Nc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100000756074 [0,1,0,0,0,1|2,0,0]=4 7987 B16R2.2959 Nc1cncnc1NCCc2c[nH]cn2 27a_100000755092_100000709731 [0,1,0,0,0,1|2,0,0]=4 7988 B16R2.2959 Nc1ncccc1OCCc2c[nH]cn2 7a_100000211975_100020628418 [0,1,0,0,0,1|2,0,0]=4 7989 B16R2.2959 Nc1ncccc1SCCc2c[nH]cn2 62a_100000045569_100020628418 [0,1,0,0,0,1|2,0,0]=4 7990 B16R2.2959 Nc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100000045569 [0,1,0,0,0,1|2,0,0]=4 7991 B16R2.2959 O=c1[nH]nccc1NCCc2c[nH]cn2 27a_100000755092_100000087129 [0,1,0,0,0,1|2,0,0]=4 7992 B16R2.2959 O=c1cc[nH]cc1SCCc2c[nH]cn2 62a_100009998708_100020628418 [0,1,0,0,0,1|2,0,0]=4 7993 B16R2.2959 O=c1cc[nH]cc1SCCc2c[nH]cn2 62a_100020628418_100009998708 [0,1,0,0,0,1|2,0,0]=4 7994 B16R2.2959 O=c1occcc1OCCc2c[nH]cn2 7a_100000077404_100020628418 [0,1,0,0,0,1|2,0,0]=4 7995 B16R2.2959 Oc1ccccc1CCSc2c[nH]cn2 62a_100000722297_100000756875 [0,1,0,0,0,1|1,0,0]=3 7996 B16R2.2959 Oc1ccccc1CCSc2c[nH]cn2 62a_100000756875_100000722297 [0,1,0,0,0,1|1,0,0]=3 7997 B16R2.2959 Oc1ccccc1CCSc2c[nH]nn2 62a_100000722297_100009819707 [0,1,0,0,0,1|2,0,0]=4 7998 B16R2.2959 Oc1ccccc1CCSc2c[nH]nn2 62a_100009819707_100000722297 [0,1,0,0,0,1|2,0,0]=4 7999 B16R2.2959 Oc1ccccc1CCSc2cscn2 62a_100000722297_100000751502 [0,1,0,0,0,1|2,0,0]=4 8000 B16R2.2959 Oc1ccccc1CCSc2cscn2 62a_100000751502_100000722297 [0,1,0,0,0,1|2,0,0]=4 8001 B16R2.2959 Oc1ccccc1CCSc2nc[nH]n2 62a_100000722297_100000761765 [0,1,0,0,0,1|2,0,0]=4 8002 B16R2.2959 Oc1ccccc1CCSc2nc[nH]n2 62a_100000761765_100000722297 [0,1,0,0,0,1|2,0,0]=4 8003 B16R2.2959 Oc1ccccc1CNCc2c[nH]cn2 34a_100000185550_100000707719 [0,1,0,0,0,1|0,0,0]=2 8004 B16R2.2959 Oc1ccccc1CNCc2cc[nH]n2 207a_100000185550_100000738523 [0,1,0,0,0,1|2,0,0]=4 8005 B16R2.2959 Oc1ccccc1CNCc2cc[nH]n2 270004a_100000185550_100000738523 [0,1,0,0,0,1|2,0,0]=4 8006 B16R2.2959 Oc1ccccc1CNCc2ccco2 207a_100000185550_100000186105 [0,1,0,0,0,1|2,0,0]=4 8007 B16R2.2959 Oc1ccccc1CNCc2ccco2 270004a_100000185550_100000186105 [0,1,0,0,0,1|2,0,0]=4 8008 B16R2.2959 Oc1ccccc1CNCc2cccs2 207a_100000185550_100000209959 [0,1,0,0,0,1|2,0,0]=4 8009 B16R2.2959 Oc1ccccc1CNCc2cccs2 270004a_100000185550_100000209959 [0,1,0,0,0,1|2,0,0]=4 8010 B16R2.2959 Oc1ccccc1CNCc2ccoc2 207a_100000185550_100011215517 [0,1,0,0,0,1|2,0,0]=4 8011 B16R2.2959 Oc1ccccc1CNCc2ccoc2 270004a_100000185550_100011215517 [0,1,0,0,0,1|2,0,0]=4 8012 B16R2.2959 Oc1ccccc1CNCc2ccon2 34a_100000185550_100000234950 [0,1,0,0,0,1|2,0,0]=4 8013 B16R2.2959 Oc1ccccc1CNCc2ccsc2 207a_100000185550_100000188534 [0,1,0,0,0,1|2,0,0]=4 8014 B16R2.2959 Oc1ccccc1CNCc2ccsc2 270004a_100000185550_100000188534 [0,1,0,0,0,1|2,0,0]=4 8015 B16R2.2959 Oc1ccccc1CNCc2ccsc2 34a_100000185550_100011261437 [0,1,0,0,0,1|2,0,0]=4 8016 B16R2.2959 Oc1ccccc1CNCc2cn[nH]c2 207a_100000185550_100016992096 [0,1,0,0,0,1|2,0,0]=4 8017 B16R2.2959 Oc1ccccc1CNCc2cn[nH]c2 270004a_100000185550_100016992096 [0,1,0,0,0,1|2,0,0]=4 8018 B16R2.2959 Oc1ccccc1CNCc2cnc[nH]2 207a_100000185550_100000742939 [0,1,0,0,0,1|0,0,2]=4 8019 B16R2.2959 Oc1ccccc1CNCc2cnco2 270004a_100000185550_100000064291 [0,1,0,0,0,1|1,0,1]=4 8020 B16R2.2959 Oc1ccccc1CNCc2cncs2 207a_100000185550_100000749870 [0,1,0,0,0,1|1,0,1]=4 8021 B16R2.2959 Oc1ccccc1CNCc2cncs2 270004a_100000185550_100000749870 [0,1,0,0,0,1|1,0,1]=4 8022 B16R2.2959 Oc1ccccc1CNCc2cncs2 34a_100000185550_100015185245 [0,1,0,0,0,1|1,0,1]=4 8023 B16R2.2959 Oc1ccccc1CNCc2cocn2 270004a_100000185550_100000050382 [0,1,0,0,0,1|1,0,0]=3 8024 B16R2.2959 Oc1ccccc1CNCc2cscn2 207a_100000185550_100000743575 [0,1,0,0,0,1|1,0,0]=3 8025 B16R2.2959 Oc1ccccc1CNCc2cscn2 270004a_100000185550_100000743575 [0,1,0,0,0,1|1,0,0]=3 8026 B16R2.2959 Oc1ccccc1CNCc2cscn2 34a_100000185550_100000205941 [0,1,0,0,0,1|1,0,0]=3 8027 B16R2.2959 Oc1ccccc1CNCc2csnn2 270004a_100000185550_100000738508 [0,1,0,0,0,1|2,0,0]=4 8028 B16R2.2959 Oc1ccccc1CNCc2ncc[nH]2 207a_100000185550_100000743867 [0,1,0,0,0,1|2,0,0]=4 8029 B16R2.2959 Oc1ccccc1CNCc2ncc[nH]2 34a_100000185550_100016991755 [0,1,0,0,0,1|2,0,0]=4 8030 B16R2.2959 Oc1ccccc1CNCc2ncco2 270004a_100000185550_100000064290 [0,1,0,0,0,1|2,0,0]=4 8031 B16R2.2959 Oc1ccccc1CNCc2ncco2 34a_100000185550_103436540062 [0,1,0,0,0,1|2,0,0]=4 8032 B16R2.2959 Oc1ccccc1CNCc2nccs2 207a_100000185550_100000750902 [0,1,0,0,0,1|2,0,0]=4 8033 B16R2.2959 Oc1ccccc1CNCc2nccs2 270004a_100000185550_100000750902 [0,1,0,0,0,1|2,0,0]=4 8034 B16R2.2959 Oc1ccccc1CNCc2nccs2 34a_100000185550_100015184050 [0,1,0,0,0,1|2,0,0]=4 8035 B16R2.2959 Oc1ccccc1CNCc2ncon2 34a_100000185550_100000233494 [0,1,0,0,0,1|2,0,0]=4 8036 B16R2.2959 Oc1ccccc1CNCn2cncn2 34a_100000185550_200020645497 [0,1,0,0,0,1|1,0,1]=4 8037 B16R2.2959 Oc1ccccc1NCCc2cccs2 34a_100000185747_100000748579 [0,1,0,0,0,1|2,0,0]=4 8038 B16R2.2959 Oc1ccccc1NCCn2cccn2 34a_100000185747_100015204718 [0,1,0,0,0,1|2,0,0]=4 8039 B16R2.2959 Oc1ccccc1NCCn2cncn2 34a_100000185747_200000749826 [0,1,0,0,0,1|1,0,1]=4 8040 B16R2.2959 Oc1ccccc1SCCc2c[nH]cn2 62a_100000739446_100020628418 [0,1,0,0,0,1|1,0,0]=3 8041 B16R2.2959 Oc1ccccc1SCCc2c[nH]cn2 62a_100020628418_100000739446 [0,1,0,0,0,1|1,0,0]=3 8042 B16R2.2959 Oc1cccnc1CSCc2c[nH]cn2 62a_100000707719_200020655725 [0,1,0,0,0,1|2,0,0]=4 8043 B16R2.2959 Oc1cccnc1CSCc2c[nH]cn2 62a_200020655725_100000707719 [0,1,0,0,0,1|2,0,0]=4 8044 B16R2.2959 Oc1cccnc1SCCc2c[nH]cn2 62a_100000034122_100020628418 [0,1,0,0,0,1|2,0,0]=4 8045 B16R2.2959 Oc1cccnc1SCCc2c[nH]cn2 62a_100020628418_100000034122 [0,1,0,0,0,1|2,0,0]=4 8046 B16R2.2959 Oc1cnccc1SCCc2c[nH]cn2 62a_100009817591_100020628418 [0,1,0,0,0,1|2,0,0]=4 8047 B16R2.2959 Oc1cnccc1SCCc2c[nH]cn2 62a_100020628418_100009817591 [0,1,0,0,0,1|2,0,0]=4 8048 B16R2.2959 Oc1ncccc1CNCc2c[nH]cn2 207a_100000758547_100011998315 [0,1,0,0,0,1|1,0,0]=3 8049 B16R2.2959 Oc1ncccc1CNCc2c[nH]nn2 207a_100020620823_100011998315 [0,1,0,0,0,1|2,0,0]=4 8050 B16R2.2959 Oc1ncccc1CNCc2c[nH]nn2 270004a_100020620823_100011998315 [0,1,0,0,0,1|2,0,0]=4 8051 B16R2.2959 Oc1ncccc1CNCc2cocn2 207a_100015188801_100011998315 [0,1,0,0,0,1|2,0,0]=4 8052 B16R2.2959 Oc1ncccc1CNCc2cocn2 270004a_100015188801_100011998315 [0,1,0,0,0,1|2,0,0]=4 8053 B16R2.2959 Oc1ncccc1CNCc2cscn2 207a_100015185402_100011998315 [0,1,0,0,0,1|2,0,0]=4 8054 B16R2.2959 Oc1ncccc1SCCc2c[nH]cn2 62a_100000760158_100020628418 [0,1,0,0,0,1|2,0,0]=4 8055 B16R2.2959 Oc1ncccc1SCCc2c[nH]cn2 62a_100020628418_100000760158 [0,1,0,0,0,1|2,0,0]=4 8056 B16R2.2959 S=c1cc[nH]cc1SCCc2c[nH]cn2 62a_100020628418_200012280681 [0,1,0,0,0,1|2,0,0]=4 8057 B16R2.2959 S=c1cc[nH]cc1SCCc2c[nH]cn2 62a_200012280681_100020628418 [0,1,0,0,0,1|2,0,0]=4 8058 B16R2.2959 [O-][n+]1ccccc1OCCc2c[nH]cn2 7a_100000211761_100020628418 [0,1,0,0,0,1|2,0,0]=4 8059 B16R2.2959 [O-][n+]1ccccc1SCCc2c[nH]cn2 62a_100020628418_200000042595 [0,1,0,0,0,1|2,0,0]=4 8060 B16R2.3250 Brc1[nH]cnc1C=NNc2ccccc2 4a_100015195140_100015192532 [0,1,0,0,0,1|0,0,1]=3 8061 B16R2.3250 Brc1[nH]cnc1C=NNc2ccccn2 4a_100000183288_100015192532 [0,1,0,0,0,1|1,0,1]=4 8062 B16R2.3250 Brc1[nH]cnc1C=NNc2cccnc2 4a_100000728903_100015192532 [0,1,0,0,0,1|1,0,1]=4 8063 B16R2.3250 Brc1[nH]cnc1C=NNc2ccncc2 4a_100000698918_100015192532 [0,1,0,0,0,1|1,0,1]=4 8064 B16R2.3250 Brc1ccoc1CNCc2ccccc2 270004a_100015324214_100000756499 [0,1,0,0,0,1|2,0,0]=4 8065 B16R2.3250 Brc1ccsc1CNCc2ccccc2 207a_100015324214_100000766043 [0,1,0,0,0,1|2,0,0]=4 8066 B16R2.3250 Brc1ccsc1CNCc2ccccc2 270004a_100015324214_100000766043 [0,1,0,0,0,1|2,0,0]=4 8067 B16R2.3250 Brc1cscc1CNCc2ccccc2 207a_100015324214_100000685484 [0,1,0,0,0,1|2,0,0]=4 8068 B16R2.3250 Brc1cscc1CNCc2ccccc2 270004a_100015324214_100000685484 [0,1,0,0,0,1|2,0,0]=4 8069 B16R2.3250 Brc1sccc1CNCc2ccccc2 207a_100000727803_100015611070 [0,1,0,0,0,1|2,0,0]=4 8070 B16R2.3250 Brc1sccc1CNCc2ccccc2 207a_100015324214_100009816921 [0,1,0,0,0,1|2,0,0]=4 8071 B16R2.3250 Brc1sccc1CNCc2ccccc2 2230a_100000727803_100015291786 [0,1,0,0,0,1|2,0,0]=4 8072 B16R2.3250 Brc1sccc1CNCc2ccccc2 2230a_100015324214_100009814289 [0,1,0,0,0,1|2,0,0]=4 8073 B16R2.3250 Brc1sccc1CNCc2ccccc2 270004a_100000727803_100015611070 [0,1,0,0,0,1|2,0,0]=4 8074 B16R2.3250 Brc1sccc1CNCc2ccccc2 270004a_100015324214_100009816921 [0,1,0,0,0,1|2,0,0]=4 8075 B16R2.3250 Brc1sccc1CNCc2ccccc2 34a_100000727803_100015291786 [0,1,0,0,0,1|2,0,0]=4 8076 B16R2.3250 Brc1sccc1CNCc2ccccc2 34a_100015324214_100009814289 [0,1,0,0,0,1|2,0,0]=4 8077 B16R2.3250 Cc1[nH]cnc1C=CCc2ccccc2 271570a_200016263579_100009816806 [0,1,0,0,0,1|1,0,1]=4 8078 B16R2.3250 Cc1[nH]cnc1C=NNc2ccccc2 4a_100015195140_100000032982 [0,1,0,0,0,1|0,0,1]=3 8079 B16R2.3250 Cc1[nH]cnc1C=NNc2ccccn2 4a_100000183288_100000032982 [0,1,0,0,0,1|1,0,1]=4 8080 B16R2.3250 Cc1[nH]cnc1C=NNc2cccnc2 4a_100000728903_100000032982 [0,1,0,0,0,1|1,0,1]=4 8081 B16R2.3250 Cc1[nH]cnc1C=NNc2ccncc2 4a_100000698918_100000032982 [0,1,0,0,0,1|1,0,1]=4 8082 B16R2.3250 Cc1[nH]cnc1CNCc2ccccc2 207a_100015324214_100000032982 [0,1,0,0,0,1|0,0,0]=2 8083 B16R2.3250 Cc1[nH]cnc1CNCc2ccccc2 2230a_100015324214_100000751220 [0,1,0,0,0,1|0,0,0]=2 8084 B16R2.3250 Cc1[nH]cnc1CNCc2cccnc2 207a_100000210453_100000032982 [0,1,0,0,0,1|1,0,0]=3 8085 B16R2.3250 Cc1[nH]cnc1CNCc2cccnn2 2230a_100159270163_100000751220 [0,1,0,0,0,1|2,0,0]=4 8086 B16R2.3250 Cc1[nH]cnc1CNCc2cncnc2 207a_100011243677_100000032982 [0,1,0,0,0,1|2,0,0]=4 8087 B16R2.3250 Cc1[nH]cnc1CNCc2cncnc2 2230a_100011243677_100000751220 [0,1,0,0,0,1|2,0,0]=4 8088 B16R2.3250 Cc1[nH]cnc1CSCc2ccccc2 62a_100000211182_100000751220 [0,1,0,0,0,1|1,0,0]=3 8089 B16R2.3250 Cc1[nH]cnc1CSCc2ccccc2 62a_100000751220_100015291786 [0,1,0,0,0,1|1,0,0]=3 8090 B16R2.3250 Cc1[nH]cnc1CSCc2ccccn2 62a_100000721315_100000751220 [0,1,0,0,0,1|2,0,0]=4 8091 B16R2.3250 Cc1[nH]cnc1CSCc2ccccn2 62a_100000751220_100000721315 [0,1,0,0,0,1|2,0,0]=4 8092 B16R2.3250 Cc1[nH]cnc1CSCc2cccnc2 62a_100000741622_100000751220 [0,1,0,0,0,1|2,0,0]=4 8093 B16R2.3250 Cc1[nH]cnc1CSCc2cccnc2 62a_100000751220_100000741622 [0,1,0,0,0,1|2,0,0]=4 8094 B16R2.3250 Cc1[nH]cnc1CSCc2ccncc2 62a_100000751220_100015193705 [0,1,0,0,0,1|2,0,0]=4 8095 B16R2.3250 Cc1[nH]cnc1CSCc2ccncc2 62a_100015193705_100000751220 [0,1,0,0,0,1|2,0,0]=4 8096 B16R2.3250 Cc1[nH]cnc1SCCc2ccccc2 62a_100000765856_100010186451 [0,1,0,0,0,1|1,0,0]=3 8097 B16R2.3250 Cc1[nH]cnc1SCCc2ccccc2 62a_100010186451_100011218657 [0,1,0,0,0,1|1,0,0]=3 8098 B16R2.3250 Cc1[nH]cnc1SCCc2ccccn2 62a_100010186451_100015183660 [0,1,0,0,0,1|2,0,0]=4 8099 B16R2.3250 Cc1[nH]cnc1SCCc2ccccn2 62a_100015183660_100010186451 [0,1,0,0,0,1|2,0,0]=4 8100 B16R2.3250 Cc1[nH]cnc1SCCc2cccnc2 62a_100010186451_200011713674 [0,1,0,0,0,1|2,0,0]=4 8101 B16R2.3250 Cc1[nH]cnc1SCCc2cccnc2 62a_200011713674_100010186451 [0,1,0,0,0,1|2,0,0]=4 8102 B16R2.3250 Cc1[nH]cnc1SCCc2ccncc2 62a_100000723409_100010186451 [0,1,0,0,0,1|2,0,0]=4 8103 B16R2.3250 Cc1[nH]cnc1SCCc2ccncc2 62a_100010186451_100000723409 [0,1,0,0,0,1|2,0,0]=4 8104 B16R2.3250 Cc1[nH]cnc1SCSc2ccccc2 62a_100010186451_100011218342 [0,1,0,0,0,1|1,0,0]=3 8105 B16R2.3250 Cc1[nH]cnc1SCSc2ccccc2 62a_100011218342_100010186451 [0,1,0,0,0,1|1,0,0]=3 8106 B16R2.3250 Cc1ccoc1CNCc2ccccc2 207a_100015324214_100000763527 [0,1,0,0,0,1|2,0,0]=4 8107 B16R2.3250 Cc1ccoc1CNCc2ccccc2 270004a_100015324214_100000763527 [0,1,0,0,0,1|2,0,0]=4 8108 B16R2.3250 Cc1ccsc1CNCc2ccccc2 207a_100000238519_100015611070 [0,1,0,0,0,1|2,0,0]=4 8109 B16R2.3250 Cc1ccsc1CNCc2ccccc2 207a_100015324214_100000210881 [0,1,0,0,0,1|2,0,0]=4 8110 B16R2.3250 Cc1ccsc1CNCc2ccccc2 2230a_100000238519_100015291786 [0,1,0,0,0,1|2,0,0]=4 8111 B16R2.3250 Cc1ccsc1CNCc2ccccc2 270004a_100000238519_100015611070 [0,1,0,0,0,1|2,0,0]=4 8112 B16R2.3250 Cc1ccsc1CNCc2ccccc2 270004a_100015324214_100000210881 [0,1,0,0,0,1|2,0,0]=4 8113 B16R2.3250 Cc1ccsc1CNCc2ccccc2 34a_100000238519_100015291786 [0,1,0,0,0,1|2,0,0]=4 8114 B16R2.3250 Cc1n[nH]cc1CNCc2ccccc2 207a_100000737071_100015611070 [0,1,0,0,0,1|2,0,0]=4 8115 B16R2.3250 Cc1n[nH]cc1CNCc2ccccc2 207a_100015324214_100000737037 [0,1,0,0,0,1|2,0,0]=4 8116 B16R2.3250 Cc1n[nH]cc1CNCc2ccccc2 270004a_100000737071_100015611070 [0,1,0,0,0,1|2,0,0]=4 8117 B16R2.3250 Cc1ncsc1CCNc2ccccc2 34a_100000106764_100000057103 [0,1,0,0,0,1|1,0,1]=4 8118 B16R2.3250 Cc1ncsc1CNCc2ccccc2 207a_100000752186_100015611070 [0,1,0,0,0,1|1,0,1]=4 8119 B16R2.3250 Cc1ncsc1CNCc2ccccc2 207a_100015324214_100000764165 [0,1,0,0,0,1|1,0,1]=4 8120 B16R2.3250 Cc1ncsc1CNCc2ccccc2 2230a_100000752186_100015291786 [0,1,0,0,0,1|1,0,1]=4 8121 B16R2.3250 Cc1ncsc1CNCc2ccccc2 270004a_100000752186_100015611070 [0,1,0,0,0,1|1,0,1]=4 8122 B16R2.3250 Cc1nonc1CNCc2ccccc2 207a_100000756898_100015611070 [0,1,0,0,0,1|1,0,1]=4 8123 B16R2.3250 Cc1nonc1CNCc2ccccc2 2230a_100015324214_200000044682 [0,1,0,0,0,1|1,0,1]=4 8124 B16R2.3250 Cc1nonc1CNCc2ccccc2 270004a_100000756898_100015611070 [0,1,0,0,0,1|1,0,1]=4 8125 B16R2.3250 Cc1nonc1CNCc2ccccc2 34a_100015324214_200000044682 [0,1,0,0,0,1|1,0,1]=4 8126 B16R2.3250 Cc1ocnc1CNCc2ccccc2 2230a_100015324214_200000693990 [0,1,0,0,0,1|1,0,0]=3 8127 B16R2.3250 Cc1ocnc1CNCc2ccccc2 34a_100015324214_200000693990 [0,1,0,0,0,1|1,0,0]=3 8128 B16R2.3250 Cc1ocnc1COCc2ccccc2 34a_100000210790_200000693990 [0,1,0,0,0,1|2,0,0]=4 8129 B16R2.3250 Cc1ocnc1COCc2ccccc2 34a_100012017639_100015291786 [0,1,0,0,0,1|2,0,0]=4 8130 B16R2.3250 Cc1ocnc1COCc2ccccc2 7a_100000210790_200000693990 [0,1,0,0,0,1|2,0,0]=4 8131 B16R2.3250 Cc1ocnc1CSCc2ccccc2 62a_100000211182_200000693990 [0,1,0,0,0,1|2,0,0]=4 8132 B16R2.3250 Cc1ocnc1CSCc2ccccc2 62a_200000693990_100015291786 [0,1,0,0,0,1|2,0,0]=4 8133 B16R2.3250 Cc1scnc1SCCc2ccccc2 62a_100000732656_100011218657 [0,1,0,0,0,1|2,0,0]=4 8134 B16R2.3250 Cc1scnc1SCCc2ccccc2 62a_100000765856_100000732656 [0,1,0,0,0,1|2,0,0]=4 8135 B16R2.3250 Cc1scnc1SCSc2ccccc2 62a_100000732656_100011218342 [0,1,0,0,0,1|2,0,0]=4 8136 B16R2.3250 Cc1scnc1SCSc2ccccc2 62a_100011218342_100000732656 [0,1,0,0,0,1|2,0,0]=4 8137 B16R2.3250 Clc1c[nH]nc1CNCc2ccccc2 207a_100015324214_100000040271 [0,1,0,0,0,1|2,0,0]=4 8138 B16R2.3250 Clc1c[nH]nc1CNCc2ccccc2 270004a_100015324214_100000040271 [0,1,0,0,0,1|2,0,0]=4 8139 B16R2.3250 Clc1ccsc1CNCc2ccccc2 207a_100011934584_100015611070 [0,1,0,0,0,1|2,0,0]=4 8140 B16R2.3250 Clc1ccsc1CNCc2ccccc2 207a_100015324214_100000722334 [0,1,0,0,0,1|2,0,0]=4 8141 B16R2.3250 Clc1ccsc1CNCc2ccccc2 2230a_100011934584_100015291786 [0,1,0,0,0,1|2,0,0]=4 8142 B16R2.3250 Clc1ccsc1CNCc2ccccc2 270004a_100011934584_100015611070 [0,1,0,0,0,1|2,0,0]=4 8143 B16R2.3250 Clc1ccsc1CNCc2ccccc2 270004a_100015324214_100000722334 [0,1,0,0,0,1|2,0,0]=4 8144 B16R2.3250 Clc1ccsc1CNCc2ccccc2 34a_100011934584_100015291786 [0,1,0,0,0,1|2,0,0]=4 8145 B16R2.3250 Clc1sccc1CNCc2ccccc2 207a_100015324214_100000089901 [0,1,0,0,0,1|2,0,0]=4 8146 B16R2.3250 Clc1sccc1CNCc2ccccc2 2230a_100015324214_100010167017 [0,1,0,0,0,1|2,0,0]=4 8147 B16R2.3250 Clc1sccc1CNCc2ccccc2 270004a_100015324214_100000089901 [0,1,0,0,0,1|2,0,0]=4 8148 B16R2.3250 Clc1sccc1CNCc2ccccc2 34a_100015324214_100010167017 [0,1,0,0,0,1|2,0,0]=4 8149 B16R2.3250 Clc1snnc1CNCc2ccccc2 2230a_100015324214_100000018852 [0,1,0,0,0,1|2,0,0]=4 8150 B16R2.3250 Cn1cccc1CNCc2ccccc2 270004a_100015324214_100000211633 [0,1,0,0,0,1|1,0,1]=4 8151 B16R2.3250 Cn1cccc1CNCc2ccccc2 34a_100011219357_100015291786 [0,1,0,0,0,1|1,0,1]=4 8152 B16R2.3250 Cn1ccnc1CNCc2ccccc2 207a_100015186572_100015611070 [0,1,0,0,0,1|2,0,0]=4 8153 B16R2.3250 Cn1ccnc1CNCc2ccccc2 207a_100015324214_100000748660 [0,1,0,0,0,1|2,0,0]=4 8154 B16R2.3250 Cn1ccnc1CNCc2ccccc2 2230a_100015186572_100015291786 [0,1,0,0,0,1|2,0,0]=4 8155 B16R2.3250 Cn1ccnc1CNCc2ccccc2 2230a_100015324214_100000700302 [0,1,0,0,0,1|2,0,0]=4 8156 B16R2.3250 Cn1ccnc1CNCc2ccccc2 270004a_100015186572_100015611070 [0,1,0,0,0,1|2,0,0]=4 8157 B16R2.3250 Cn1ccnc1CNCc2ccccc2 270004a_100015324214_100000748660 [0,1,0,0,0,1|2,0,0]=4 8158 B16R2.3250 Cn1ccnc1CNCc2ccccc2 34a_100015324214_100000700302 [0,1,0,0,0,1|2,0,0]=4 8159 B16R2.3250 Cn1cncc1CNCc2ccccc2 207a_100000732891_100015611070 [0,1,0,0,0,1|0,0,2]=4 8160 B16R2.3250 Cn1cncc1CNCc2ccccc2 207a_100015324214_100000750899 [0,1,0,0,0,1|0,0,2]=4 8161 B16R2.3250 Cn1cncc1CNCc2ccccc2 270004a_100000732891_100015611070 [0,1,0,0,0,1|0,0,2]=4 8162 B16R2.3250 Cn1cncc1CNCc2ccccc2 270004a_100015324214_100000750899 [0,1,0,0,0,1|0,0,2]=4 8163 B16R2.5767 CC(CSc1c[nH]cn1)c2ccccc2 62a_100000756875_100000756946 [0,1,0,0,0,1|1,0,0]=3 8164 B16R2.5767 CC(CSc1c[nH]cn1)c2ccccc2 62a_100000756946_100000756875 [0,1,0,0,0,1|1,0,0]=3 8165 B16R2.5767 CC(CSc1c[nH]nn1)c2ccccc2 62a_100000756946_100009819707 [0,1,0,0,0,1|2,0,0]=4 8166 B16R2.5767 CC(CSc1c[nH]nn1)c2ccccc2 62a_100009819707_100000756946 [0,1,0,0,0,1|2,0,0]=4 8167 B16R2.5767 CC(CSc1cscn1)c2ccccc2 62a_100000751502_100000756946 [0,1,0,0,0,1|2,0,0]=4 8168 B16R2.5767 CC(CSc1cscn1)c2ccccc2 62a_100000756946_100000751502 [0,1,0,0,0,1|2,0,0]=4 8169 B16R2.5767 CC(CSc1nc[nH]n1)c2ccccc2 62a_100000756946_100000761765 [0,1,0,0,0,1|2,0,0]=4 8170 B16R2.5767 CC(CSc1nc[nH]n1)c2ccccc2 62a_100000761765_100000756946 [0,1,0,0,0,1|2,0,0]=4 8171 B16R2.5767 CC(NCc1c[nH]cn1)c2ccccn2 2230a_100000181244_100000707719 [0,1,0,0,0,1|1,0,0]=3 8172 B16R2.5767 CC(NCc1c[nH]cn1)c2cccnc2 2230a_100000195435_100000707719 [0,1,0,0,0,1|1,0,0]=3 8173 B16R2.5767 CC(NCc1c[nH]cn1)c2ccncc2 2230a_100000181269_100000707719 [0,1,0,0,0,1|1,0,0]=3 8174 B16R2.5767 CC(NCc1c[nH]cn1)c2ncccn2 2230a_100020641698_100000707719 [0,1,0,0,0,1|2,0,0]=4 8175 B16R2.5767 CC(NCc1cc[nH]n1)c2ccccc2 269862a_100000739516_100000185851 [0,1,0,0,0,1|2,0,0]=4 8176 B16R2.5767 CC(NCc1ccco1)c2ccccc2 2230a_100000185738_100000230085 [0,1,0,0,0,1|2,0,0]=4 8177 B16R2.5767 CC(NCc1ccco1)c2ccccc2 34a_100000185738_100000211855 [0,1,0,0,0,1|2,0,0]=4 8178 B16R2.5767 CC(NCc1cccs1)c2ccccc2 2230a_100000211653_100000230085 [0,1,0,0,0,1|2,0,0]=4 8179 B16R2.5767 CC(NCc1cccs1)c2ccccc2 269862a_100000211653_100000185851 [0,1,0,0,0,1|2,0,0]=4 8180 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 2230a_100015206860_100000230085 [0,1,0,0,0,1|2,0,0]=4 8181 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 269862a_100015206860_100000185851 [0,1,0,0,0,1|2,0,0]=4 8182 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 34a_100015206860_100000211855 [0,1,0,0,0,1|2,0,0]=4 8183 B16R2.5767 CC(NCc1ccon1)c2ccccc2 269862a_100000688301_100000185851 [0,1,0,0,0,1|2,0,0]=4 8184 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 2230a_100000186416_100000230085 [0,1,0,0,0,1|2,0,0]=4 8185 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 269862a_100000186416_100000185851 [0,1,0,0,0,1|2,0,0]=4 8186 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 34a_100000186416_100000211855 [0,1,0,0,0,1|2,0,0]=4 8187 B16R2.5767 CC(NCc1cnco1)c2ccccc2 269862a_100020634212_100000185851 [0,1,0,0,0,1|1,0,1]=4 8188 B16R2.5767 CC(NCc1cncs1)c2ccccc2 2230a_100016987365_100000230085 [0,1,0,0,0,1|1,0,1]=4 8189 B16R2.5767 CC(NCc1cncs1)c2ccccc2 269862a_100016987365_100000185851 [0,1,0,0,0,1|1,0,1]=4 8190 B16R2.5767 CC(NCc1cocn1)c2ccccc2 269862a_100015188801_100000185851 [0,1,0,0,0,1|1,0,0]=3 8191 B16R2.5767 CC(NCc1cocn1)c2ccccn2 269862a_100015188801_100000210467 [0,1,0,0,0,1|2,0,0]=4 8192 B16R2.5767 CC(NCc1cocn1)c2ccccn2 270004a_100000181244_100000050382 [0,1,0,0,0,1|2,0,0]=4 8193 B16R2.5767 CC(NCc1cocn1)c2cccnc2 269862a_100015188801_100000210468 [0,1,0,0,0,1|2,0,0]=4 8194 B16R2.5767 CC(NCc1cocn1)c2cccnc2 270004a_100000195435_100000050382 [0,1,0,0,0,1|2,0,0]=4 8195 B16R2.5767 CC(NCc1cocn1)c2ccncc2 269862a_100015188801_100000185792 [0,1,0,0,0,1|2,0,0]=4 8196 B16R2.5767 CC(NCc1cocn1)c2ccncc2 270004a_100000181269_100000050382 [0,1,0,0,0,1|2,0,0]=4 8197 B16R2.5767 CC(NCc1cscn1)c2ccccc2 2230a_100015185402_100000230085 [0,1,0,0,0,1|1,0,0]=3 8198 B16R2.5767 CC(NCc1cscn1)c2ccccc2 269862a_100015185402_100000185851 [0,1,0,0,0,1|1,0,0]=3 8199 B16R2.5767 CC(NCc1cscn1)c2ccccn2 207a_100000181244_100000743575 [0,1,0,0,0,1|2,0,0]=4 8200 B16R2.5767 CC(NCc1cscn1)c2ccccn2 2230a_100000181244_100000205941 [0,1,0,0,0,1|2,0,0]=4 8201 B16R2.5767 CC(NCc1cscn1)c2ccccn2 269862a_100015185402_100000210467 [0,1,0,0,0,1|2,0,0]=4 8202 B16R2.5767 CC(NCc1cscn1)c2ccccn2 270004a_100000181244_100000743575 [0,1,0,0,0,1|2,0,0]=4 8203 B16R2.5767 CC(NCc1cscn1)c2cccnc2 207a_100000195435_100000743575 [0,1,0,0,0,1|2,0,0]=4 8204 B16R2.5767 CC(NCc1cscn1)c2cccnc2 2230a_100000195435_100000205941 [0,1,0,0,0,1|2,0,0]=4 8205 B16R2.5767 CC(NCc1cscn1)c2cccnc2 269862a_100015185402_100000210468 [0,1,0,0,0,1|2,0,0]=4 8206 B16R2.5767 CC(NCc1cscn1)c2cccnc2 270004a_100000195435_100000743575 [0,1,0,0,0,1|2,0,0]=4 8207 B16R2.5767 CC(NCc1cscn1)c2ccncc2 207a_100000181269_100000743575 [0,1,0,0,0,1|2,0,0]=4 8208 B16R2.5767 CC(NCc1cscn1)c2ccncc2 2230a_100000181269_100000205941 [0,1,0,0,0,1|2,0,0]=4 8209 B16R2.5767 CC(NCc1cscn1)c2ccncc2 269862a_100015185402_100000185792 [0,1,0,0,0,1|2,0,0]=4 8210 B16R2.5767 CC(NCc1cscn1)c2ccncc2 270004a_100000181269_100000743575 [0,1,0,0,0,1|2,0,0]=4 8211 B16R2.5767 CC(NCc1ncco1)c2ccccc2 2230a_100016994969_100000230085 [0,1,0,0,0,1|2,0,0]=4 8212 B16R2.5767 CC(NCc1nccs1)c2ccccc2 2230a_100000740555_100000230085 [0,1,0,0,0,1|2,0,0]=4 8213 B16R2.5767 CC(NCc1nccs1)c2ccccc2 269862a_100000740555_100000185851 [0,1,0,0,0,1|2,0,0]=4 8214 B16R2.5767 CC(SCc1c[nH]cn1)c2ccccc2 62a_100000230085_100000707719 [0,1,0,0,0,1|1,0,0]=3 8215 B16R2.5767 CC(SCc1c[nH]cn1)c2ccccc2 62a_100000707719_100000230085 [0,1,0,0,0,1|1,0,0]=3 8216 B16R2.5767 CC(SCc1cscn1)c2ccccc2 62a_100000205941_100000230085 [0,1,0,0,0,1|2,0,0]=4 8217 B16R2.5767 CC(SCc1cscn1)c2ccccc2 62a_100000230085_100000205941 [0,1,0,0,0,1|2,0,0]=4 8218 B16R2.5767 CN(CCc1c[nH]cn1)c2ccccc2 2230a_100000210012_100020628418 [0,1,0,0,0,1|0,0,0]=2 8219 B16R2.5767 CN(CCc1c[nH]cn1)c2ccccc2 269982a_100000210012_100020628418 [0,1,0,0,0,1|0,0,0]=2 8220 B16R2.5767 CN(CCc1cccs1)c2ccccc2 2230a_100000210012_100000748579 [0,1,0,0,0,1|2,0,0]=4 8221 B16R2.5767 CN(CCc1cccs1)c2ccccc2 269982a_100000210012_100000748579 [0,1,0,0,0,1|2,0,0]=4 8222 B16R2.5767 CN(CCc1cccs1)c2ccccc2 34a_100000210012_100000748579 [0,1,0,0,0,1|2,0,0]=4 8223 B16R2.5767 CN(CCc1cn[nH]c1)c2ccccc2 2230a_100000210012_100000743252 [0,1,0,0,0,1|2,0,0]=4 8224 B16R2.5767 CN(CCc1cn[nH]c1)c2ccccc2 269982a_100000210012_100000743252 [0,1,0,0,0,1|2,0,0]=4 8225 B16R2.5767 CN(CCn1cccn1)c2ccccc2 2230a_100000210012_100000685285 [0,1,0,0,0,1|2,0,0]=4 8226 B16R2.5767 CN(CCn1cccn1)c2ccccc2 269982a_100000210012_100000685285 [0,1,0,0,0,1|2,0,0]=4 8227 B16R2.5767 CN(CCn1cccn1)c2ccccc2 34a_100000210012_100015204718 [0,1,0,0,0,1|2,0,0]=4 8228 B16R2.5767 CN(CCn1cncn1)c2ccccc2 2230a_100000210012_100000731791 [0,1,0,0,0,1|1,0,1]=4 8229 B16R2.5767 CN(CCn1cncn1)c2ccccc2 269982a_100000210012_100000731791 [0,1,0,0,0,1|1,0,1]=4 8230 B16R2.5767 CN(CCn1cncn1)c2ccccc2 34a_100000210012_200000749826 [0,1,0,0,0,1|1,0,1]=4 8231 B16R2.5767 C[C@@H](NCc1c[nH]cn1)c2ccccc2 2230a_100000751104_100000707719 [0,1,0,0,0,1|0,0,0]=2 8232 B16R2.5767 C[C@@H](NCc1c[nH]cn1)c2cnccn2 2230a_100020589798_100000707719 [0,1,0,0,0,1|2,0,0]=4 8233 B16R2.5767 C[C@@H](NCc1cc[nH]n1)c2ccccc2 207a_100000751104_100000738523 [0,1,0,0,0,1|2,0,0]=4 8234 B16R2.5767 C[C@@H](NCc1cc[nH]n1)c2ccccc2 270004a_100000751104_100000738523 [0,1,0,0,0,1|2,0,0]=4 8235 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 207a_100000751104_100000186105 [0,1,0,0,0,1|2,0,0]=4 8236 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 270004a_100000751104_100000186105 [0,1,0,0,0,1|2,0,0]=4 8237 B16R2.5767 C[C@@H](NCc1cccs1)c2ccccc2 207a_100000751104_100000209959 [0,1,0,0,0,1|2,0,0]=4 8238 B16R2.5767 C[C@@H](NCc1cccs1)c2ccccc2 270004a_100000751104_100000209959 [0,1,0,0,0,1|2,0,0]=4 8239 B16R2.5767 C[C@@H](NCc1ccoc1)c2ccccc2 207a_100000751104_100011215517 [0,1,0,0,0,1|2,0,0]=4 8240 B16R2.5767 C[C@@H](NCc1ccoc1)c2ccccc2 270004a_100000751104_100011215517 [0,1,0,0,0,1|2,0,0]=4 8241 B16R2.5767 C[C@@H](NCc1ccon1)c2ccccc2 2230a_100000751104_100000234950 [0,1,0,0,0,1|2,0,0]=4 8242 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 207a_100000751104_100000188534 [0,1,0,0,0,1|2,0,0]=4 8243 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 2230a_100000751104_100011261437 [0,1,0,0,0,1|2,0,0]=4 8244 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 270004a_100000751104_100000188534 [0,1,0,0,0,1|2,0,0]=4 8245 B16R2.5767 C[C@@H](NCc1cn[nH]c1)c2ccccc2 207a_100000751104_100016992096 [0,1,0,0,0,1|2,0,0]=4 8246 B16R2.5767 C[C@@H](NCc1cn[nH]c1)c2ccccc2 270004a_100000751104_100016992096 [0,1,0,0,0,1|2,0,0]=4 8247 B16R2.5767 C[C@@H](NCc1cnc[nH]1)c2ccccc2 207a_100000751104_100000742939 [0,1,0,0,0,1|0,0,2]=4 8248 B16R2.5767 C[C@@H](NCc1cnco1)c2ccccc2 270004a_100000751104_100000064291 [0,1,0,0,0,1|1,0,1]=4 8249 B16R2.5767 C[C@@H](NCc1cncs1)c2ccccc2 207a_100000751104_100000749870 [0,1,0,0,0,1|1,0,1]=4 8250 B16R2.5767 C[C@@H](NCc1cncs1)c2ccccc2 2230a_100000751104_100015185245 [0,1,0,0,0,1|1,0,1]=4 8251 B16R2.5767 C[C@@H](NCc1cncs1)c2ccccc2 270004a_100000751104_100000749870 [0,1,0,0,0,1|1,0,1]=4 8252 B16R2.5767 C[C@@H](NCc1cocn1)c2ccccc2 270004a_100000751104_100000050382 [0,1,0,0,0,1|1,0,0]=3 8253 B16R2.5767 C[C@@H](NCc1cscn1)c2ccccc2 207a_100000751104_100000743575 [0,1,0,0,0,1|1,0,0]=3 8254 B16R2.5767 C[C@@H](NCc1cscn1)c2ccccc2 2230a_100000751104_100000205941 [0,1,0,0,0,1|1,0,0]=3 8255 B16R2.5767 C[C@@H](NCc1cscn1)c2ccccc2 270004a_100000751104_100000743575 [0,1,0,0,0,1|1,0,0]=3 8256 B16R2.5767 C[C@@H](NCc1csnn1)c2ccccc2 270004a_100000751104_100000738508 [0,1,0,0,0,1|2,0,0]=4 8257 B16R2.5767 C[C@@H](NCc1ncc[nH]1)c2ccccc2 207a_100000751104_100000743867 [0,1,0,0,0,1|2,0,0]=4 8258 B16R2.5767 C[C@@H](NCc1ncc[nH]1)c2ccccc2 2230a_100000751104_100016991755 [0,1,0,0,0,1|2,0,0]=4 8259 B16R2.5767 C[C@@H](NCc1ncco1)c2ccccc2 2230a_100000751104_103436540062 [0,1,0,0,0,1|2,0,0]=4 8260 B16R2.5767 C[C@@H](NCc1ncco1)c2ccccc2 270004a_100000751104_100000064290 [0,1,0,0,0,1|2,0,0]=4 8261 B16R2.5767 C[C@@H](NCc1nccs1)c2ccccc2 207a_100000751104_100000750902 [0,1,0,0,0,1|2,0,0]=4 8262 B16R2.5767 C[C@@H](NCc1nccs1)c2ccccc2 2230a_100000751104_100015184050 [0,1,0,0,0,1|2,0,0]=4 8263 B16R2.5767 C[C@@H](NCc1nccs1)c2ccccc2 270004a_100000751104_100000750902 [0,1,0,0,0,1|2,0,0]=4 8264 B16R2.5767 C[C@@H](NCn1cncn1)c2ccccc2 2230a_100000751104_200020645497 [0,1,0,0,0,1|1,0,1]=4 8265 B16R2.5767 C[C@@H](OCc1c[nH]cn1)c2ccccc2 34a_100000761318_100000707719 [0,1,0,0,0,1|1,0,0]=3 8266 B16R2.5767 C[C@@H](OCc1cscn1)c2ccccc2 34a_100000761318_100000205941 [0,1,0,0,0,1|2,0,0]=4 8267 B16R2.5767 C[C@@H](OCc1cscn1)c2ccccc2 7a_100000761318_100000205941 [0,1,0,0,0,1|2,0,0]=4 8268 B16R2.5767 O=C(CCc1c[nH]cn1)c2ccccc2 1458a_100000185807_100020628418 [0,1,0,0,0,1|1,0,0]=3 8269 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccccc2 62a_100000211460_100000756875 [0,1,0,0,0,1|1,0,0]=3 8270 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccccc2 62a_100000756875_100000211460 [0,1,0,0,0,1|1,0,0]=3 8271 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccccn2 62a_100000027445_100000756875 [0,1,0,0,0,1|2,0,0]=4 8272 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccccn2 62a_100000756875_100000027445 [0,1,0,0,0,1|2,0,0]=4 8273 B16R2.5767 O=C(CSc1c[nH]cn1)c2cccnc2 62a_100000756875_100000757877 [0,1,0,0,0,1|2,0,0]=4 8274 B16R2.5767 O=C(CSc1c[nH]cn1)c2cccnc2 62a_100000757877_100000756875 [0,1,0,0,0,1|2,0,0]=4 8275 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccncc2 62a_100000027454_100000756875 [0,1,0,0,0,1|2,0,0]=4 8276 B16R2.5767 O=C(CSc1c[nH]cn1)c2ccncc2 62a_100000756875_100000027454 [0,1,0,0,0,1|2,0,0]=4 8277 B16R2.5767 O=C(CSc1c[nH]nn1)c2ccccc2 62a_100000211460_100009819707 [0,1,0,0,0,1|2,0,0]=4 8278 B16R2.5767 O=C(CSc1c[nH]nn1)c2ccccc2 62a_100009819707_100000211460 [0,1,0,0,0,1|2,0,0]=4 8279 B16R2.5767 O=C(CSc1cscn1)c2ccccc2 62a_100000211460_100000751502 [0,1,0,0,0,1|2,0,0]=4 8280 B16R2.5767 O=C(CSc1cscn1)c2ccccc2 62a_100000751502_100000211460 [0,1,0,0,0,1|2,0,0]=4 8281 B16R2.5767 O=C(CSc1nc[nH]n1)c2ccccc2 62a_100000211460_100000761765 [0,1,0,0,0,1|2,0,0]=4 8282 B16R2.5767 O=C(CSc1nc[nH]n1)c2ccccc2 62a_100000761765_100000211460 [0,1,0,0,0,1|2,0,0]=4 8283 B16R2.5767 O=C(NCc1c[nH]cn1)c2ccccc2 11a_100000758547_100000185807 [0,1,0,0,0,1|0,0,0]=2 8284 B16R2.5767 O=C(NCc1c[nH]cn1)c2ccccc2 240690a_100000758547_100000185807 [0,1,0,0,0,1|0,0,0]=2 8285 B16R2.5767 O=C(NCc1c[nH]cn1)c2ccccc2 527a_100000758547_100000185807 [0,1,0,0,0,1|0,0,0]=2 8286 B16R2.5767 O=C(NCc1c[nH]nn1)c2ccccc2 11a_100020620823_100000185807 [0,1,0,0,0,1|1,0,0]=3 8287 B16R2.5767 O=C(NCc1c[nH]nn1)c2ccccc2 240690a_100020620823_100000185807 [0,1,0,0,0,1|1,0,0]=3 8288 B16R2.5767 O=C(NCc1c[nH]nn1)c2ccccc2 527a_100020620823_100000185807 [0,1,0,0,0,1|1,0,0]=3 8289 B16R2.5767 O=C(NCc1cc[nH]n1)c2ccccc2 11a_100000739516_100000185807 [0,1,0,0,0,1|2,0,0]=4 8290 B16R2.5767 O=C(NCc1cc[nH]n1)c2ccccc2 240690a_100000739516_100000185807 [0,1,0,0,0,1|2,0,0]=4 8291 B16R2.5767 O=C(NCc1cc[nH]n1)c2ccccc2 527a_100000739516_100000185807 [0,1,0,0,0,1|2,0,0]=4 8292 B16R2.5767 O=C(NCc1ccc[nH]1)c2ccccc2 11a_100000764082_100000185807 [0,1,0,0,0,1|1,0,1]=4 8293 B16R2.5767 O=C(NCc1ccc[nH]1)c2ccccc2 240690a_100000764082_100000185807 [0,1,0,0,0,1|1,0,1]=4 8294 B16R2.5767 O=C(NCc1ccc[nH]1)c2ccccc2 527a_100000764082_100000185807 [0,1,0,0,0,1|1,0,1]=4 8295 B16R2.5767 O=C(NCc1ccco1)c2ccccc2 11a_100000185738_100000185807 [0,1,0,0,0,1|2,0,0]=4 8296 B16R2.5767 O=C(NCc1ccco1)c2ccccc2 1626a_100000185738_100000185807 [0,1,0,0,0,1|2,0,0]=4 8297 B16R2.5767 O=C(NCc1ccco1)c2ccccc2 240690a_100000185738_100000185807 [0,1,0,0,0,1|2,0,0]=4 8298 B16R2.5767 O=C(NCc1ccco1)c2ccccc2 527a_100000185738_100000185807 [0,1,0,0,0,1|2,0,0]=4 8299 B16R2.5767 O=C(NCc1cccs1)c2ccccc2 11a_100000211653_100000185807 [0,1,0,0,0,1|2,0,0]=4 8300 B16R2.5767 O=C(NCc1cccs1)c2ccccc2 1626a_100000211653_100000185807 [0,1,0,0,0,1|2,0,0]=4 8301 B16R2.5767 O=C(NCc1cccs1)c2ccccc2 240690a_100000211653_100000185807 [0,1,0,0,0,1|2,0,0]=4 8302 B16R2.5767 O=C(NCc1cccs1)c2ccccc2 527a_100000211653_100000185807 [0,1,0,0,0,1|2,0,0]=4 8303 B16R2.5767 O=C(NCc1ccoc1)c2ccccc2 11a_100015206860_100000185807 [0,1,0,0,0,1|2,0,0]=4 8304 B16R2.5767 O=C(NCc1ccoc1)c2ccccc2 1626a_100015206860_100000185807 [0,1,0,0,0,1|2,0,0]=4 8305 B16R2.5767 O=C(NCc1ccoc1)c2ccccc2 240690a_100015206860_100000185807 [0,1,0,0,0,1|2,0,0]=4 8306 B16R2.5767 O=C(NCc1ccoc1)c2ccccc2 527a_100015206860_100000185807 [0,1,0,0,0,1|2,0,0]=4 8307 B16R2.5767 O=C(NCc1ccon1)c2ccccc2 11a_100000688301_100000185807 [0,1,0,0,0,1|2,0,0]=4 8308 B16R2.5767 O=C(NCc1ccon1)c2ccccc2 240690a_100000688301_100000185807 [0,1,0,0,0,1|2,0,0]=4 8309 B16R2.5767 O=C(NCc1ccon1)c2ccccc2 527a_100000688301_100000185807 [0,1,0,0,0,1|2,0,0]=4 8310 B16R2.5767 O=C(NCc1ccsc1)c2ccccc2 11a_100000186416_100000185807 [0,1,0,0,0,1|2,0,0]=4 8311 B16R2.5767 O=C(NCc1ccsc1)c2ccccc2 1626a_100000186416_100000185807 [0,1,0,0,0,1|2,0,0]=4 8312 B16R2.5767 O=C(NCc1ccsc1)c2ccccc2 240690a_100000186416_100000185807 [0,1,0,0,0,1|2,0,0]=4 8313 B16R2.5767 O=C(NCc1ccsc1)c2ccccc2 527a_100000186416_100000185807 [0,1,0,0,0,1|2,0,0]=4 8314 B16R2.5767 O=C(NCc1cn[nH]c1)c2ccccc2 11a_100000737208_100000185807 [0,1,0,0,0,1|2,0,0]=4 8315 B16R2.5767 O=C(NCc1cn[nH]c1)c2ccccc2 240690a_100000737208_100000185807 [0,1,0,0,0,1|2,0,0]=4 8316 B16R2.5767 O=C(NCc1cnco1)c2ccccc2 11a_100020634212_100000185807 [0,1,0,0,0,1|1,0,1]=4 8317 B16R2.5767 O=C(NCc1cnco1)c2ccccc2 240690a_100020634212_100000185807 [0,1,0,0,0,1|1,0,1]=4 8318 B16R2.5767 O=C(NCc1cnco1)c2ccccc2 527a_100020634212_100000185807 [0,1,0,0,0,1|1,0,1]=4 8319 B16R2.5767 O=C(NCc1cncs1)c2ccccc2 11a_100016987365_100000185807 [0,1,0,0,0,1|1,0,1]=4 8320 B16R2.5767 O=C(NCc1cncs1)c2ccccc2 240690a_100016987365_100000185807 [0,1,0,0,0,1|1,0,1]=4 8321 B16R2.5767 O=C(NCc1cncs1)c2ccccc2 527a_100016987365_100000185807 [0,1,0,0,0,1|1,0,1]=4 8322 B16R2.5767 O=C(NCc1cocn1)c2ccccc2 11a_100015188801_100000185807 [0,1,0,0,0,1|1,0,0]=3 8323 B16R2.5767 O=C(NCc1cocn1)c2ccccc2 240690a_100015188801_100000185807 [0,1,0,0,0,1|1,0,0]=3 8324 B16R2.5767 O=C(NCc1cocn1)c2ccccc2 527a_100015188801_100000185807 [0,1,0,0,0,1|1,0,0]=3 8325 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 11a_100015185402_100000185807 [0,1,0,0,0,1|1,0,0]=3 8326 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 1626a_100015185402_100000185807 [0,1,0,0,0,1|1,0,0]=3 8327 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 240690a_100015185402_100000185807 [0,1,0,0,0,1|1,0,0]=3 8328 B16R2.5767 O=C(NCc1cscn1)c2ccccc2 527a_100015185402_100000185807 [0,1,0,0,0,1|1,0,0]=3 8329 B16R2.5767 O=C(NCc1ncc[nH]1)c2ccccc2 11a_100000754540_100000185807 [0,1,0,0,0,1|2,0,0]=4 8330 B16R2.5767 O=C(NCc1ncc[nH]1)c2ccccc2 240690a_100000754540_100000185807 [0,1,0,0,0,1|2,0,0]=4 8331 B16R2.5767 O=C(NCc1ncc[nH]1)c2ccccc2 527a_100000754540_100000185807 [0,1,0,0,0,1|2,0,0]=4 8332 B16R2.5767 O=C(NCc1ncco1)c2ccccc2 11a_100016994969_100000185807 [0,1,0,0,0,1|2,0,0]=4 8333 B16R2.5767 O=C(NCc1ncco1)c2ccccc2 1626a_100016994969_100000185807 [0,1,0,0,0,1|2,0,0]=4 8334 B16R2.5767 O=C(NCc1ncco1)c2ccccc2 240690a_100016994969_100000185807 [0,1,0,0,0,1|2,0,0]=4 8335 B16R2.5767 O=C(NCc1ncco1)c2ccccc2 527a_100016994969_100000185807 [0,1,0,0,0,1|2,0,0]=4 8336 B16R2.5767 O=C(NCc1nccs1)c2ccccc2 11a_100000740555_100000185807 [0,1,0,0,0,1|2,0,0]=4 8337 B16R2.5767 O=C(NCc1nccs1)c2ccccc2 1626a_100000740555_100000185807 [0,1,0,0,0,1|2,0,0]=4 8338 B16R2.5767 O=C(NCc1nccs1)c2ccccc2 240690a_100000740555_100000185807 [0,1,0,0,0,1|2,0,0]=4 8339 B16R2.5767 O=C(NCc1nccs1)c2ccccc2 527a_100000740555_100000185807 [0,1,0,0,0,1|2,0,0]=4 8340 B16R2.5767 O=S(CSc1c[nH]cn1)c2ccccc2 62a_100000756875_100000031784 [0,1,0,0,0,1|1,0,0]=3 8341 B16R2.5767 O=S(CSc1c[nH]nn1)c2ccccc2 62a_100009819707_100000031784 [0,1,0,0,0,1|2,0,0]=4 8342 B16R2.5767 O=S(CSc1cscn1)c2ccccc2 62a_100000751502_100000031784 [0,1,0,0,0,1|2,0,0]=4 8343 B16R2.5767 O=S(CSc1nc[nH]n1)c2ccccc2 62a_100000761765_100000031784 [0,1,0,0,0,1|2,0,0]=4 8344 B16R2.5767 OC(CSc1c[nH]cn1)c2ccccc2 62a_100000185958_100000756875 [0,1,0,0,0,1|1,0,0]=3 8345 B16R2.5767 OC(CSc1c[nH]cn1)c2ccccc2 62a_100000756875_100000185958 [0,1,0,0,0,1|1,0,0]=3 8346 B16R2.5767 OC(CSc1c[nH]nn1)c2ccccc2 62a_100000185958_100009819707 [0,1,0,0,0,1|2,0,0]=4 8347 B16R2.5767 OC(CSc1c[nH]nn1)c2ccccc2 62a_100009819707_100000185958 [0,1,0,0,0,1|2,0,0]=4 8348 B16R2.5767 OC(CSc1cscn1)c2ccccc2 62a_100000185958_100000751502 [0,1,0,0,0,1|2,0,0]=4 8349 B16R2.5767 OC(CSc1cscn1)c2ccccc2 62a_100000751502_100000185958 [0,1,0,0,0,1|2,0,0]=4 8350 B16R2.5767 OC(CSc1nc[nH]n1)c2ccccc2 62a_100000185958_100000761765 [0,1,0,0,0,1|2,0,0]=4 8351 B16R2.5767 OC(CSc1nc[nH]n1)c2ccccc2 62a_100000761765_100000185958 [0,1,0,0,0,1|2,0,0]=4 8352 B16R2.5767 O[C@H](CSc1c[nH]cn1)c2ccccc2 62a_100000756875_100011933945 [0,1,0,0,0,1|1,0,0]=3 8353 B16R2.5767 O[C@H](CSc1c[nH]cn1)c2ccccc2 62a_100011933945_100000756875 [0,1,0,0,0,1|1,0,0]=3 8354 B16R2.5767 O[C@H](CSc1c[nH]nn1)c2ccccc2 62a_100009819707_100011933945 [0,1,0,0,0,1|2,0,0]=4 8355 B16R2.5767 O[C@H](CSc1c[nH]nn1)c2ccccc2 62a_100011933945_100009819707 [0,1,0,0,0,1|2,0,0]=4 8356 B16R2.5767 O[C@H](CSc1cscn1)c2ccccc2 62a_100000751502_100011933945 [0,1,0,0,0,1|2,0,0]=4 8357 B16R2.5767 O[C@H](CSc1cscn1)c2ccccc2 62a_100011933945_100000751502 [0,1,0,0,0,1|2,0,0]=4 8358 B16R2.5767 O[C@H](CSc1nc[nH]n1)c2ccccc2 62a_100000761765_100011933945 [0,1,0,0,0,1|2,0,0]=4 8359 B16R2.5767 O[C@H](CSc1nc[nH]n1)c2ccccc2 62a_100011933945_100000761765 [0,1,0,0,0,1|2,0,0]=4 8360 B16R2.3305 O=c1cccccc1OCc2c[nH]cn2 34a_100000036025_100000707719 [0,1,0,0,0,1|1,0,0]=3 8361 B16R2.3305 O=c1cccccc1OCc2cscn2 34a_100000036025_100000205941 [0,1,0,0,0,1|2,0,0]=4 8362 B16R2.3305 O=c1cccccc1OCc2cscn2 7a_100000036025_100000205941 [0,1,0,0,0,1|2,0,0]=4 8363 B16R2.169 CCn1ccnc1CNc2ccccc2 207a_100000106764_100000748659 [0,2,0,0,0,0|2,0,0]=4 8364 B16R2.169 CCn1cncc1CNc2ccccc2 207a_100000106764_100011361554 [0,2,0,0,0,0|0,0,2]=4 8365 B16R2.169 CCn1cncc1CNc2ccccc2 270302a_100000106764_100011361554 [0,2,0,0,0,0|0,0,2]=4 8366 B16R2.169 CCn1cncc1CNc2ccccc2 34a_100000106764_100015185705 [0,2,0,0,0,0|0,0,2]=4 8367 B16R2.169 CCn1ncnc1CNc2ccccc2 207a_100000106764_100011935331 [0,2,0,0,0,0|1,0,1]=4 8368 B16R2.169 CCn1ncnc1CNc2ccccc2 270302a_100000106764_100011935331 [0,2,0,0,0,0|1,0,1]=4 8369 B16R2.169 COc1ccoc1CNc2ccccc2 207a_100000106764_200009856553 [0,2,0,0,0,0|2,0,0]=4 8370 B16R2.169 COc1ccoc1CNc2ccccc2 270302a_100000106764_200009856553 [0,2,0,0,0,0|2,0,0]=4 8371 B16R2.169 COc1ccsc1CNc2ccccc2 207a_100000106764_100000689126 [0,2,0,0,0,0|2,0,0]=4 8372 B16R2.169 COc1ccsc1CNc2ccccc2 270302a_100000106764_100000689126 [0,2,0,0,0,0|2,0,0]=4 8373 B16R2.1067 Brc1ccc(cc1)NCc2ccsc2Br 207a_100000210018_100009816921 [0,2,0,0,0,0|2,0,0]=4 8374 B16R2.1067 Brc1ccc(cc1)NCc2ccsc2Br 2230a_100000210018_100009814289 [0,2,0,0,0,0|2,0,0]=4 8375 B16R2.1067 Brc1ccc(cc1)NCc2ccsc2Br 270302a_100000210018_100009816921 [0,2,0,0,0,0|2,0,0]=4 8376 B16R2.1067 Brc1ccc(cc1)NCc2ccsc2Br 34a_100000210018_100009814289 [0,2,0,0,0,0|2,0,0]=4 8377 B16R2.1067 Brc1ccc(cc1)NCc2cscc2Br 207a_100000210018_100000685484 [0,2,0,0,0,0|2,0,0]=4 8378 B16R2.1067 Brc1ccc(cc1)NCc2cscc2Br 270302a_100000210018_100000685484 [0,2,0,0,0,0|2,0,0]=4 8379 B16R2.1067 Brc1ccc(cc1)NCc2sccc2Br 207a_100000210018_100000766043 [0,2,0,0,0,0|2,0,0]=4 8380 B16R2.1067 Brc1ccc(cc1)NCc2sccc2Br 270302a_100000210018_100000766043 [0,2,0,0,0,0|2,0,0]=4 8381 B16R2.1067 Brc1ccsc1CNc2ccc(cc2)I 207a_100000185761_100000766043 [0,2,0,0,0,0|2,0,0]=4 8382 B16R2.1067 Brc1ccsc1CNc2ccc(cc2)I 270302a_100000185761_100000766043 [0,2,0,0,0,0|2,0,0]=4 8383 B16R2.1067 Brc1cscc1CNc2ccc(cc2)I 207a_100000185761_100000685484 [0,2,0,0,0,0|2,0,0]=4 8384 B16R2.1067 Brc1cscc1CNc2ccc(cc2)I 270302a_100000185761_100000685484 [0,2,0,0,0,0|2,0,0]=4 8385 B16R2.1067 Brc1sccc1CNc2ccc(cc2)I 207a_100000185761_100009816921 [0,2,0,0,0,0|2,0,0]=4 8386 B16R2.1067 Brc1sccc1CNc2ccc(cc2)I 270302a_100000185761_100009816921 [0,2,0,0,0,0|2,0,0]=4 8387 B16R2.1067 Brc1sccc1CNc2ccc(cc2)I 34a_100000185761_100009814289 [0,2,0,0,0,0|2,0,0]=4 8388 B16R2.1067 Cc1[nH]cnc1C=Cc2ccc(cc2)Br 271570a_100102527914_100009816806 [0,2,0,0,0,0|1,0,1]=4 8389 B16R2.1067 Cc1[nH]cnc1C=Cc2ccc(cc2)Cl 271570a_100102527930_100009816806 [0,2,0,0,0,0|1,0,1]=4 8390 B16R2.1067 Cc1[nH]cnc1C=Cc2ccc(cc2)F 271570a_100102525539_100009816806 [0,2,0,0,0,0|1,0,1]=4 8391 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)Br 207a_100000210018_100000032982 [0,2,0,0,0,0|0,0,0]=2 8392 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)Br 2230a_100000210018_100000751220 [0,2,0,0,0,0|0,0,0]=2 8393 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)Cl 207a_100000210052_100000032982 [0,2,0,0,0,0|0,0,0]=2 8394 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)Cl 2230a_100000210052_100000751220 [0,2,0,0,0,0|0,0,0]=2 8395 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)F 207a_100000185862_100000032982 [0,2,0,0,0,0|0,0,0]=2 8396 B16R2.1067 Cc1[nH]cnc1CNc2ccc(cc2)I 207a_100000185761_100000032982 [0,2,0,0,0,0|0,0,0]=2 8397 B16R2.1067 Cc1[nH]cnc1CSc2cc[n+](cc2)[O-] 62a_100000751220_100000039755 [0,2,0,0,0,0|2,0,0]=4 8398 B16R2.1067 Cc1[nH]cnc1CSc2ccc(=O)[nH]c2 62a_100000212171_100000751220 [0,2,0,0,0,0|2,0,0]=4 8399 B16R2.1067 Cc1[nH]cnc1CSc2ccc(=O)[nH]c2 62a_100000751220_100000212171 [0,2,0,0,0,0|2,0,0]=4 8400 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)Br 62a_100000751220_100000752885 [0,2,0,0,0,0|1,0,0]=3 8401 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)Br 62a_100000752885_100000751220 [0,2,0,0,0,0|1,0,0]=3 8402 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)Cl 62a_100000751220_100000755918 [0,2,0,0,0,0|1,0,0]=3 8403 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)Cl 62a_100000755918_100000751220 [0,2,0,0,0,0|1,0,0]=3 8404 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)F 62a_100000211213_100000751220 [0,2,0,0,0,0|1,0,0]=3 8405 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)F 62a_100000751220_100000211213 [0,2,0,0,0,0|1,0,0]=3 8406 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)N 62a_100000185761_100000751220 [0,2,0,0,0,0|1,0,0]=3 8407 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)N 62a_100000751220_100000185761 [0,2,0,0,0,0|1,0,0]=3 8408 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cc2)O 62a_100000751220_100000185759 [0,2,0,0,0,0|1,0,0]=3 8409 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)Br 62a_100000686858_100000751220 [0,2,0,0,0,0|2,0,0]=4 8410 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)Br 62a_100000751220_100000686858 [0,2,0,0,0,0|2,0,0]=4 8411 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)Cl 62a_100000751220_100011356976 [0,2,0,0,0,0|2,0,0]=4 8412 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)Cl 62a_100011356976_100000751220 [0,2,0,0,0,0|2,0,0]=4 8413 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)F 62a_100000744514_100000751220 [0,2,0,0,0,0|2,0,0]=4 8414 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)F 62a_100000751220_100000744514 [0,2,0,0,0,0|2,0,0]=4 8415 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)N 62a_100000737798_100000751220 [0,2,0,0,0,0|2,0,0]=4 8416 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)N 62a_100000751220_100000737798 [0,2,0,0,0,0|2,0,0]=4 8417 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)O 62a_100000685995_100000751220 [0,2,0,0,0,0|2,0,0]=4 8418 B16R2.1067 Cc1[nH]cnc1CSc2ccc(cn2)O 62a_100000751220_100000744096 [0,2,0,0,0,0|2,0,0]=4 8419 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)Br 62a_100000751220_100009814638 [0,2,0,0,0,0|2,0,0]=4 8420 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)Br 62a_100009814638_100000751220 [0,2,0,0,0,0|2,0,0]=4 8421 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)Cl 62a_100000034144_100000751220 [0,2,0,0,0,0|2,0,0]=4 8422 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)Cl 62a_100000751220_100000034144 [0,2,0,0,0,0|2,0,0]=4 8423 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)F 62a_100000042367_100000751220 [0,2,0,0,0,0|2,0,0]=4 8424 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)F 62a_100000751220_100000042367 [0,2,0,0,0,0|2,0,0]=4 8425 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)N 62a_100000187370_100000751220 [0,2,0,0,0,0|2,0,0]=4 8426 B16R2.1067 Cc1[nH]cnc1CSc2ccc(nc2)N 62a_100000751220_100000187370 [0,2,0,0,0,0|2,0,0]=4 8427 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)Br 62a_100000189115_100010186451 [0,2,0,0,0,0|2,0,0]=4 8428 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)Br 62a_100010186451_100000189115 [0,2,0,0,0,0|2,0,0]=4 8429 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)Cl 62a_100000187161_100010186451 [0,2,0,0,0,0|2,0,0]=4 8430 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)Cl 62a_100010186451_100000187161 [0,2,0,0,0,0|2,0,0]=4 8431 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)F 62a_100000198546_100010186451 [0,2,0,0,0,0|2,0,0]=4 8432 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)F 62a_100010186451_100000187164 [0,2,0,0,0,0|2,0,0]=4 8433 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)I 62a_100000189116_100010186451 [0,2,0,0,0,0|2,0,0]=4 8434 B16R2.1067 Cc1[nH]cnc1SCc2ccc(cc2)I 62a_100010186451_100000189116 [0,2,0,0,0,0|2,0,0]=4 8435 B16R2.1067 Cc1ccc(cc1)C=Cc2nc[nH]c2C 271570a_100102527916_100009816806 [0,2,0,0,0,0|1,0,1]=4 8436 B16R2.1067 Cc1ccc(cc1)CSc2nc[nH]c2C 62a_100000210814_100010186451 [0,2,0,0,0,0|2,0,0]=4 8437 B16R2.1067 Cc1ccc(cc1)CSc2nc[nH]c2C 62a_100010186451_100000210814 [0,2,0,0,0,0|2,0,0]=4 8438 B16R2.1067 Cc1ccc(cc1)NCc2c[nH]nc2C 207a_100000124888_100000737037 [0,2,0,0,0,0|2,0,0]=4 8439 B16R2.1067 Cc1ccc(cc1)NCc2c[nH]nc2C 270302a_100000124888_100000737037 [0,2,0,0,0,0|2,0,0]=4 8440 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Br 207a_100000124888_100009816921 [0,2,0,0,0,0|2,0,0]=4 8441 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Br 270302a_100000124888_100009816921 [0,2,0,0,0,0|2,0,0]=4 8442 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Br 34a_100000124888_100009814289 [0,2,0,0,0,0|2,0,0]=4 8443 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Cl 207a_100000124888_100000089901 [0,2,0,0,0,0|2,0,0]=4 8444 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Cl 270302a_100000124888_100000089901 [0,2,0,0,0,0|2,0,0]=4 8445 B16R2.1067 Cc1ccc(cc1)NCc2ccsc2Cl 34a_100000124888_100010167017 [0,2,0,0,0,0|2,0,0]=4 8446 B16R2.1067 Cc1ccc(cc1)NCc2cncn2C 207a_100000124888_100000750899 [0,2,0,0,0,0|0,0,2]=4 8447 B16R2.1067 Cc1ccc(cc1)NCc2cncn2C 270302a_100000124888_100000750899 [0,2,0,0,0,0|0,0,2]=4 8448 B16R2.1067 Cc1ccc(cc1)NCc2cscc2Br 207a_100000124888_100000685484 [0,2,0,0,0,0|2,0,0]=4 8449 B16R2.1067 Cc1ccc(cc1)NCc2cscc2Br 270302a_100000124888_100000685484 [0,2,0,0,0,0|2,0,0]=4 8450 B16R2.1067 Cc1ccc(cc1)NCc2n[nH]cc2Cl 207a_100000124888_100000040271 [0,2,0,0,0,0|2,0,0]=4 8451 B16R2.1067 Cc1ccc(cc1)NCc2nc[nH]c2C 207a_100000124888_100000032982 [0,2,0,0,0,0|0,0,0]=2 8452 B16R2.1067 Cc1ccc(cc1)NCc2nccn2C 207a_100000124888_100000748660 [0,2,0,0,0,0|2,0,0]=4 8453 B16R2.1067 Cc1ccc(cc1)NCc2nccn2C 34a_100000124888_100000700302 [0,2,0,0,0,0|2,0,0]=4 8454 B16R2.1067 Cc1ccc(cc1)NCc2ncoc2C 34a_100000124888_200000693990 [0,2,0,0,0,0|1,0,0]=3 8455 B16R2.1067 Cc1ccc(cc1)NCc2nonc2C 34a_100000124888_200000044682 [0,2,0,0,0,0|1,0,1]=4 8456 B16R2.1067 Cc1ccc(cc1)NCc2occc2C 207a_100000124888_100000763527 [0,2,0,0,0,0|2,0,0]=4 8457 B16R2.1067 Cc1ccc(cc1)NCc2occc2C 270302a_100000124888_100000763527 [0,2,0,0,0,0|2,0,0]=4 8458 B16R2.1067 Cc1ccc(cc1)NCc2sccc2Br 207a_100000124888_100000766043 [0,2,0,0,0,0|2,0,0]=4 8459 B16R2.1067 Cc1ccc(cc1)NCc2sccc2Br 270302a_100000124888_100000766043 [0,2,0,0,0,0|2,0,0]=4 8460 B16R2.1067 Cc1ccc(cc1)NCc2sccc2C 207a_100000124888_100000210881 [0,2,0,0,0,0|2,0,0]=4 8461 B16R2.1067 Cc1ccc(cc1)NCc2sccc2C 270302a_100000124888_100000210881 [0,2,0,0,0,0|2,0,0]=4 8462 B16R2.1067 Cc1ccc(cc1)NCc2sccc2Cl 207a_100000124888_100000722334 [0,2,0,0,0,0|2,0,0]=4 8463 B16R2.1067 Cc1ccc(cc1)NCc2sccc2Cl 270302a_100000124888_100000722334 [0,2,0,0,0,0|2,0,0]=4 8464 B16R2.1067 Cc1ccc(cc1)NCc2scnc2C 207a_100000124888_100000764165 [0,2,0,0,0,0|1,0,1]=4 8465 B16R2.1067 Cc1ccc(cc1)NCc2scnc2C 270302a_100000124888_100000764165 [0,2,0,0,0,0|1,0,1]=4 8466 B16R2.1067 Cc1ccc(cc1)OCc2ncoc2C 34a_100000210336_200000693990 [0,2,0,0,0,0|2,0,0]=4 8467 B16R2.1067 Cc1ccc(cc1)OCc2ncoc2C 7a_100000210336_200000693990 [0,2,0,0,0,0|2,0,0]=4 8468 B16R2.1067 Cc1ccc(cc1)SCc2nc[nH]c2C 62a_100000186775_100000751220 [0,2,0,0,0,0|1,0,0]=3 8469 B16R2.1067 Cc1ccc(cc1)SCc2nc[nH]c2C 62a_100000751220_100000186775 [0,2,0,0,0,0|1,0,0]=3 8470 B16R2.1067 Cc1ccc(cc1)SCc2ncoc2C 62a_100000186775_200000693990 [0,2,0,0,0,0|2,0,0]=4 8471 B16R2.1067 Cc1ccc(cc1)SCc2ncoc2C 62a_200000693990_100000186775 [0,2,0,0,0,0|2,0,0]=4 8472 B16R2.1067 Cc1ccc(cn1)SCc2nc[nH]c2C 62a_100000751220_100000751577 [0,2,0,0,0,0|2,0,0]=4 8473 B16R2.1067 Cc1ccc(cn1)SCc2nc[nH]c2C 62a_100000751577_100000751220 [0,2,0,0,0,0|2,0,0]=4 8474 B16R2.1067 Cc1ccc(nc1)SCc2nc[nH]c2C 62a_100000751220_100000754016 [0,2,0,0,0,0|2,0,0]=4 8475 B16R2.1067 Cc1ccc(nc1)SCc2nc[nH]c2C 62a_100011192072_100000751220 [0,2,0,0,0,0|2,0,0]=4 8476 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)Br 207a_100000210018_100000763527 [0,2,0,0,0,0|2,0,0]=4 8477 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)Br 270302a_100000210018_100000763527 [0,2,0,0,0,0|2,0,0]=4 8478 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)Cl 207a_100000210052_100000763527 [0,2,0,0,0,0|2,0,0]=4 8479 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)Cl 270302a_100000210052_100000763527 [0,2,0,0,0,0|2,0,0]=4 8480 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)F 207a_100000185862_100000763527 [0,2,0,0,0,0|2,0,0]=4 8481 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)F 270302a_100000185862_100000763527 [0,2,0,0,0,0|2,0,0]=4 8482 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)I 207a_100000185761_100000763527 [0,2,0,0,0,0|2,0,0]=4 8483 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)I 270302a_100000185761_100000763527 [0,2,0,0,0,0|2,0,0]=4 8484 B16R2.1067 Cc1ccoc1CNc2ccc(cc2)O 270302a_100000185829_100000763527 [0,2,0,0,0,0|2,0,0]=4 8485 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)Br 207a_100000210018_100000210881 [0,2,0,0,0,0|2,0,0]=4 8486 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)Br 270302a_100000210018_100000210881 [0,2,0,0,0,0|2,0,0]=4 8487 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)Cl 207a_100000210052_100000210881 [0,2,0,0,0,0|2,0,0]=4 8488 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)Cl 270302a_100000210052_100000210881 [0,2,0,0,0,0|2,0,0]=4 8489 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)F 207a_100000185862_100000210881 [0,2,0,0,0,0|2,0,0]=4 8490 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)F 270302a_100000185862_100000210881 [0,2,0,0,0,0|2,0,0]=4 8491 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)I 207a_100000185761_100000210881 [0,2,0,0,0,0|2,0,0]=4 8492 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)I 270302a_100000185761_100000210881 [0,2,0,0,0,0|2,0,0]=4 8493 B16R2.1067 Cc1ccsc1CNc2ccc(cc2)O 270302a_100000185829_100000210881 [0,2,0,0,0,0|2,0,0]=4 8494 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)Br 207a_100000210018_100000737037 [0,2,0,0,0,0|2,0,0]=4 8495 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)Br 270302a_100000210018_100000737037 [0,2,0,0,0,0|2,0,0]=4 8496 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)Cl 207a_100000210052_100000737037 [0,2,0,0,0,0|2,0,0]=4 8497 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)Cl 270302a_100000210052_100000737037 [0,2,0,0,0,0|2,0,0]=4 8498 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)F 207a_100000185862_100000737037 [0,2,0,0,0,0|2,0,0]=4 8499 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)F 270302a_100000185862_100000737037 [0,2,0,0,0,0|2,0,0]=4 8500 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)I 207a_100000185761_100000737037 [0,2,0,0,0,0|2,0,0]=4 8501 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)I 270302a_100000185761_100000737037 [0,2,0,0,0,0|2,0,0]=4 8502 B16R2.1067 Cc1n[nH]cc1CNc2ccc(cc2)O 270302a_100000185829_100000737037 [0,2,0,0,0,0|2,0,0]=4 8503 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)Br 207a_100000210018_100000764165 [0,2,0,0,0,0|1,0,1]=4 8504 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)Br 270302a_100000210018_100000764165 [0,2,0,0,0,0|1,0,1]=4 8505 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)Cl 207a_100000210052_100000764165 [0,2,0,0,0,0|1,0,1]=4 8506 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)Cl 270302a_100000210052_100000764165 [0,2,0,0,0,0|1,0,1]=4 8507 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)F 207a_100000185862_100000764165 [0,2,0,0,0,0|1,0,1]=4 8508 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)F 270302a_100000185862_100000764165 [0,2,0,0,0,0|1,0,1]=4 8509 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)I 207a_100000185761_100000764165 [0,2,0,0,0,0|1,0,1]=4 8510 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)I 270302a_100000185761_100000764165 [0,2,0,0,0,0|1,0,1]=4 8511 B16R2.1067 Cc1ncsc1CNc2ccc(cc2)O 270302a_100000185829_100000764165 [0,2,0,0,0,0|1,0,1]=4 8512 B16R2.1067 Cc1nonc1CNc2ccc(cc2)Br 2230a_100000210018_200000044682 [0,2,0,0,0,0|1,0,1]=4 8513 B16R2.1067 Cc1nonc1CNc2ccc(cc2)Br 34a_100000210018_200000044682 [0,2,0,0,0,0|1,0,1]=4 8514 B16R2.1067 Cc1nonc1CNc2ccc(cc2)Cl 2230a_100000210052_200000044682 [0,2,0,0,0,0|1,0,1]=4 8515 B16R2.1067 Cc1nonc1CNc2ccc(cc2)Cl 34a_100000210052_200000044682 [0,2,0,0,0,0|1,0,1]=4 8516 B16R2.1067 Cc1nonc1CNc2ccc(cc2)F 34a_100000185862_200000044682 [0,2,0,0,0,0|1,0,1]=4 8517 B16R2.1067 Cc1nonc1CNc2ccc(cc2)I 34a_100000185761_200000044682 [0,2,0,0,0,0|1,0,1]=4 8518 B16R2.1067 Cc1nonc1CNc2ccc(cc2)O 34a_100000185829_200000044682 [0,2,0,0,0,0|1,0,1]=4 8519 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)Br 2230a_100000210018_200000693990 [0,2,0,0,0,0|1,0,0]=3 8520 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)Br 34a_100000210018_200000693990 [0,2,0,0,0,0|1,0,0]=3 8521 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)Cl 2230a_100000210052_200000693990 [0,2,0,0,0,0|1,0,0]=3 8522 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)Cl 34a_100000210052_200000693990 [0,2,0,0,0,0|1,0,0]=3 8523 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)F 34a_100000185862_200000693990 [0,2,0,0,0,0|1,0,0]=3 8524 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)I 34a_100000185761_200000693990 [0,2,0,0,0,0|1,0,0]=3 8525 B16R2.1067 Cc1ocnc1CNc2ccc(cc2)O 34a_100000185829_200000693990 [0,2,0,0,0,0|1,0,0]=3 8526 B16R2.1067 Cc1ocnc1COc2ccc(cc2)Br 34a_100000185759_200000693990 [0,2,0,0,0,0|2,0,0]=4 8527 B16R2.1067 Cc1ocnc1COc2ccc(cc2)Br 7a_100000185759_200000693990 [0,2,0,0,0,0|2,0,0]=4 8528 B16R2.1067 Cc1ocnc1COc2ccc(cc2)Cl 34a_100000210216_200000693990 [0,2,0,0,0,0|2,0,0]=4 8529 B16R2.1067 Cc1ocnc1COc2ccc(cc2)Cl 7a_100000210216_200000693990 [0,2,0,0,0,0|2,0,0]=4 8530 B16R2.1067 Cc1ocnc1COc2ccc(cc2)F 34a_100000210339_200000693990 [0,2,0,0,0,0|2,0,0]=4 8531 B16R2.1067 Cc1ocnc1COc2ccc(cc2)I 34a_100000212066_200000693990 [0,2,0,0,0,0|2,0,0]=4 8532 B16R2.1067 Cc1ocnc1COc2ccc(cc2)I 7a_100000212066_200000693990 [0,2,0,0,0,0|2,0,0]=4 8533 B16R2.1067 Cc1ocnc1COc2ccc(cc2)N 34a_100000185829_200000693990 [0,2,0,0,0,0|2,0,0]=4 8534 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)Br 62a_100000752885_200000693990 [0,2,0,0,0,0|2,0,0]=4 8535 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)Br 62a_200000693990_100000752885 [0,2,0,0,0,0|2,0,0]=4 8536 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)Cl 62a_100000755918_200000693990 [0,2,0,0,0,0|2,0,0]=4 8537 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)Cl 62a_200000693990_100000755918 [0,2,0,0,0,0|2,0,0]=4 8538 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)F 62a_100000211213_200000693990 [0,2,0,0,0,0|2,0,0]=4 8539 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)F 62a_200000693990_100000211213 [0,2,0,0,0,0|2,0,0]=4 8540 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)N 62a_100000185761_200000693990 [0,2,0,0,0,0|2,0,0]=4 8541 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)N 62a_200000693990_100000185761 [0,2,0,0,0,0|2,0,0]=4 8542 B16R2.1067 Cc1ocnc1CSc2ccc(cc2)O 62a_200000693990_100000185759 [0,2,0,0,0,0|2,0,0]=4 8543 B16R2.1067 Clc1c[nH]nc1CNc2ccc(cc2)Br 207a_100000210018_100000040271 [0,2,0,0,0,0|2,0,0]=4 8544 B16R2.1067 Clc1c[nH]nc1CNc2ccc(cc2)I 207a_100000185761_100000040271 [0,2,0,0,0,0|2,0,0]=4 8545 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Br 207a_100000210052_100009816921 [0,2,0,0,0,0|2,0,0]=4 8546 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Br 2230a_100000210052_100009814289 [0,2,0,0,0,0|2,0,0]=4 8547 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Br 270302a_100000210052_100009816921 [0,2,0,0,0,0|2,0,0]=4 8548 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Br 34a_100000210052_100009814289 [0,2,0,0,0,0|2,0,0]=4 8549 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Cl 207a_100000210052_100000089901 [0,2,0,0,0,0|2,0,0]=4 8550 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Cl 2230a_100000210052_100010167017 [0,2,0,0,0,0|2,0,0]=4 8551 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Cl 270302a_100000210052_100000089901 [0,2,0,0,0,0|2,0,0]=4 8552 B16R2.1067 Clc1ccc(cc1)NCc2ccsc2Cl 34a_100000210052_100010167017 [0,2,0,0,0,0|2,0,0]=4 8553 B16R2.1067 Clc1ccc(cc1)NCc2cscc2Br 207a_100000210052_100000685484 [0,2,0,0,0,0|2,0,0]=4 8554 B16R2.1067 Clc1ccc(cc1)NCc2cscc2Br 270302a_100000210052_100000685484 [0,2,0,0,0,0|2,0,0]=4 8555 B16R2.1067 Clc1ccc(cc1)NCc2n[nH]cc2Cl 207a_100000210052_100000040271 [0,2,0,0,0,0|2,0,0]=4 8556 B16R2.1067 Clc1ccc(cc1)NCc2nnsc2Cl 2230a_100000210052_100000018852 [0,2,0,0,0,0|2,0,0]=4 8557 B16R2.1067 Clc1ccc(cc1)NCc2sccc2Br 207a_100000210052_100000766043 [0,2,0,0,0,0|2,0,0]=4 8558 B16R2.1067 Clc1ccc(cc1)NCc2sccc2Br 270302a_100000210052_100000766043 [0,2,0,0,0,0|2,0,0]=4 8559 B16R2.1067 Clc1ccc(cc1)NCc2sccc2Cl 207a_100000210052_100000722334 [0,2,0,0,0,0|2,0,0]=4 8560 B16R2.1067 Clc1ccc(cc1)NCc2sccc2Cl 270302a_100000210052_100000722334 [0,2,0,0,0,0|2,0,0]=4 8561 B16R2.1067 Clc1ccsc1CNc2ccc(cc2)Br 207a_100000210018_100000722334 [0,2,0,0,0,0|2,0,0]=4 8562 B16R2.1067 Clc1ccsc1CNc2ccc(cc2)Br 270302a_100000210018_100000722334 [0,2,0,0,0,0|2,0,0]=4 8563 B16R2.1067 Clc1ccsc1CNc2ccc(cc2)I 207a_100000185761_100000722334 [0,2,0,0,0,0|2,0,0]=4 8564 B16R2.1067 Clc1ccsc1CNc2ccc(cc2)I 270302a_100000185761_100000722334 [0,2,0,0,0,0|2,0,0]=4 8565 B16R2.1067 Clc1sccc1CNc2ccc(cc2)Br 207a_100000210018_100000089901 [0,2,0,0,0,0|2,0,0]=4 8566 B16R2.1067 Clc1sccc1CNc2ccc(cc2)Br 2230a_100000210018_100010167017 [0,2,0,0,0,0|2,0,0]=4 8567 B16R2.1067 Clc1sccc1CNc2ccc(cc2)Br 270302a_100000210018_100000089901 [0,2,0,0,0,0|2,0,0]=4 8568 B16R2.1067 Clc1sccc1CNc2ccc(cc2)Br 34a_100000210018_100010167017 [0,2,0,0,0,0|2,0,0]=4 8569 B16R2.1067 Clc1sccc1CNc2ccc(cc2)I 207a_100000185761_100000089901 [0,2,0,0,0,0|2,0,0]=4 8570 B16R2.1067 Clc1sccc1CNc2ccc(cc2)I 270302a_100000185761_100000089901 [0,2,0,0,0,0|2,0,0]=4 8571 B16R2.1067 Clc1sccc1CNc2ccc(cc2)I 34a_100000185761_100010167017 [0,2,0,0,0,0|2,0,0]=4 8572 B16R2.1067 Clc1snnc1CNc2ccc(cc2)Br 2230a_100000210018_100000018852 [0,2,0,0,0,0|2,0,0]=4 8573 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Br 207a_100000210018_100000748660 [0,2,0,0,0,0|2,0,0]=4 8574 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Br 2230a_100000210018_100000700302 [0,2,0,0,0,0|2,0,0]=4 8575 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Br 34a_100000210018_100000700302 [0,2,0,0,0,0|2,0,0]=4 8576 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Cl 207a_100000210052_100000748660 [0,2,0,0,0,0|2,0,0]=4 8577 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Cl 2230a_100000210052_100000700302 [0,2,0,0,0,0|2,0,0]=4 8578 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)Cl 34a_100000210052_100000700302 [0,2,0,0,0,0|2,0,0]=4 8579 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)F 207a_100000185862_100000748660 [0,2,0,0,0,0|2,0,0]=4 8580 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)F 34a_100000185862_100000700302 [0,2,0,0,0,0|2,0,0]=4 8581 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)I 207a_100000185761_100000748660 [0,2,0,0,0,0|2,0,0]=4 8582 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)I 34a_100000185761_100000700302 [0,2,0,0,0,0|2,0,0]=4 8583 B16R2.1067 Cn1ccnc1CNc2ccc(cc2)O 34a_100000185829_100000700302 [0,2,0,0,0,0|2,0,0]=4 8584 B16R2.1067 Cn1cncc1CNc2ccc(cc2)Br 207a_100000210018_100000750899 [0,2,0,0,0,0|0,0,2]=4 8585 B16R2.1067 Cn1cncc1CNc2ccc(cc2)Br 270302a_100000210018_100000750899 [0,2,0,0,0,0|0,0,2]=4 8586 B16R2.1067 Cn1cncc1CNc2ccc(cc2)Cl 207a_100000210052_100000750899 [0,2,0,0,0,0|0,0,2]=4 8587 B16R2.1067 Cn1cncc1CNc2ccc(cc2)Cl 270302a_100000210052_100000750899 [0,2,0,0,0,0|0,0,2]=4 8588 B16R2.1067 Cn1cncc1CNc2ccc(cc2)F 207a_100000185862_100000750899 [0,2,0,0,0,0|0,0,2]=4 8589 B16R2.1067 Cn1cncc1CNc2ccc(cc2)F 270302a_100000185862_100000750899 [0,2,0,0,0,0|0,0,2]=4 8590 B16R2.1067 Cn1cncc1CNc2ccc(cc2)I 207a_100000185761_100000750899 [0,2,0,0,0,0|0,0,2]=4 8591 B16R2.1067 Cn1cncc1CNc2ccc(cc2)I 270302a_100000185761_100000750899 [0,2,0,0,0,0|0,0,2]=4 8592 B16R2.1067 Cn1cncc1CNc2ccc(cc2)O 270302a_100000185829_100000750899 [0,2,0,0,0,0|0,0,2]=4 8593 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Br 207a_100000185862_100009816921 [0,2,0,0,0,0|2,0,0]=4 8594 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Br 270302a_100000185862_100009816921 [0,2,0,0,0,0|2,0,0]=4 8595 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Br 34a_100000185862_100009814289 [0,2,0,0,0,0|2,0,0]=4 8596 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Cl 207a_100000185862_100000089901 [0,2,0,0,0,0|2,0,0]=4 8597 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Cl 270302a_100000185862_100000089901 [0,2,0,0,0,0|2,0,0]=4 8598 B16R2.1067 Fc1ccc(cc1)NCc2ccsc2Cl 34a_100000185862_100010167017 [0,2,0,0,0,0|2,0,0]=4 8599 B16R2.1067 Fc1ccc(cc1)NCc2cscc2Br 207a_100000185862_100000685484 [0,2,0,0,0,0|2,0,0]=4 8600 B16R2.1067 Fc1ccc(cc1)NCc2cscc2Br 270302a_100000185862_100000685484 [0,2,0,0,0,0|2,0,0]=4 8601 B16R2.1067 Fc1ccc(cc1)NCc2n[nH]cc2Cl 207a_100000185862_100000040271 [0,2,0,0,0,0|2,0,0]=4 8602 B16R2.1067 Fc1ccc(cc1)NCc2sccc2Br 207a_100000185862_100000766043 [0,2,0,0,0,0|2,0,0]=4 8603 B16R2.1067 Fc1ccc(cc1)NCc2sccc2Br 270302a_100000185862_100000766043 [0,2,0,0,0,0|2,0,0]=4 8604 B16R2.1067 Fc1ccc(cc1)NCc2sccc2Cl 207a_100000185862_100000722334 [0,2,0,0,0,0|2,0,0]=4 8605 B16R2.1067 Fc1ccc(cc1)NCc2sccc2Cl 270302a_100000185862_100000722334 [0,2,0,0,0,0|2,0,0]=4 8606 B16R2.1067 Oc1ccc(cc1)NCc2ccsc2Br 270302a_100000185829_100009816921 [0,2,0,0,0,0|2,0,0]=4 8607 B16R2.1067 Oc1ccc(cc1)NCc2ccsc2Br 34a_100000185829_100009814289 [0,2,0,0,0,0|2,0,0]=4 8608 B16R2.1067 Oc1ccc(cc1)NCc2ccsc2Cl 270302a_100000185829_100000089901 [0,2,0,0,0,0|2,0,0]=4 8609 B16R2.1067 Oc1ccc(cc1)NCc2ccsc2Cl 34a_100000185829_100010167017 [0,2,0,0,0,0|2,0,0]=4 8610 B16R2.1067 Oc1ccc(cc1)NCc2cscc2Br 270302a_100000185829_100000685484 [0,2,0,0,0,0|2,0,0]=4 8611 B16R2.1067 Oc1ccc(cc1)NCc2sccc2Br 270302a_100000185829_100000766043 [0,2,0,0,0,0|2,0,0]=4 8612 B16R2.1067 Oc1ccc(cc1)NCc2sccc2Cl 270302a_100000185829_100000722334 [0,2,0,0,0,0|2,0,0]=4 8613 B16R2.2904 Brc1cc(c(s1)Br)CNc2ccccc2 207a_100000106764_100011982627 [0,2,0,0,0,0|2,0,0]=4 8614 B16R2.2904 Cc1cc(c(s1)C)CNc2ccccc2 207a_100000106764_100000745318 [0,2,0,0,0,0|2,0,0]=4 8615 B16R2.2904 Cc1cc(c(s1)C)CNc2ccccc2 270302a_100000106764_100000745318 [0,2,0,0,0,0|2,0,0]=4 8616 B16R2.2904 Cc1cc(c(s1)CNc2ccccc2)Br 207a_100000106764_100011361552 [0,2,0,0,0,0|2,0,0]=4 8617 B16R2.2904 Cc1cc(c(s1)CNc2ccccc2)Br 270302a_100000106764_100011361552 [0,2,0,0,0,0|2,0,0]=4 8618 B16R2.2904 Cc1cc(sc1CNc2ccccc2)Br 207a_100000106764_100010221198 [0,2,0,0,0,0|2,0,0]=4 8619 B16R2.2904 Cc1cc(sc1CNc2ccccc2)Br 270302a_100000106764_100010221198 [0,2,0,0,0,0|2,0,0]=4 8620 B16R2.2904 Cc1nc(c([nH]1)C)CNc2ccccc2 207a_100000106764_100009834603 [0,2,0,0,0,0|0,0,0]=2 8621 B16R2.2904 Cc1nc(c([nH]1)C)SCc2ccccc2 62a_100000211182_200009820778 [0,2,0,0,0,0|2,0,0]=4 8622 B16R2.2904 Cc1nc(c([nH]1)C)SCc2ccccc2 62a_200009820778_100015291786 [0,2,0,0,0,0|2,0,0]=4 8623 B16R2.2904 Cc1nc(c(o1)CNc2ccccc2)C 207a_100000106764_100000734261 [0,2,0,0,0,0|1,0,1]=4 8624 B16R2.2904 Cc1nc(c(o1)CNc2ccccc2)C 270302a_100000106764_100000734261 [0,2,0,0,0,0|1,0,1]=4 8625 B16R2.2904 Cc1nc(c(s1)CNc2ccccc2)Br 34a_100000106764_100015664652 [0,2,0,0,0,0|1,0,1]=4 8626 B16R2.2904 Cc1nc(c(s1)CNc2ccccc2)C 207a_100000106764_100000757988 [0,2,0,0,0,0|1,0,1]=4 8627 B16R2.2904 Cc1nc(c(s1)CNc2ccccc2)C 34a_100000106764_100000760948 [0,2,0,0,0,0|1,0,1]=4 8628 B16R2.2904 Cc1nn(cc1CNc2ccccc2)C 207a_100000106764_100000745535 [0,2,0,0,0,0|2,0,0]=4 8629 B16R2.2904 Cc1nn(cc1CNc2ccccc2)C 270302a_100000106764_100000745535 [0,2,0,0,0,0|2,0,0]=4 8630 B16R2.2904 Cc1nn(cc1CNc2ccccc2)C 34a_100000106764_100015186178 [0,2,0,0,0,0|2,0,0]=4 8631 B16R2.2904 Clc1cc(c(s1)CNc2ccccc2)Br 207a_100000106764_100021366026 [0,2,0,0,0,0|2,0,0]=4 8632 B16R2.2904 Clc1cc(c(s1)Cl)CNc2ccccc2 207a_100000106764_100011218220 [0,2,0,0,0,0|2,0,0]=4 8633 B16R2.2904 Clc1cc(c(s1)Cl)CNc2ccccc2 270302a_100000106764_100011218220 [0,2,0,0,0,0|2,0,0]=4 8634 B16R2.2904 Clc1cc(sc1CNc2ccccc2)Br 207a_100000106764_100015463987 [0,2,0,0,0,0|2,0,0]=4 8635 B16R2.2904 Clc1cc(sc1CNc2ccccc2)Br 270302a_100000106764_100015463987 [0,2,0,0,0,0|2,0,0]=4 8636 B16R2.2904 Cn1cc(c(n1)CNc2ccccc2)Br 207a_100000106764_100009813915 [0,2,0,0,0,0|2,0,0]=4 8637 B16R2.2904 Cn1cc(c(n1)CNc2ccccc2)Br 34a_100000106764_100009817083 [0,2,0,0,0,0|2,0,0]=4 8638 B16R2.2904 Cn1cc(c(n1)CNc2ccccc2)Cl 207a_100000106764_100000040845 [0,2,0,0,0,0|2,0,0]=4 8639 B16R2.2904 Cn1cc(c(n1)CNc2ccccc2)Cl 270302a_100000106764_100000040845 [0,2,0,0,0,0|2,0,0]=4 8640 B16R2.2910 Brc1cccc(c1)NCc2ccsc2Br 207a_100000210019_100009816921 [0,2,0,0,0,0|2,0,0]=4 8641 B16R2.2910 Brc1cccc(c1)NCc2ccsc2Br 270302a_100000210019_100009816921 [0,2,0,0,0,0|2,0,0]=4 8642 B16R2.2910 Brc1cccc(c1)NCc2ccsc2Br 34a_100000210019_100009814289 [0,2,0,0,0,0|2,0,0]=4 8643 B16R2.2910 Brc1cccc(c1)NCc2cscc2Br 207a_100000210019_100000685484 [0,2,0,0,0,0|2,0,0]=4 8644 B16R2.2910 Brc1cccc(c1)NCc2cscc2Br 270302a_100000210019_100000685484 [0,2,0,0,0,0|2,0,0]=4 8645 B16R2.2910 Brc1cccc(c1)NCc2sccc2Br 207a_100000210019_100000766043 [0,2,0,0,0,0|2,0,0]=4 8646 B16R2.2910 Brc1cccc(c1)NCc2sccc2Br 270302a_100000210019_100000766043 [0,2,0,0,0,0|2,0,0]=4 8647 B16R2.2910 Brc1ccsc1CNc2cccc(c2)I 207a_100000211102_100000766043 [0,2,0,0,0,0|2,0,0]=4 8648 B16R2.2910 Brc1ccsc1CNc2cccc(c2)I 270302a_100000211102_100000766043 [0,2,0,0,0,0|2,0,0]=4 8649 B16R2.2910 Brc1cscc1CNc2cccc(c2)I 207a_100000211102_100000685484 [0,2,0,0,0,0|2,0,0]=4 8650 B16R2.2910 Brc1cscc1CNc2cccc(c2)I 270302a_100000211102_100000685484 [0,2,0,0,0,0|2,0,0]=4 8651 B16R2.2910 Brc1sccc1CNc2cccc(c2)I 207a_100000211102_100009816921 [0,2,0,0,0,0|2,0,0]=4 8652 B16R2.2910 Brc1sccc1CNc2cccc(c2)I 270302a_100000211102_100009816921 [0,2,0,0,0,0|2,0,0]=4 8653 B16R2.2910 Brc1sccc1CNc2cccc(c2)I 34a_100000211102_100009814289 [0,2,0,0,0,0|2,0,0]=4 8654 B16R2.2910 Cc1[nH]cnc1C=Cc2cccc(c2)Cl 271570a_100102525933_100009816806 [0,2,0,0,0,0|1,0,1]=4 8655 B16R2.2910 Cc1[nH]cnc1C=Cc2cccc(c2)F 271570a_100102525537_100009816806 [0,2,0,0,0,0|1,0,1]=4 8656 B16R2.2910 Cc1[nH]cnc1CNc2cccc(c2)Br 207a_100000210019_100000032982 [0,2,0,0,0,0|0,0,0]=2 8657 B16R2.2910 Cc1[nH]cnc1CNc2cccc(c2)Cl 207a_100000185859_100000032982 [0,2,0,0,0,0|0,0,0]=2 8658 B16R2.2910 Cc1[nH]cnc1CNc2cccc(c2)F 207a_100000210047_100000032982 [0,2,0,0,0,0|0,0,0]=2 8659 B16R2.2910 Cc1[nH]cnc1CNc2cccc(c2)I 207a_100000211102_100000032982 [0,2,0,0,0,0|0,0,0]=2 8660 B16R2.2910 Cc1[nH]cnc1CSc2cc(=O)cc[nH]2 62a_100009817434_100000751220 [0,2,0,0,0,0|2,0,0]=4 8661 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)Cl 62a_100000751220_100010167805 [0,2,0,0,0,0|2,0,0]=4 8662 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)Cl 62a_100010167805_100000751220 [0,2,0,0,0,0|2,0,0]=4 8663 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)F 62a_100000751220_100000764206 [0,2,0,0,0,0|2,0,0]=4 8664 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)F 62a_100000764206_100000751220 [0,2,0,0,0,0|2,0,0]=4 8665 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)N 62a_100000751220_100009814236 [0,2,0,0,0,0|2,0,0]=4 8666 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)N 62a_100009814236_100000751220 [0,2,0,0,0,0|2,0,0]=4 8667 B16R2.2910 Cc1[nH]cnc1CSc2cc(ccn2)O 62a_100000751220_100000762945 [0,2,0,0,0,0|2,0,0]=4 8668 B16R2.2910 Cc1[nH]cnc1CSc2cc[nH]c(=O)c2 62a_100000751220_100009816521 [0,2,0,0,0,0|2,0,0]=4 8669 B16R2.2910 Cc1[nH]cnc1CSc2cc[nH]c(=O)c2 62a_100009816521_100000751220 [0,2,0,0,0,0|2,0,0]=4 8670 B16R2.2910 Cc1[nH]cnc1CSc2ccc[n+](c2)C 62a_100000751220_100009996589 [0,2,0,0,0,0|2,0,0]=4 8671 B16R2.2910 Cc1[nH]cnc1CSc2ccc[n+](c2)C 62a_100009996589_100000751220 [0,2,0,0,0,0|2,0,0]=4 8672 B16R2.2910 Cc1[nH]cnc1CSc2ccc[n+](c2)[O-] 62a_100000751220_100009815978 [0,2,0,0,0,0|2,0,0]=4 8673 B16R2.2910 Cc1[nH]cnc1CSc2cccc(=O)[nH]2 62a_100000751220_100000752884 [0,2,0,0,0,0|2,0,0]=4 8674 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)Br 62a_100000691529_100000751220 [0,2,0,0,0,0|1,0,0]=3 8675 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)Br 62a_100000751220_100000691529 [0,2,0,0,0,0|1,0,0]=3 8676 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)Cl 62a_100000699651_100000751220 [0,2,0,0,0,0|1,0,0]=3 8677 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)Cl 62a_100000751220_100000699651 [0,2,0,0,0,0|1,0,0]=3 8678 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)F 62a_100000685547_100000751220 [0,2,0,0,0,0|1,0,0]=3 8679 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)F 62a_100000751220_100000685547 [0,2,0,0,0,0|1,0,0]=3 8680 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)N 62a_100000210019_100000751220 [0,2,0,0,0,0|1,0,0]=3 8681 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)N 62a_100000751220_100000210019 [0,2,0,0,0,0|1,0,0]=3 8682 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)O 62a_100000751220_100000211634 [0,2,0,0,0,0|1,0,0]=3 8683 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)[S] 62a_100000751220_114929384022 [0,2,0,0,0,0|1,0,0]=3 8684 B16R2.2910 Cc1[nH]cnc1CSc2cccc(c2)[S] 62a_114929384022_100000751220 [0,2,0,0,0,0|1,0,0]=3 8685 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)Br 62a_100000684672_100000751220 [0,2,0,0,0,0|2,0,0]=4 8686 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)Br 62a_100000751220_100000684672 [0,2,0,0,0,0|2,0,0]=4 8687 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)Cl 62a_100000051397_100000751220 [0,2,0,0,0,0|2,0,0]=4 8688 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)Cl 62a_100000751220_100000051397 [0,2,0,0,0,0|2,0,0]=4 8689 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)F 62a_100000751220_100009815982 [0,2,0,0,0,0|2,0,0]=4 8690 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)F 62a_100009815982_100000751220 [0,2,0,0,0,0|2,0,0]=4 8691 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)N 62a_100000740741_100000751220 [0,2,0,0,0,0|2,0,0]=4 8692 B16R2.2910 Cc1[nH]cnc1CSc2cccc(n2)N 62a_100000751220_100000740741 [0,2,0,0,0,0|2,0,0]=4 8693 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)Br 62a_100000751220_100009814637 [0,2,0,0,0,0|2,0,0]=4 8694 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)Br 62a_100009814637_100000751220 [0,2,0,0,0,0|2,0,0]=4 8695 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)Cl 62a_100000035001_100000751220 [0,2,0,0,0,0|2,0,0]=4 8696 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)Cl 62a_100000751220_100000035001 [0,2,0,0,0,0|2,0,0]=4 8697 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)F 62a_100000751220_100009816116 [0,2,0,0,0,0|2,0,0]=4 8698 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)F 62a_100009816116_100000751220 [0,2,0,0,0,0|2,0,0]=4 8699 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)N 62a_100000049665_100000751220 [0,2,0,0,0,0|2,0,0]=4 8700 B16R2.2910 Cc1[nH]cnc1CSc2ccnc(c2)N 62a_100000751220_100000049665 [0,2,0,0,0,0|2,0,0]=4 8701 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)Br 62a_100000728054_100000751220 [0,2,0,0,0,0|2,0,0]=4 8702 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)Br 62a_100000751220_100000728054 [0,2,0,0,0,0|2,0,0]=4 8703 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)Cl 62a_100000049639_100000751220 [0,2,0,0,0,0|2,0,0]=4 8704 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)Cl 62a_100000751220_100000049639 [0,2,0,0,0,0|2,0,0]=4 8705 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)F 62a_100000744099_100000751220 [0,2,0,0,0,0|2,0,0]=4 8706 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)F 62a_100000751220_100000744099 [0,2,0,0,0,0|2,0,0]=4 8707 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)N 62a_100000687067_100000751220 [0,2,0,0,0,0|2,0,0]=4 8708 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)N 62a_100000751220_100000687067 [0,2,0,0,0,0|2,0,0]=4 8709 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)O 62a_100000751220_100000754920 [0,2,0,0,0,0|2,0,0]=4 8710 B16R2.2910 Cc1[nH]cnc1CSc2cncc(c2)O 62a_100000754920_100000751220 [0,2,0,0,0,0|2,0,0]=4 8711 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)Br 62a_100000211773_100010186451 [0,2,0,0,0,0|2,0,0]=4 8712 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)Br 62a_100010186451_100000211773 [0,2,0,0,0,0|2,0,0]=4 8713 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)Cl 62a_100000187163_100010186451 [0,2,0,0,0,0|2,0,0]=4 8714 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)Cl 62a_100010186451_100000187163 [0,2,0,0,0,0|2,0,0]=4 8715 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)F 62a_100000230114_100010186451 [0,2,0,0,0,0|2,0,0]=4 8716 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)F 62a_100010186451_100000230114 [0,2,0,0,0,0|2,0,0]=4 8717 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)I 62a_100010186451_100011218688 [0,2,0,0,0,0|2,0,0]=4 8718 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)I 62a_100011218688_100010186451 [0,2,0,0,0,0|2,0,0]=4 8719 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)O 62a_100010186451_100011660834 [0,2,0,0,0,0|2,0,0]=4 8720 B16R2.2910 Cc1[nH]cnc1SCc2cccc(c2)O 62a_100011660834_100010186451 [0,2,0,0,0,0|2,0,0]=4 8721 B16R2.2910 Cc1cc(ccn1)SCc2nc[nH]c2C 62a_100000751220_100000758586 [0,2,0,0,0,0|2,0,0]=4 8722 B16R2.2910 Cc1cc(ccn1)SCc2nc[nH]c2C 62a_100000758586_100000751220 [0,2,0,0,0,0|2,0,0]=4 8723 B16R2.2910 Cc1cccc(c1)C=Cc2nc[nH]c2C 271570a_200135466880_100009816806 [0,2,0,0,0,0|1,0,1]=4 8724 B16R2.2910 Cc1cccc(c1)CSc2nc[nH]c2C 62a_100000211840_100010186451 [0,2,0,0,0,0|2,0,0]=4 8725 B16R2.2910 Cc1cccc(c1)CSc2nc[nH]c2C 62a_100010186451_100000211840 [0,2,0,0,0,0|2,0,0]=4 8726 B16R2.2910 Cc1cccc(c1)NCc2c[nH]nc2C 207a_100000188690_100000737037 [0,2,0,0,0,0|2,0,0]=4 8727 B16R2.2910 Cc1cccc(c1)NCc2c[nH]nc2C 270302a_100000188690_100000737037 [0,2,0,0,0,0|2,0,0]=4 8728 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Br 207a_100000188690_100009816921 [0,2,0,0,0,0|2,0,0]=4 8729 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Br 2230a_100000188690_100009814289 [0,2,0,0,0,0|2,0,0]=4 8730 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Br 270302a_100000188690_100009816921 [0,2,0,0,0,0|2,0,0]=4 8731 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Br 34a_100000188690_100009814289 [0,2,0,0,0,0|2,0,0]=4 8732 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Cl 207a_100000188690_100000089901 [0,2,0,0,0,0|2,0,0]=4 8733 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Cl 2230a_100000188690_100010167017 [0,2,0,0,0,0|2,0,0]=4 8734 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Cl 270302a_100000188690_100000089901 [0,2,0,0,0,0|2,0,0]=4 8735 B16R2.2910 Cc1cccc(c1)NCc2ccsc2Cl 34a_100000188690_100010167017 [0,2,0,0,0,0|2,0,0]=4 8736 B16R2.2910 Cc1cccc(c1)NCc2cncn2C 207a_100000188690_100000750899 [0,2,0,0,0,0|0,0,2]=4 8737 B16R2.2910 Cc1cccc(c1)NCc2cncn2C 270302a_100000188690_100000750899 [0,2,0,0,0,0|0,0,2]=4 8738 B16R2.2910 Cc1cccc(c1)NCc2cscc2Br 207a_100000188690_100000685484 [0,2,0,0,0,0|2,0,0]=4 8739 B16R2.2910 Cc1cccc(c1)NCc2cscc2Br 270302a_100000188690_100000685484 [0,2,0,0,0,0|2,0,0]=4 8740 B16R2.2910 Cc1cccc(c1)NCc2n[nH]cc2Cl 207a_100000188690_100000040271 [0,2,0,0,0,0|2,0,0]=4 8741 B16R2.2910 Cc1cccc(c1)NCc2nc[nH]c2C 207a_100000188690_100000032982 [0,2,0,0,0,0|0,0,0]=2 8742 B16R2.2910 Cc1cccc(c1)NCc2nc[nH]c2C 2230a_100000188690_100000751220 [0,2,0,0,0,0|0,0,0]=2 8743 B16R2.2910 Cc1cccc(c1)NCc2nccn2C 207a_100000188690_100000748660 [0,2,0,0,0,0|2,0,0]=4 8744 B16R2.2910 Cc1cccc(c1)NCc2nccn2C 2230a_100000188690_100000700302 [0,2,0,0,0,0|2,0,0]=4 8745 B16R2.2910 Cc1cccc(c1)NCc2nccn2C 34a_100000188690_100000700302 [0,2,0,0,0,0|2,0,0]=4 8746 B16R2.2910 Cc1cccc(c1)NCc2ncoc2C 2230a_100000188690_200000693990 [0,2,0,0,0,0|1,0,0]=3 8747 B16R2.2910 Cc1cccc(c1)NCc2ncoc2C 34a_100000188690_200000693990 [0,2,0,0,0,0|1,0,0]=3 8748 B16R2.2910 Cc1cccc(c1)NCc2nnsc2Cl 2230a_100000188690_100000018852 [0,2,0,0,0,0|2,0,0]=4 8749 B16R2.2910 Cc1cccc(c1)NCc2nonc2C 2230a_100000188690_200000044682 [0,2,0,0,0,0|1,0,1]=4 8750 B16R2.2910 Cc1cccc(c1)NCc2nonc2C 34a_100000188690_200000044682 [0,2,0,0,0,0|1,0,1]=4 8751 B16R2.2910 Cc1cccc(c1)NCc2occc2C 207a_100000188690_100000763527 [0,2,0,0,0,0|2,0,0]=4 8752 B16R2.2910 Cc1cccc(c1)NCc2occc2C 270302a_100000188690_100000763527 [0,2,0,0,0,0|2,0,0]=4 8753 B16R2.2910 Cc1cccc(c1)NCc2sccc2Br 207a_100000188690_100000766043 [0,2,0,0,0,0|2,0,0]=4 8754 B16R2.2910 Cc1cccc(c1)NCc2sccc2Br 270302a_100000188690_100000766043 [0,2,0,0,0,0|2,0,0]=4 8755 B16R2.2910 Cc1cccc(c1)NCc2sccc2C 207a_100000188690_100000210881 [0,2,0,0,0,0|2,0,0]=4 8756 B16R2.2910 Cc1cccc(c1)NCc2sccc2C 270302a_100000188690_100000210881 [0,2,0,0,0,0|2,0,0]=4 8757 B16R2.2910 Cc1cccc(c1)NCc2sccc2Cl 207a_100000188690_100000722334 [0,2,0,0,0,0|2,0,0]=4 8758 B16R2.2910 Cc1cccc(c1)NCc2sccc2Cl 270302a_100000188690_100000722334 [0,2,0,0,0,0|2,0,0]=4 8759 B16R2.2910 Cc1cccc(c1)NCc2scnc2C 207a_100000188690_100000764165 [0,2,0,0,0,0|1,0,1]=4 8760 B16R2.2910 Cc1cccc(c1)NCc2scnc2C 270302a_100000188690_100000764165 [0,2,0,0,0,0|1,0,1]=4 8761 B16R2.2910 Cc1cccc(c1)OCc2ncoc2C 34a_100000210337_200000693990 [0,2,0,0,0,0|2,0,0]=4 8762 B16R2.2910 Cc1cccc(c1)OCc2ncoc2C 7a_100000210337_200000693990 [0,2,0,0,0,0|2,0,0]=4 8763 B16R2.2910 Cc1cccc(c1)SCc2nc[nH]c2C 62a_100000751220_100011215228 [0,2,0,0,0,0|1,0,0]=3 8764 B16R2.2910 Cc1cccc(c1)SCc2nc[nH]c2C 62a_100011215228_100000751220 [0,2,0,0,0,0|1,0,0]=3 8765 B16R2.2910 Cc1cccc(c1)SCc2ncoc2C 62a_100011215228_200000693990 [0,2,0,0,0,0|2,0,0]=4 8766 B16R2.2910 Cc1cccc(c1)SCc2ncoc2C 62a_200000693990_100011215228 [0,2,0,0,0,0|2,0,0]=4 8767 B16R2.2910 Cc1cccc(n1)SCc2nc[nH]c2C 62a_100000742759_100000751220 [0,2,0,0,0,0|2,0,0]=4 8768 B16R2.2910 Cc1cccc(n1)SCc2nc[nH]c2C 62a_100000751220_100000742759 [0,2,0,0,0,0|2,0,0]=4 8769 B16R2.2910 Cc1ccnc(c1)SCc2nc[nH]c2C 62a_100000750283_100000751220 [0,2,0,0,0,0|2,0,0]=4 8770 B16R2.2910 Cc1ccnc(c1)SCc2nc[nH]c2C 62a_100000751220_100000750283 [0,2,0,0,0,0|2,0,0]=4 8771 B16R2.2910 Cc1ccoc1CNc2cccc(c2)Br 207a_100000210019_100000763527 [0,2,0,0,0,0|2,0,0]=4 8772 B16R2.2910 Cc1ccoc1CNc2cccc(c2)Br 270302a_100000210019_100000763527 [0,2,0,0,0,0|2,0,0]=4 8773 B16R2.2910 Cc1ccoc1CNc2cccc(c2)Cl 207a_100000185859_100000763527 [0,2,0,0,0,0|2,0,0]=4 8774 B16R2.2910 Cc1ccoc1CNc2cccc(c2)Cl 270302a_100000185859_100000763527 [0,2,0,0,0,0|2,0,0]=4 8775 B16R2.2910 Cc1ccoc1CNc2cccc(c2)F 207a_100000210047_100000763527 [0,2,0,0,0,0|2,0,0]=4 8776 B16R2.2910 Cc1ccoc1CNc2cccc(c2)F 270302a_100000210047_100000763527 [0,2,0,0,0,0|2,0,0]=4 8777 B16R2.2910 Cc1ccoc1CNc2cccc(c2)I 207a_100000211102_100000763527 [0,2,0,0,0,0|2,0,0]=4 8778 B16R2.2910 Cc1ccoc1CNc2cccc(c2)I 270302a_100000211102_100000763527 [0,2,0,0,0,0|2,0,0]=4 8779 B16R2.2910 Cc1ccoc1CNc2cccc(c2)O 270302a_100000210217_100000763527 [0,2,0,0,0,0|2,0,0]=4 8780 B16R2.2910 Cc1ccsc1CNc2cccc(c2)Br 207a_100000210019_100000210881 [0,2,0,0,0,0|2,0,0]=4 8781 B16R2.2910 Cc1ccsc1CNc2cccc(c2)Br 270302a_100000210019_100000210881 [0,2,0,0,0,0|2,0,0]=4 8782 B16R2.2910 Cc1ccsc1CNc2cccc(c2)Cl 207a_100000185859_100000210881 [0,2,0,0,0,0|2,0,0]=4 8783 B16R2.2910 Cc1ccsc1CNc2cccc(c2)Cl 270302a_100000185859_100000210881 [0,2,0,0,0,0|2,0,0]=4 8784 B16R2.2910 Cc1ccsc1CNc2cccc(c2)F 207a_100000210047_100000210881 [0,2,0,0,0,0|2,0,0]=4 8785 B16R2.2910 Cc1ccsc1CNc2cccc(c2)F 270302a_100000210047_100000210881 [0,2,0,0,0,0|2,0,0]=4 8786 B16R2.2910 Cc1ccsc1CNc2cccc(c2)I 207a_100000211102_100000210881 [0,2,0,0,0,0|2,0,0]=4 8787 B16R2.2910 Cc1ccsc1CNc2cccc(c2)I 270302a_100000211102_100000210881 [0,2,0,0,0,0|2,0,0]=4 8788 B16R2.2910 Cc1ccsc1CNc2cccc(c2)O 270302a_100000210217_100000210881 [0,2,0,0,0,0|2,0,0]=4 8789 B16R2.2910 Cc1cncc(c1)SCc2nc[nH]c2C 62a_100000751220_100000760492 [0,2,0,0,0,0|2,0,0]=4 8790 B16R2.2910 Cc1cncc(c1)SCc2nc[nH]c2C 62a_100000760492_100000751220 [0,2,0,0,0,0|2,0,0]=4 8791 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)Br 207a_100000210019_100000737037 [0,2,0,0,0,0|2,0,0]=4 8792 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)Br 270302a_100000210019_100000737037 [0,2,0,0,0,0|2,0,0]=4 8793 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)Cl 207a_100000185859_100000737037 [0,2,0,0,0,0|2,0,0]=4 8794 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)Cl 270302a_100000185859_100000737037 [0,2,0,0,0,0|2,0,0]=4 8795 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)F 207a_100000210047_100000737037 [0,2,0,0,0,0|2,0,0]=4 8796 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)F 270302a_100000210047_100000737037 [0,2,0,0,0,0|2,0,0]=4 8797 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)I 207a_100000211102_100000737037 [0,2,0,0,0,0|2,0,0]=4 8798 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)I 270302a_100000211102_100000737037 [0,2,0,0,0,0|2,0,0]=4 8799 B16R2.2910 Cc1n[nH]cc1CNc2cccc(c2)O 270302a_100000210217_100000737037 [0,2,0,0,0,0|2,0,0]=4 8800 B16R2.2910 Cc1ncsc1CNc2cccc(c2)Br 207a_100000210019_100000764165 [0,2,0,0,0,0|1,0,1]=4 8801 B16R2.2910 Cc1ncsc1CNc2cccc(c2)Br 270302a_100000210019_100000764165 [0,2,0,0,0,0|1,0,1]=4 8802 B16R2.2910 Cc1ncsc1CNc2cccc(c2)Cl 207a_100000185859_100000764165 [0,2,0,0,0,0|1,0,1]=4 8803 B16R2.2910 Cc1ncsc1CNc2cccc(c2)Cl 270302a_100000185859_100000764165 [0,2,0,0,0,0|1,0,1]=4 8804 B16R2.2910 Cc1ncsc1CNc2cccc(c2)F 207a_100000210047_100000764165 [0,2,0,0,0,0|1,0,1]=4 8805 B16R2.2910 Cc1ncsc1CNc2cccc(c2)F 270302a_100000210047_100000764165 [0,2,0,0,0,0|1,0,1]=4 8806 B16R2.2910 Cc1ncsc1CNc2cccc(c2)I 207a_100000211102_100000764165 [0,2,0,0,0,0|1,0,1]=4 8807 B16R2.2910 Cc1ncsc1CNc2cccc(c2)I 270302a_100000211102_100000764165 [0,2,0,0,0,0|1,0,1]=4 8808 B16R2.2910 Cc1ncsc1CNc2cccc(c2)O 270302a_100000210217_100000764165 [0,2,0,0,0,0|1,0,1]=4 8809 B16R2.2910 Cc1nonc1CNc2cccc(c2)Br 34a_100000210019_200000044682 [0,2,0,0,0,0|1,0,1]=4 8810 B16R2.2910 Cc1nonc1CNc2cccc(c2)Cl 34a_100000185859_200000044682 [0,2,0,0,0,0|1,0,1]=4 8811 B16R2.2910 Cc1nonc1CNc2cccc(c2)F 34a_100000210047_200000044682 [0,2,0,0,0,0|1,0,1]=4 8812 B16R2.2910 Cc1nonc1CNc2cccc(c2)I 34a_100000211102_200000044682 [0,2,0,0,0,0|1,0,1]=4 8813 B16R2.2910 Cc1nonc1CNc2cccc(c2)O 34a_100000210217_200000044682 [0,2,0,0,0,0|1,0,1]=4 8814 B16R2.2910 Cc1ocnc1CNc2cccc(c2)Br 34a_100000210019_200000693990 [0,2,0,0,0,0|1,0,0]=3 8815 B16R2.2910 Cc1ocnc1CNc2cccc(c2)Cl 34a_100000185859_200000693990 [0,2,0,0,0,0|1,0,0]=3 8816 B16R2.2910 Cc1ocnc1CNc2cccc(c2)F 34a_100000210047_200000693990 [0,2,0,0,0,0|1,0,0]=3 8817 B16R2.2910 Cc1ocnc1CNc2cccc(c2)I 34a_100000211102_200000693990 [0,2,0,0,0,0|1,0,0]=3 8818 B16R2.2910 Cc1ocnc1CNc2cccc(c2)O 34a_100000210217_200000693990 [0,2,0,0,0,0|1,0,0]=3 8819 B16R2.2910 Cc1ocnc1COc2cccc(c2)Br 34a_100000210342_200000693990 [0,2,0,0,0,0|2,0,0]=4 8820 B16R2.2910 Cc1ocnc1COc2cccc(c2)Br 7a_100000210342_200000693990 [0,2,0,0,0,0|2,0,0]=4 8821 B16R2.2910 Cc1ocnc1COc2cccc(c2)Cl 34a_100000210295_200000693990 [0,2,0,0,0,0|2,0,0]=4 8822 B16R2.2910 Cc1ocnc1COc2cccc(c2)Cl 7a_100000210295_200000693990 [0,2,0,0,0,0|2,0,0]=4 8823 B16R2.2910 Cc1ocnc1COc2cccc(c2)F 34a_100000210426_200000693990 [0,2,0,0,0,0|2,0,0]=4 8824 B16R2.2910 Cc1ocnc1COc2cccc(c2)F 7a_100000210426_200000693990 [0,2,0,0,0,0|2,0,0]=4 8825 B16R2.2910 Cc1ocnc1COc2cccc(c2)I 34a_100000211634_200000693990 [0,2,0,0,0,0|2,0,0]=4 8826 B16R2.2910 Cc1ocnc1COc2cccc(c2)I 7a_100000211634_200000693990 [0,2,0,0,0,0|2,0,0]=4 8827 B16R2.2910 Cc1ocnc1COc2cccc(c2)N 34a_100000210217_200000693990 [0,2,0,0,0,0|2,0,0]=4 8828 B16R2.2910 Cc1ocnc1CSc2cccc(c2)Br 62a_100000691529_200000693990 [0,2,0,0,0,0|2,0,0]=4 8829 B16R2.2910 Cc1ocnc1CSc2cccc(c2)Br 62a_200000693990_100000691529 [0,2,0,0,0,0|2,0,0]=4 8830 B16R2.2910 Cc1ocnc1CSc2cccc(c2)Cl 62a_100000699651_200000693990 [0,2,0,0,0,0|2,0,0]=4 8831 B16R2.2910 Cc1ocnc1CSc2cccc(c2)Cl 62a_200000693990_100000699651 [0,2,0,0,0,0|2,0,0]=4 8832 B16R2.2910 Cc1ocnc1CSc2cccc(c2)F 62a_100000685547_200000693990 [0,2,0,0,0,0|2,0,0]=4 8833 B16R2.2910 Cc1ocnc1CSc2cccc(c2)F 62a_200000693990_100000685547 [0,2,0,0,0,0|2,0,0]=4 8834 B16R2.2910 Cc1ocnc1CSc2cccc(c2)N 62a_100000210019_200000693990 [0,2,0,0,0,0|2,0,0]=4 8835 B16R2.2910 Cc1ocnc1CSc2cccc(c2)N 62a_200000693990_100000210019 [0,2,0,0,0,0|2,0,0]=4 8836 B16R2.2910 Cc1ocnc1CSc2cccc(c2)O 62a_200000693990_100000211634 [0,2,0,0,0,0|2,0,0]=4 8837 B16R2.2910 Cc1ocnc1CSc2cccc(c2)[S] 62a_114929384022_200000693990 [0,2,0,0,0,0|2,0,0]=4 8838 B16R2.2910 Cc1ocnc1CSc2cccc(c2)[S] 62a_200000693990_114929384022 [0,2,0,0,0,0|2,0,0]=4 8839 B16R2.2910 Clc1c[nH]nc1CNc2cccc(c2)Br 207a_100000210019_100000040271 [0,2,0,0,0,0|2,0,0]=4 8840 B16R2.2910 Clc1c[nH]nc1CNc2cccc(c2)I 207a_100000211102_100000040271 [0,2,0,0,0,0|2,0,0]=4 8841 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Br 207a_100000185859_100009816921 [0,2,0,0,0,0|2,0,0]=4 8842 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Br 270302a_100000185859_100009816921 [0,2,0,0,0,0|2,0,0]=4 8843 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Br 34a_100000185859_100009814289 [0,2,0,0,0,0|2,0,0]=4 8844 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Cl 207a_100000185859_100000089901 [0,2,0,0,0,0|2,0,0]=4 8845 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Cl 270302a_100000185859_100000089901 [0,2,0,0,0,0|2,0,0]=4 8846 B16R2.2910 Clc1cccc(c1)NCc2ccsc2Cl 34a_100000185859_100010167017 [0,2,0,0,0,0|2,0,0]=4 8847 B16R2.2910 Clc1cccc(c1)NCc2cscc2Br 207a_100000185859_100000685484 [0,2,0,0,0,0|2,0,0]=4 8848 B16R2.2910 Clc1cccc(c1)NCc2cscc2Br 270302a_100000185859_100000685484 [0,2,0,0,0,0|2,0,0]=4 8849 B16R2.2910 Clc1cccc(c1)NCc2n[nH]cc2Cl 207a_100000185859_100000040271 [0,2,0,0,0,0|2,0,0]=4 8850 B16R2.2910 Clc1cccc(c1)NCc2sccc2Br 207a_100000185859_100000766043 [0,2,0,0,0,0|2,0,0]=4 8851 B16R2.2910 Clc1cccc(c1)NCc2sccc2Br 270302a_100000185859_100000766043 [0,2,0,0,0,0|2,0,0]=4 8852 B16R2.2910 Clc1cccc(c1)NCc2sccc2Cl 207a_100000185859_100000722334 [0,2,0,0,0,0|2,0,0]=4 8853 B16R2.2910 Clc1cccc(c1)NCc2sccc2Cl 270302a_100000185859_100000722334 [0,2,0,0,0,0|2,0,0]=4 8854 B16R2.2910 Clc1ccsc1CNc2cccc(c2)Br 207a_100000210019_100000722334 [0,2,0,0,0,0|2,0,0]=4 8855 B16R2.2910 Clc1ccsc1CNc2cccc(c2)Br 270302a_100000210019_100000722334 [0,2,0,0,0,0|2,0,0]=4 8856 B16R2.2910 Clc1ccsc1CNc2cccc(c2)I 207a_100000211102_100000722334 [0,2,0,0,0,0|2,0,0]=4 8857 B16R2.2910 Clc1ccsc1CNc2cccc(c2)I 270302a_100000211102_100000722334 [0,2,0,0,0,0|2,0,0]=4 8858 B16R2.2910 Clc1sccc1CNc2cccc(c2)Br 207a_100000210019_100000089901 [0,2,0,0,0,0|2,0,0]=4 8859 B16R2.2910 Clc1sccc1CNc2cccc(c2)Br 270302a_100000210019_100000089901 [0,2,0,0,0,0|2,0,0]=4 8860 B16R2.2910 Clc1sccc1CNc2cccc(c2)Br 34a_100000210019_100010167017 [0,2,0,0,0,0|2,0,0]=4 8861 B16R2.2910 Clc1sccc1CNc2cccc(c2)I 207a_100000211102_100000089901 [0,2,0,0,0,0|2,0,0]=4 8862 B16R2.2910 Clc1sccc1CNc2cccc(c2)I 270302a_100000211102_100000089901 [0,2,0,0,0,0|2,0,0]=4 8863 B16R2.2910 Clc1sccc1CNc2cccc(c2)I 34a_100000211102_100010167017 [0,2,0,0,0,0|2,0,0]=4 8864 B16R2.2910 Cn1ccnc1CNc2cccc(c2)Br 207a_100000210019_100000748660 [0,2,0,0,0,0|2,0,0]=4 8865 B16R2.2910 Cn1ccnc1CNc2cccc(c2)Br 34a_100000210019_100000700302 [0,2,0,0,0,0|2,0,0]=4 8866 B16R2.2910 Cn1ccnc1CNc2cccc(c2)Cl 207a_100000185859_100000748660 [0,2,0,0,0,0|2,0,0]=4 8867 B16R2.2910 Cn1ccnc1CNc2cccc(c2)Cl 34a_100000185859_100000700302 [0,2,0,0,0,0|2,0,0]=4 8868 B16R2.2910 Cn1ccnc1CNc2cccc(c2)F 207a_100000210047_100000748660 [0,2,0,0,0,0|2,0,0]=4 8869 B16R2.2910 Cn1ccnc1CNc2cccc(c2)F 34a_100000210047_100000700302 [0,2,0,0,0,0|2,0,0]=4 8870 B16R2.2910 Cn1ccnc1CNc2cccc(c2)I 207a_100000211102_100000748660 [0,2,0,0,0,0|2,0,0]=4 8871 B16R2.2910 Cn1ccnc1CNc2cccc(c2)I 34a_100000211102_100000700302 [0,2,0,0,0,0|2,0,0]=4 8872 B16R2.2910 Cn1ccnc1CNc2cccc(c2)O 34a_100000210217_100000700302 [0,2,0,0,0,0|2,0,0]=4 8873 B16R2.2910 Cn1cncc1CNc2cccc(c2)Br 207a_100000210019_100000750899 [0,2,0,0,0,0|0,0,2]=4 8874 B16R2.2910 Cn1cncc1CNc2cccc(c2)Br 270302a_100000210019_100000750899 [0,2,0,0,0,0|0,0,2]=4 8875 B16R2.2910 Cn1cncc1CNc2cccc(c2)Cl 207a_100000185859_100000750899 [0,2,0,0,0,0|0,0,2]=4 8876 B16R2.2910 Cn1cncc1CNc2cccc(c2)Cl 270302a_100000185859_100000750899 [0,2,0,0,0,0|0,0,2]=4 8877 B16R2.2910 Cn1cncc1CNc2cccc(c2)F 207a_100000210047_100000750899 [0,2,0,0,0,0|0,0,2]=4 8878 B16R2.2910 Cn1cncc1CNc2cccc(c2)F 270302a_100000210047_100000750899 [0,2,0,0,0,0|0,0,2]=4 8879 B16R2.2910 Cn1cncc1CNc2cccc(c2)I 207a_100000211102_100000750899 [0,2,0,0,0,0|0,0,2]=4 8880 B16R2.2910 Cn1cncc1CNc2cccc(c2)I 270302a_100000211102_100000750899 [0,2,0,0,0,0|0,0,2]=4 8881 B16R2.2910 Cn1cncc1CNc2cccc(c2)O 270302a_100000210217_100000750899 [0,2,0,0,0,0|0,0,2]=4 8882 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Br 207a_100000210047_100009816921 [0,2,0,0,0,0|2,0,0]=4 8883 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Br 270302a_100000210047_100009816921 [0,2,0,0,0,0|2,0,0]=4 8884 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Br 34a_100000210047_100009814289 [0,2,0,0,0,0|2,0,0]=4 8885 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Cl 207a_100000210047_100000089901 [0,2,0,0,0,0|2,0,0]=4 8886 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Cl 270302a_100000210047_100000089901 [0,2,0,0,0,0|2,0,0]=4 8887 B16R2.2910 Fc1cccc(c1)NCc2ccsc2Cl 34a_100000210047_100010167017 [0,2,0,0,0,0|2,0,0]=4 8888 B16R2.2910 Fc1cccc(c1)NCc2cscc2Br 207a_100000210047_100000685484 [0,2,0,0,0,0|2,0,0]=4 8889 B16R2.2910 Fc1cccc(c1)NCc2cscc2Br 270302a_100000210047_100000685484 [0,2,0,0,0,0|2,0,0]=4 8890 B16R2.2910 Fc1cccc(c1)NCc2n[nH]cc2Cl 207a_100000210047_100000040271 [0,2,0,0,0,0|2,0,0]=4 8891 B16R2.2910 Fc1cccc(c1)NCc2sccc2Br 207a_100000210047_100000766043 [0,2,0,0,0,0|2,0,0]=4 8892 B16R2.2910 Fc1cccc(c1)NCc2sccc2Br 270302a_100000210047_100000766043 [0,2,0,0,0,0|2,0,0]=4 8893 B16R2.2910 Fc1cccc(c1)NCc2sccc2Cl 207a_100000210047_100000722334 [0,2,0,0,0,0|2,0,0]=4 8894 B16R2.2910 Fc1cccc(c1)NCc2sccc2Cl 270302a_100000210047_100000722334 [0,2,0,0,0,0|2,0,0]=4 8895 B16R2.2910 Oc1cccc(c1)NCc2ccsc2Br 270302a_100000210217_100009816921 [0,2,0,0,0,0|2,0,0]=4 8896 B16R2.2910 Oc1cccc(c1)NCc2ccsc2Br 34a_100000210217_100009814289 [0,2,0,0,0,0|2,0,0]=4 8897 B16R2.2910 Oc1cccc(c1)NCc2ccsc2Cl 270302a_100000210217_100000089901 [0,2,0,0,0,0|2,0,0]=4 8898 B16R2.2910 Oc1cccc(c1)NCc2ccsc2Cl 34a_100000210217_100010167017 [0,2,0,0,0,0|2,0,0]=4 8899 B16R2.2910 Oc1cccc(c1)NCc2cscc2Br 270302a_100000210217_100000685484 [0,2,0,0,0,0|2,0,0]=4 8900 B16R2.2910 Oc1cccc(c1)NCc2sccc2Br 270302a_100000210217_100000766043 [0,2,0,0,0,0|2,0,0]=4 8901 B16R2.2910 Oc1cccc(c1)NCc2sccc2Cl 270302a_100000210217_100000722334 [0,2,0,0,0,0|2,0,0]=4 8902 B16R2.2948 Cc1[nH]nc(c1CNc2ccccc2)Cl 207a_100000106764_100000695511 [0,2,0,0,0,0|2,0,0]=4 8903 B16R2.2948 Cc1n[nH]c(c1CNc2ccccc2)C 207a_100000106764_100000739816 [0,2,0,0,0,0|2,0,0]=4 8904 B16R2.2948 Cc1n[nH]c(c1CNc2ccccc2)C 270302a_100000106764_100000739816 [0,2,0,0,0,0|2,0,0]=4 8905 B16R2.2948 Cn1cnc(c1CNc2ccccc2)I 207a_100000106764_200000040309 [0,2,0,0,0,0|0,0,2]=4 8906 B16R2.2966 Brc1ccccc1NCc2ccsc2Br 207a_100000210017_100009816921 [0,2,0,0,0,0|2,0,0]=4 8907 B16R2.2966 Brc1ccccc1NCc2ccsc2Br 34a_100000210017_100009814289 [0,2,0,0,0,0|2,0,0]=4 8908 B16R2.2966 Brc1ccccc1NCc2sccc2Br 207a_100000210017_100000766043 [0,2,0,0,0,0|2,0,0]=4 8909 B16R2.2966 Brc1ccsc1CNc2ccccc2I 207a_100000210053_100000766043 [0,2,0,0,0,0|2,0,0]=4 8910 B16R2.2966 Brc1cscc1CNc2ccccc2Br 207a_100000210017_100000685484 [0,2,0,0,0,0|2,0,0]=4 8911 B16R2.2966 Brc1cscc1CNc2ccccc2I 207a_100000210053_100000685484 [0,2,0,0,0,0|2,0,0]=4 8912 B16R2.2966 Brc1sccc1CNc2ccccc2I 207a_100000210053_100009816921 [0,2,0,0,0,0|2,0,0]=4 8913 B16R2.2966 Brc1sccc1CNc2ccccc2I 34a_100000210053_100009814289 [0,2,0,0,0,0|2,0,0]=4 8914 B16R2.2966 Cc1[nH]cnc1C=Cc2ccccc2F 271570a_200102527919_100009816806 [0,2,0,0,0,0|1,0,1]=4 8915 B16R2.2966 Cc1[nH]cnc1CNc2ccccc2Br 207a_100000210017_100000032982 [0,2,0,0,0,0|0,0,0]=2 8916 B16R2.2966 Cc1[nH]cnc1CNc2ccccc2Cl 207a_100000185783_100000032982 [0,2,0,0,0,0|0,0,0]=2 8917 B16R2.2966 Cc1[nH]cnc1CNc2ccccc2F 207a_100000210422_100000032982 [0,2,0,0,0,0|0,0,0]=2 8918 B16R2.2966 Cc1[nH]cnc1CNc2ccccc2I 207a_100000210053_100000032982 [0,2,0,0,0,0|0,0,0]=2 8919 B16R2.2966 Cc1[nH]cnc1CSc2c[nH]ccc2=O 62a_100000751220_100009998708 [0,2,0,0,0,0|2,0,0]=4 8920 B16R2.2966 Cc1[nH]cnc1CSc2c[nH]ccc2=O 62a_100009998708_100000751220 [0,2,0,0,0,0|2,0,0]=4 8921 B16R2.2966 Cc1[nH]cnc1CSc2c[nH]ccc2=S 62a_100000751220_200012280681 [0,2,0,0,0,0|2,0,0]=4 8922 B16R2.2966 Cc1[nH]cnc1CSc2c[nH]ccc2=S 62a_200012280681_100000751220 [0,2,0,0,0,0|2,0,0]=4 8923 B16R2.2966 Cc1[nH]cnc1CSc2cccc[n+]2C 62a_100000751220_100000212160 [0,2,0,0,0,0|2,0,0]=4 8924 B16R2.2966 Cc1[nH]cnc1CSc2cccc[n+]2[O-] 62a_100000751220_200000042595 [0,2,0,0,0,0|2,0,0]=4 8925 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2Br 62a_100000695589_100000751220 [0,2,0,0,0,0|1,0,0]=3 8926 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2Br 62a_100000751220_100000695589 [0,2,0,0,0,0|1,0,0]=3 8927 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2Cl 62a_100000751220_100000764095 [0,2,0,0,0,0|1,0,0]=3 8928 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2Cl 62a_100000764095_100000751220 [0,2,0,0,0,0|1,0,0]=3 8929 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2F 62a_100000751220_100011215700 [0,2,0,0,0,0|1,0,0]=3 8930 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2F 62a_100011215700_100000751220 [0,2,0,0,0,0|1,0,0]=3 8931 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2N 62a_100000210017_100000751220 [0,2,0,0,0,0|1,0,0]=3 8932 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2N 62a_100000751220_100000210017 [0,2,0,0,0,0|1,0,0]=3 8933 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2O 62a_100000739446_100000751220 [0,2,0,0,0,0|1,0,0]=3 8934 B16R2.2966 Cc1[nH]cnc1CSc2ccccc2O 62a_100000751220_100000739446 [0,2,0,0,0,0|1,0,0]=3 8935 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2Br 62a_100000751220_100010202626 [0,2,0,0,0,0|2,0,0]=4 8936 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2Br 62a_100010202626_100000751220 [0,2,0,0,0,0|2,0,0]=4 8937 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2Cl 62a_100000036424_100000751220 [0,2,0,0,0,0|2,0,0]=4 8938 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2Cl 62a_100000751220_100000036424 [0,2,0,0,0,0|2,0,0]=4 8939 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2F 62a_100000751220_100009816115 [0,2,0,0,0,0|2,0,0]=4 8940 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2F 62a_100009816115_100000751220 [0,2,0,0,0,0|2,0,0]=4 8941 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2N 62a_100000045569_100000751220 [0,2,0,0,0,0|2,0,0]=4 8942 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2N 62a_100000751220_100000045569 [0,2,0,0,0,0|2,0,0]=4 8943 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2O 62a_100000751220_100000760158 [0,2,0,0,0,0|2,0,0]=4 8944 B16R2.2966 Cc1[nH]cnc1CSc2cccnc2O 62a_100000760158_100000751220 [0,2,0,0,0,0|2,0,0]=4 8945 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2Br 62a_100000726257_100000751220 [0,2,0,0,0,0|2,0,0]=4 8946 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2Br 62a_100000751220_100000726257 [0,2,0,0,0,0|2,0,0]=4 8947 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2Cl 62a_100000708259_100000751220 [0,2,0,0,0,0|2,0,0]=4 8948 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2Cl 62a_100000751220_100000708259 [0,2,0,0,0,0|2,0,0]=4 8949 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2F 62a_100000047030_100000751220 [0,2,0,0,0,0|2,0,0]=4 8950 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2F 62a_100000751220_100000047030 [0,2,0,0,0,0|2,0,0]=4 8951 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2N 62a_100000751220_100000756074 [0,2,0,0,0,0|2,0,0]=4 8952 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2N 62a_100000756074_100000751220 [0,2,0,0,0,0|2,0,0]=4 8953 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2O 62a_100000751220_100009817591 [0,2,0,0,0,0|2,0,0]=4 8954 B16R2.2966 Cc1[nH]cnc1CSc2ccncc2O 62a_100009817591_100000751220 [0,2,0,0,0,0|2,0,0]=4 8955 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2Br 62a_100000751220_100010138639 [0,2,0,0,0,0|2,0,0]=4 8956 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2Br 62a_100010138639_100000751220 [0,2,0,0,0,0|2,0,0]=4 8957 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2Cl 62a_100000751220_100009995489 [0,2,0,0,0,0|2,0,0]=4 8958 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2Cl 62a_100009995489_100000751220 [0,2,0,0,0,0|2,0,0]=4 8959 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2F 62a_100000751220_100009820683 [0,2,0,0,0,0|2,0,0]=4 8960 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2F 62a_100009820683_100000751220 [0,2,0,0,0,0|2,0,0]=4 8961 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2N 62a_100000047001_100000751220 [0,2,0,0,0,0|2,0,0]=4 8962 B16R2.2966 Cc1[nH]cnc1CSc2cnccc2N 62a_100000751220_100000047001 [0,2,0,0,0,0|2,0,0]=4 8963 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2Br 62a_100000696092_100000751220 [0,2,0,0,0,0|2,0,0]=4 8964 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2Br 62a_100000751220_100000696092 [0,2,0,0,0,0|2,0,0]=4 8965 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2Cl 62a_100000751220_100011356963 [0,2,0,0,0,0|2,0,0]=4 8966 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2Cl 62a_100011356963_100000751220 [0,2,0,0,0,0|2,0,0]=4 8967 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2F 62a_100000685392_100000751220 [0,2,0,0,0,0|2,0,0]=4 8968 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2F 62a_100000751220_100000685392 [0,2,0,0,0,0|2,0,0]=4 8969 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2N 62a_100000688686_100000751220 [0,2,0,0,0,0|2,0,0]=4 8970 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2N 62a_100000751220_100000688686 [0,2,0,0,0,0|2,0,0]=4 8971 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2O 62a_100000034122_100000751220 [0,2,0,0,0,0|2,0,0]=4 8972 B16R2.2966 Cc1[nH]cnc1CSc2ncccc2O 62a_100000751220_100000034122 [0,2,0,0,0,0|2,0,0]=4 8973 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2Br 62a_100000184730_100010186451 [0,2,0,0,0,0|2,0,0]=4 8974 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2Br 62a_100010186451_100000184730 [0,2,0,0,0,0|2,0,0]=4 8975 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2Cl 62a_100000187162_100010186451 [0,2,0,0,0,0|2,0,0]=4 8976 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2Cl 62a_100010186451_100000187162 [0,2,0,0,0,0|2,0,0]=4 8977 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2F 62a_100000211605_100010186451 [0,2,0,0,0,0|2,0,0]=4 8978 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2F 62a_100010186451_100000211605 [0,2,0,0,0,0|2,0,0]=4 8979 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2I 62a_100010186451_100011216222 [0,2,0,0,0,0|2,0,0]=4 8980 B16R2.2966 Cc1[nH]cnc1SCc2ccccc2I 62a_100011216222_100010186451 [0,2,0,0,0,0|2,0,0]=4 8981 B16R2.2966 Cc1ccccc1CSc2nc[nH]c2C 62a_100000211839_100010186451 [0,2,0,0,0,0|2,0,0]=4 8982 B16R2.2966 Cc1ccccc1CSc2nc[nH]c2C 62a_100010186451_100000211839 [0,2,0,0,0,0|2,0,0]=4 8983 B16R2.2966 Cc1ccccc1NCc2c[nH]nc2C 207a_100015192222_100000737037 [0,2,0,0,0,0|2,0,0]=4 8984 B16R2.2966 Cc1ccccc1NCc2c[nH]nc2C 270302a_100015192222_100000737037 [0,2,0,0,0,0|2,0,0]=4 8985 B16R2.2966 Cc1ccccc1NCc2ccsc2Br 207a_100015192222_100009816921 [0,2,0,0,0,0|2,0,0]=4 8986 B16R2.2966 Cc1ccccc1NCc2ccsc2Br 270302a_100015192222_100009816921 [0,2,0,0,0,0|2,0,0]=4 8987 B16R2.2966 Cc1ccccc1NCc2ccsc2Br 34a_100015192222_100009814289 [0,2,0,0,0,0|2,0,0]=4 8988 B16R2.2966 Cc1ccccc1NCc2ccsc2Cl 207a_100015192222_100000089901 [0,2,0,0,0,0|2,0,0]=4 8989 B16R2.2966 Cc1ccccc1NCc2ccsc2Cl 270302a_100015192222_100000089901 [0,2,0,0,0,0|2,0,0]=4 8990 B16R2.2966 Cc1ccccc1NCc2ccsc2Cl 34a_100015192222_100010167017 [0,2,0,0,0,0|2,0,0]=4 8991 B16R2.2966 Cc1ccccc1NCc2cncn2C 207a_100015192222_100000750899 [0,2,0,0,0,0|0,0,2]=4 8992 B16R2.2966 Cc1ccccc1NCc2cncn2C 270302a_100015192222_100000750899 [0,2,0,0,0,0|0,0,2]=4 8993 B16R2.2966 Cc1ccccc1NCc2cscc2Br 207a_100015192222_100000685484 [0,2,0,0,0,0|2,0,0]=4 8994 B16R2.2966 Cc1ccccc1NCc2cscc2Br 270302a_100015192222_100000685484 [0,2,0,0,0,0|2,0,0]=4 8995 B16R2.2966 Cc1ccccc1NCc2n[nH]cc2Cl 207a_100015192222_100000040271 [0,2,0,0,0,0|2,0,0]=4 8996 B16R2.2966 Cc1ccccc1NCc2nc[nH]c2C 207a_100015192222_100000032982 [0,2,0,0,0,0|0,0,0]=2 8997 B16R2.2966 Cc1ccccc1NCc2nccn2C 207a_100015192222_100000748660 [0,2,0,0,0,0|2,0,0]=4 8998 B16R2.2966 Cc1ccccc1NCc2nccn2C 34a_100015192222_100000700302 [0,2,0,0,0,0|2,0,0]=4 8999 B16R2.2966 Cc1ccccc1NCc2ncoc2C 34a_100015192222_200000693990 [0,2,0,0,0,0|1,0,0]=3 9000 B16R2.2966 Cc1ccccc1NCc2nonc2C 34a_100015192222_200000044682 [0,2,0,0,0,0|1,0,1]=4 9001 B16R2.2966 Cc1ccccc1NCc2occc2C 207a_100015192222_100000763527 [0,2,0,0,0,0|2,0,0]=4 9002 B16R2.2966 Cc1ccccc1NCc2occc2C 270302a_100015192222_100000763527 [0,2,0,0,0,0|2,0,0]=4 9003 B16R2.2966 Cc1ccccc1NCc2sccc2Br 207a_100015192222_100000766043 [0,2,0,0,0,0|2,0,0]=4 9004 B16R2.2966 Cc1ccccc1NCc2sccc2Br 270302a_100015192222_100000766043 [0,2,0,0,0,0|2,0,0]=4 9005 B16R2.2966 Cc1ccccc1NCc2sccc2C 207a_100015192222_100000210881 [0,2,0,0,0,0|2,0,0]=4 9006 B16R2.2966 Cc1ccccc1NCc2sccc2C 270302a_100015192222_100000210881 [0,2,0,0,0,0|2,0,0]=4 9007 B16R2.2966 Cc1ccccc1NCc2sccc2Cl 207a_100015192222_100000722334 [0,2,0,0,0,0|2,0,0]=4 9008 B16R2.2966 Cc1ccccc1NCc2sccc2Cl 270302a_100015192222_100000722334 [0,2,0,0,0,0|2,0,0]=4 9009 B16R2.2966 Cc1ccccc1NCc2scnc2C 207a_100015192222_100000764165 [0,2,0,0,0,0|1,0,1]=4 9010 B16R2.2966 Cc1ccccc1NCc2scnc2C 270302a_100015192222_100000764165 [0,2,0,0,0,0|1,0,1]=4 9011 B16R2.2966 Cc1ccccc1OCc2ncoc2C 34a_100000210338_200000693990 [0,2,0,0,0,0|2,0,0]=4 9012 B16R2.2966 Cc1ccccc1OCc2ncoc2C 7a_100000210338_200000693990 [0,2,0,0,0,0|2,0,0]=4 9013 B16R2.2966 Cc1ccccc1SCc2nc[nH]c2C 62a_100000210755_100000751220 [0,2,0,0,0,0|1,0,0]=3 9014 B16R2.2966 Cc1ccccc1SCc2nc[nH]c2C 62a_100000751220_100000210755 [0,2,0,0,0,0|1,0,0]=3 9015 B16R2.2966 Cc1ccccc1SCc2ncoc2C 62a_100000210755_200000693990 [0,2,0,0,0,0|2,0,0]=4 9016 B16R2.2966 Cc1ccccc1SCc2ncoc2C 62a_200000693990_100000210755 [0,2,0,0,0,0|2,0,0]=4 9017 B16R2.2966 Cc1cccnc1SCc2nc[nH]c2C 62a_100000751220_100000751373 [0,2,0,0,0,0|2,0,0]=4 9018 B16R2.2966 Cc1cccnc1SCc2nc[nH]c2C 62a_100000751373_100000751220 [0,2,0,0,0,0|2,0,0]=4 9019 B16R2.2966 Cc1ccncc1SCc2nc[nH]c2C 62a_100000751220_100000761580 [0,2,0,0,0,0|2,0,0]=4 9020 B16R2.2966 Cc1ccncc1SCc2nc[nH]c2C 62a_100000761580_100000751220 [0,2,0,0,0,0|2,0,0]=4 9021 B16R2.2966 Cc1ccoc1CNc2ccccc2Br 207a_100000210017_100000763527 [0,2,0,0,0,0|2,0,0]=4 9022 B16R2.2966 Cc1ccoc1CNc2ccccc2Cl 207a_100000185783_100000763527 [0,2,0,0,0,0|2,0,0]=4 9023 B16R2.2966 Cc1ccoc1CNc2ccccc2F 207a_100000210422_100000763527 [0,2,0,0,0,0|2,0,0]=4 9024 B16R2.2966 Cc1ccoc1CNc2ccccc2I 207a_100000210053_100000763527 [0,2,0,0,0,0|2,0,0]=4 9025 B16R2.2966 Cc1ccsc1CNc2ccccc2Br 207a_100000210017_100000210881 [0,2,0,0,0,0|2,0,0]=4 9026 B16R2.2966 Cc1ccsc1CNc2ccccc2Cl 207a_100000185783_100000210881 [0,2,0,0,0,0|2,0,0]=4 9027 B16R2.2966 Cc1ccsc1CNc2ccccc2F 207a_100000210422_100000210881 [0,2,0,0,0,0|2,0,0]=4 9028 B16R2.2966 Cc1ccsc1CNc2ccccc2I 207a_100000210053_100000210881 [0,2,0,0,0,0|2,0,0]=4 9029 B16R2.2966 Cc1cnccc1SCc2nc[nH]c2C 62a_100000751220_100000765111 [0,2,0,0,0,0|2,0,0]=4 9030 B16R2.2966 Cc1cnccc1SCc2nc[nH]c2C 62a_100000765111_100000751220 [0,2,0,0,0,0|2,0,0]=4 9031 B16R2.2966 Cc1n[nH]cc1CNc2ccccc2Br 207a_100000210017_100000737037 [0,2,0,0,0,0|2,0,0]=4 9032 B16R2.2966 Cc1n[nH]cc1CNc2ccccc2Cl 207a_100000185783_100000737037 [0,2,0,0,0,0|2,0,0]=4 9033 B16R2.2966 Cc1n[nH]cc1CNc2ccccc2F 207a_100000210422_100000737037 [0,2,0,0,0,0|2,0,0]=4 9034 B16R2.2966 Cc1n[nH]cc1CNc2ccccc2I 207a_100000210053_100000737037 [0,2,0,0,0,0|2,0,0]=4 9035 B16R2.2966 Cc1ncccc1SCc2nc[nH]c2C 62a_100000751220_100000751574 [0,2,0,0,0,0|2,0,0]=4 9036 B16R2.2966 Cc1ncccc1SCc2nc[nH]c2C 62a_100000751574_100000751220 [0,2,0,0,0,0|2,0,0]=4 9037 B16R2.2966 Cc1ncsc1CNc2ccccc2Br 207a_100000210017_100000764165 [0,2,0,0,0,0|1,0,1]=4 9038 B16R2.2966 Cc1ncsc1CNc2ccccc2Cl 207a_100000185783_100000764165 [0,2,0,0,0,0|1,0,1]=4 9039 B16R2.2966 Cc1ncsc1CNc2ccccc2F 207a_100000210422_100000764165 [0,2,0,0,0,0|1,0,1]=4 9040 B16R2.2966 Cc1ncsc1CNc2ccccc2I 207a_100000210053_100000764165 [0,2,0,0,0,0|1,0,1]=4 9041 B16R2.2966 Cc1nonc1CNc2ccccc2Br 34a_100000210017_200000044682 [0,2,0,0,0,0|1,0,1]=4 9042 B16R2.2966 Cc1nonc1CNc2ccccc2Cl 34a_100000185783_200000044682 [0,2,0,0,0,0|1,0,1]=4 9043 B16R2.2966 Cc1nonc1CNc2ccccc2F 34a_100000210422_200000044682 [0,2,0,0,0,0|1,0,1]=4 9044 B16R2.2966 Cc1nonc1CNc2ccccc2I 34a_100000210053_200000044682 [0,2,0,0,0,0|1,0,1]=4 9045 B16R2.2966 Cc1nonc1CNc2ccccc2O 34a_100000185747_200000044682 [0,2,0,0,0,0|1,0,1]=4 9046 B16R2.2966 Cc1ocnc1CNc2ccccc2Br 34a_100000210017_200000693990 [0,2,0,0,0,0|1,0,0]=3 9047 B16R2.2966 Cc1ocnc1CNc2ccccc2Cl 34a_100000185783_200000693990 [0,2,0,0,0,0|1,0,0]=3 9048 B16R2.2966 Cc1ocnc1CNc2ccccc2F 34a_100000210422_200000693990 [0,2,0,0,0,0|1,0,0]=3 9049 B16R2.2966 Cc1ocnc1CNc2ccccc2I 34a_100000210053_200000693990 [0,2,0,0,0,0|1,0,0]=3 9050 B16R2.2966 Cc1ocnc1CNc2ccccc2O 34a_100000185747_200000693990 [0,2,0,0,0,0|1,0,0]=3 9051 B16R2.2966 Cc1ocnc1COc2ccccc2Br 34a_100000181306_200000693990 [0,2,0,0,0,0|2,0,0]=4 9052 B16R2.2966 Cc1ocnc1COc2ccccc2Br 7a_100000181306_200000693990 [0,2,0,0,0,0|2,0,0]=4 9053 B16R2.2966 Cc1ocnc1COc2ccccc2Cl 34a_100000210172_200000693990 [0,2,0,0,0,0|2,0,0]=4 9054 B16R2.2966 Cc1ocnc1COc2ccccc2Cl 7a_100000210172_200000693990 [0,2,0,0,0,0|2,0,0]=4 9055 B16R2.2966 Cc1ocnc1COc2ccccc2F 34a_100000210171_200000693990 [0,2,0,0,0,0|2,0,0]=4 9056 B16R2.2966 Cc1ocnc1COc2ccccc2F 7a_100000210171_200000693990 [0,2,0,0,0,0|2,0,0]=4 9057 B16R2.2966 Cc1ocnc1COc2ccccc2I 34a_100000739446_200000693990 [0,2,0,0,0,0|2,0,0]=4 9058 B16R2.2966 Cc1ocnc1COc2ccccc2I 7a_100000739446_200000693990 [0,2,0,0,0,0|2,0,0]=4 9059 B16R2.2966 Cc1ocnc1COc2ccccc2N 34a_100000185747_200000693990 [0,2,0,0,0,0|2,0,0]=4 9060 B16R2.2966 Cc1ocnc1COc2ccccc2N 7a_100000185747_200000693990 [0,2,0,0,0,0|2,0,0]=4 9061 B16R2.2966 Cc1ocnc1CSc2ccccc2Br 62a_100000695589_200000693990 [0,2,0,0,0,0|2,0,0]=4 9062 B16R2.2966 Cc1ocnc1CSc2ccccc2Br 62a_200000693990_100000695589 [0,2,0,0,0,0|2,0,0]=4 9063 B16R2.2966 Cc1ocnc1CSc2ccccc2Cl 62a_100000764095_200000693990 [0,2,0,0,0,0|2,0,0]=4 9064 B16R2.2966 Cc1ocnc1CSc2ccccc2Cl 62a_200000693990_100000764095 [0,2,0,0,0,0|2,0,0]=4 9065 B16R2.2966 Cc1ocnc1CSc2ccccc2F 62a_100011215700_200000693990 [0,2,0,0,0,0|2,0,0]=4 9066 B16R2.2966 Cc1ocnc1CSc2ccccc2F 62a_200000693990_100011215700 [0,2,0,0,0,0|2,0,0]=4 9067 B16R2.2966 Cc1ocnc1CSc2ccccc2N 62a_100000210017_200000693990 [0,2,0,0,0,0|2,0,0]=4 9068 B16R2.2966 Cc1ocnc1CSc2ccccc2N 62a_200000693990_100000210017 [0,2,0,0,0,0|2,0,0]=4 9069 B16R2.2966 Cc1ocnc1CSc2ccccc2O 62a_100000739446_200000693990 [0,2,0,0,0,0|2,0,0]=4 9070 B16R2.2966 Cc1ocnc1CSc2ccccc2O 62a_200000693990_100000739446 [0,2,0,0,0,0|2,0,0]=4 9071 B16R2.2966 Clc1c[nH]nc1CNc2ccccc2Br 207a_100000210017_100000040271 [0,2,0,0,0,0|2,0,0]=4 9072 B16R2.2966 Clc1c[nH]nc1CNc2ccccc2I 207a_100000210053_100000040271 [0,2,0,0,0,0|2,0,0]=4 9073 B16R2.2966 Clc1ccccc1NCc2ccsc2Br 207a_100000185783_100009816921 [0,2,0,0,0,0|2,0,0]=4 9074 B16R2.2966 Clc1ccccc1NCc2ccsc2Br 34a_100000185783_100009814289 [0,2,0,0,0,0|2,0,0]=4 9075 B16R2.2966 Clc1ccccc1NCc2ccsc2Cl 207a_100000185783_100000089901 [0,2,0,0,0,0|2,0,0]=4 9076 B16R2.2966 Clc1ccccc1NCc2ccsc2Cl 34a_100000185783_100010167017 [0,2,0,0,0,0|2,0,0]=4 9077 B16R2.2966 Clc1ccccc1NCc2cscc2Br 207a_100000185783_100000685484 [0,2,0,0,0,0|2,0,0]=4 9078 B16R2.2966 Clc1ccccc1NCc2n[nH]cc2Cl 207a_100000185783_100000040271 [0,2,0,0,0,0|2,0,0]=4 9079 B16R2.2966 Clc1ccccc1NCc2sccc2Br 207a_100000185783_100000766043 [0,2,0,0,0,0|2,0,0]=4 9080 B16R2.2966 Clc1ccccc1NCc2sccc2Cl 207a_100000185783_100000722334 [0,2,0,0,0,0|2,0,0]=4 9081 B16R2.2966 Clc1ccsc1CNc2ccccc2Br 207a_100000210017_100000722334 [0,2,0,0,0,0|2,0,0]=4 9082 B16R2.2966 Clc1ccsc1CNc2ccccc2I 207a_100000210053_100000722334 [0,2,0,0,0,0|2,0,0]=4 9083 B16R2.2966 Clc1sccc1CNc2ccccc2Br 207a_100000210017_100000089901 [0,2,0,0,0,0|2,0,0]=4 9084 B16R2.2966 Clc1sccc1CNc2ccccc2Br 34a_100000210017_100010167017 [0,2,0,0,0,0|2,0,0]=4 9085 B16R2.2966 Clc1sccc1CNc2ccccc2I 207a_100000210053_100000089901 [0,2,0,0,0,0|2,0,0]=4 9086 B16R2.2966 Clc1sccc1CNc2ccccc2I 34a_100000210053_100010167017 [0,2,0,0,0,0|2,0,0]=4 9087 B16R2.2966 Cn1ccnc1CNc2ccccc2Br 207a_100000210017_100000748660 [0,2,0,0,0,0|2,0,0]=4 9088 B16R2.2966 Cn1ccnc1CNc2ccccc2Br 34a_100000210017_100000700302 [0,2,0,0,0,0|2,0,0]=4 9089 B16R2.2966 Cn1ccnc1CNc2ccccc2Cl 207a_100000185783_100000748660 [0,2,0,0,0,0|2,0,0]=4 9090 B16R2.2966 Cn1ccnc1CNc2ccccc2Cl 34a_100000185783_100000700302 [0,2,0,0,0,0|2,0,0]=4 9091 B16R2.2966 Cn1ccnc1CNc2ccccc2F 207a_100000210422_100000748660 [0,2,0,0,0,0|2,0,0]=4 9092 B16R2.2966 Cn1ccnc1CNc2ccccc2F 34a_100000210422_100000700302 [0,2,0,0,0,0|2,0,0]=4 9093 B16R2.2966 Cn1ccnc1CNc2ccccc2I 207a_100000210053_100000748660 [0,2,0,0,0,0|2,0,0]=4 9094 B16R2.2966 Cn1ccnc1CNc2ccccc2I 34a_100000210053_100000700302 [0,2,0,0,0,0|2,0,0]=4 9095 B16R2.2966 Cn1ccnc1CNc2ccccc2O 34a_100000185747_100000700302 [0,2,0,0,0,0|2,0,0]=4 9096 B16R2.2966 Cn1cncc1CNc2ccccc2Br 207a_100000210017_100000750899 [0,2,0,0,0,0|0,0,2]=4 9097 B16R2.2966 Cn1cncc1CNc2ccccc2Cl 207a_100000185783_100000750899 [0,2,0,0,0,0|0,0,2]=4 9098 B16R2.2966 Cn1cncc1CNc2ccccc2F 207a_100000210422_100000750899 [0,2,0,0,0,0|0,0,2]=4 9099 B16R2.2966 Cn1cncc1CNc2ccccc2I 207a_100000210053_100000750899 [0,2,0,0,0,0|0,0,2]=4 9100 B16R2.2966 Fc1ccccc1NCc2ccsc2Br 207a_100000210422_100009816921 [0,2,0,0,0,0|2,0,0]=4 9101 B16R2.2966 Fc1ccccc1NCc2ccsc2Br 34a_100000210422_100009814289 [0,2,0,0,0,0|2,0,0]=4 9102 B16R2.2966 Fc1ccccc1NCc2ccsc2Cl 207a_100000210422_100000089901 [0,2,0,0,0,0|2,0,0]=4 9103 B16R2.2966 Fc1ccccc1NCc2ccsc2Cl 34a_100000210422_100010167017 [0,2,0,0,0,0|2,0,0]=4 9104 B16R2.2966 Fc1ccccc1NCc2cscc2Br 207a_100000210422_100000685484 [0,2,0,0,0,0|2,0,0]=4 9105 B16R2.2966 Fc1ccccc1NCc2n[nH]cc2Cl 207a_100000210422_100000040271 [0,2,0,0,0,0|2,0,0]=4 9106 B16R2.2966 Fc1ccccc1NCc2sccc2Br 207a_100000210422_100000766043 [0,2,0,0,0,0|2,0,0]=4 9107 B16R2.2966 Fc1ccccc1NCc2sccc2Cl 207a_100000210422_100000722334 [0,2,0,0,0,0|2,0,0]=4 9108 B16R2.2966 Oc1ccccc1NCc2ccsc2Br 34a_100000185747_100009814289 [0,2,0,0,0,0|2,0,0]=4 9109 B16R2.2966 Oc1ccccc1NCc2ccsc2Cl 34a_100000185747_100010167017 [0,2,0,0,0,0|2,0,0]=4 9110 B16R2.3014 CN(Cc1ccsc1Br)c2ccccc2 2230a_100000210012_100009814289 [0,2,0,0,0,0|2,0,0]=4 9111 B16R2.3014 CN(Cc1ccsc1Br)c2ccccc2 269982a_100000210012_100009814289 [0,2,0,0,0,0|2,0,0]=4 9112 B16R2.3014 CN(Cc1ccsc1Br)c2ccccc2 34a_100000210012_100009814289 [0,2,0,0,0,0|2,0,0]=4 9113 B16R2.3014 CN(Cc1ccsc1Cl)c2ccccc2 2230a_100000210012_100010167017 [0,2,0,0,0,0|2,0,0]=4 9114 B16R2.3014 CN(Cc1ccsc1Cl)c2ccccc2 269982a_100000210012_100010167017 [0,2,0,0,0,0|2,0,0]=4 9115 B16R2.3014 CN(Cc1ccsc1Cl)c2ccccc2 34a_100000210012_100010167017 [0,2,0,0,0,0|2,0,0]=4 9116 B16R2.3014 CN(Cc1nccn1C)c2ccccc2 2230a_100000210012_100000700302 [0,2,0,0,0,0|2,0,0]=4 9117 B16R2.3014 CN(Cc1nccn1C)c2ccccc2 269982a_100000210012_100000700302 [0,2,0,0,0,0|2,0,0]=4 9118 B16R2.3014 CN(Cc1nccn1C)c2ccccc2 34a_100000210012_100000700302 [0,2,0,0,0,0|2,0,0]=4 9119 B16R2.3014 CN(Cc1nnsc1Cl)c2ccccc2 2230a_100000210012_100000018852 [0,2,0,0,0,0|2,0,0]=4 9120 B16R2.3014 CN(Cc1nnsc1Cl)c2ccccc2 269982a_100000210012_100000018852 [0,2,0,0,0,0|2,0,0]=4 9121 B16R2.3014 Cc1[nH]cnc1CC(=O)c2ccccc2 1458a_100000185807_100000751220 [0,2,0,0,0,0|1,0,0]=3 9122 B16R2.3014 Cc1[nH]cnc1CC(C)c2ccccc2 271570a_100000062452_100009816806 [0,2,0,0,0,0|1,0,0]=3 9123 B16R2.3014 Cc1[nH]cnc1CN(C)c2ccccc2 2230a_100000210012_100000751220 [0,2,0,0,0,0|0,0,0]=2 9124 B16R2.3014 Cc1[nH]cnc1CN(C)c2ccccc2 269982a_100000210012_100000751220 [0,2,0,0,0,0|0,0,0]=2 9125 B16R2.3014 Cc1[nH]cnc1SC(C)c2ccccc2 62a_100000230085_100010186451 [0,2,0,0,0,0|2,0,0]=4 9126 B16R2.3014 Cc1[nH]cnc1SC(C)c2ccccc2 62a_100010186451_100000230085 [0,2,0,0,0,0|2,0,0]=4 9127 B16R2.3014 Cc1nonc1CN(C)c2ccccc2 2230a_100000210012_200000044682 [0,2,0,0,0,0|1,0,1]=4 9128 B16R2.3014 Cc1nonc1CN(C)c2ccccc2 269982a_100000210012_200000044682 [0,2,0,0,0,0|1,0,1]=4 9129 B16R2.3014 Cc1nonc1CN(C)c2ccccc2 34a_100000210012_200000044682 [0,2,0,0,0,0|1,0,1]=4 9130 B16R2.3014 Cc1ocnc1CC(=O)c2ccccc2 1458a_100000185807_200000693990 [0,2,0,0,0,0|2,0,0]=4 9131 B16R2.3014 Cc1ocnc1CN(C)c2ccccc2 2230a_100000210012_200000693990 [0,2,0,0,0,0|1,0,0]=3 9132 B16R2.3014 Cc1ocnc1CN(C)c2ccccc2 34a_100000210012_200000693990 [0,2,0,0,0,0|1,0,0]=3 9133 B16R2.3014 Cc1scnc1CC(C)c2ccccc2 271570a_100000062452_100000732656 [0,2,0,0,0,0|2,0,0]=4 9134 B16R2.5952 Brc1csc(c1Br)CNc2ccccc2 207a_100000106764_100012354027 [0,2,0,0,0,0|2,0,0]=4 9135 B16R2.5952 Brc1csc(c1Br)CNc2ccccc2 270302a_100000106764_100012354027 [0,2,0,0,0,0|2,0,0]=4 9136 B16R2.5952 Cc1c(cnn1C)CNc2ccccc2 207a_100000106764_100000763707 [0,2,0,0,0,0|2,0,0]=4 9137 B16R2.5952 Cc1c(cnn1C)CNc2ccccc2 270302a_100000106764_100000763707 [0,2,0,0,0,0|2,0,0]=4 9138 B16R2.5952 Cc1ncc(n1C)CNc2ccccc2 207a_100000106764_100011361570 [0,2,0,0,0,0|0,0,2]=4 9139 B16R2.5952 Cc1ncc(n1C)CNc2ccccc2 270302a_100000106764_100011361570 [0,2,0,0,0,0|0,0,2]=4 9140 B16R2.5952 Cn1c(cnc1CNc2ccccc2)Br 207a_100000106764_200009816901 [0,2,0,0,0,0|2,0,0]=4 9141 B16R2.5952 Cn1c(cnc1CNc2ccccc2)Br 270302a_100000106764_200009816901 [0,2,0,0,0,0|2,0,0]=4 9142 B16R2.5952 Cn1ncc(c1Cl)CNc2ccccc2 207a_100000106764_100000757982 [0,2,0,0,0,0|2,0,0]=4 9143 B16R2.5952 Cn1ncc(c1Cl)CNc2ccccc2 270302a_100000106764_100000757982 [0,2,0,0,0,0|2,0,0]=4 9144 B16R2.2843 CC(Nc1ccccc1)c2noc(n2)O 270196a_100000762819_100015183105 [0,2,0,0,0,0|2,0,0]=4 9145 B16R2.2843 Cc1nc(no1)C(C)Nc2ccccc2 270196a_100000762819_100000070787 [0,2,0,0,0,0|2,0,0]=4 9146 B16R2.2843 Cn1cc(nn1)C(O)Cc2ccccc2 274090a_200000210301_100000685211 [0,2,0,0,0,0|2,0,0]=4 9147 B16R2.2843 [13CH3]n1cc(nn1)C(O)Cc2ccccc2 274090a_200025704644_100000685211 [0,2,0,0,0,0|2,0,0]=4 9148 B16R2.12242 O=S(=O)(Nc1ccccc1)c2c[nH]cn2 20a_100000106764_100000754927 [0,2,0,0,0,0|1,0,0]=3 9149 B16R2.12242 O=S(=O)(Nc1ccccc1)c2c[nH]cn2 232682a_100000106764_100000754927 [0,2,0,0,0,0|1,0,0]=3 9150 B16R2.42 C#Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000140223 [0,2,0,0,0,0|2,0,0]=4 9151 B16R2.42 C#Cc1ccc(cc1)NCc2c[nH]cn2 34a_100011215031_100000707719 [0,2,0,0,0,0|0,0,0]=2 9152 B16R2.42 C#Cc1ccc(cc1)NCc2ccon2 34a_100011215031_100000234950 [0,2,0,0,0,0|2,0,0]=4 9153 B16R2.42 C#Cc1ccc(cc1)NCc2ccsc2 34a_100011215031_100011261437 [0,2,0,0,0,0|2,0,0]=4 9154 B16R2.42 C#Cc1ccc(cc1)NCc2cncs2 34a_100011215031_100015185245 [0,2,0,0,0,0|1,0,1]=4 9155 B16R2.42 C#Cc1ccc(cc1)NCc2cscn2 34a_100011215031_100000205941 [0,2,0,0,0,0|1,0,0]=3 9156 B16R2.42 C#Cc1ccc(cc1)NCc2ncc[nH]2 34a_100011215031_100016991755 [0,2,0,0,0,0|2,0,0]=4 9157 B16R2.42 C#Cc1ccc(cc1)NCc2ncco2 34a_100011215031_103436540062 [0,2,0,0,0,0|2,0,0]=4 9158 B16R2.42 C#Cc1ccc(cc1)NCc2nccs2 34a_100011215031_100015184050 [0,2,0,0,0,0|2,0,0]=4 9159 B16R2.42 C#Cc1ccc(cc1)NCc2ncon2 34a_100011215031_100000233494 [0,2,0,0,0,0|2,0,0]=4 9160 B16R2.42 C#Cc1ccc(cc1)NCn2cncn2 34a_100011215031_200020645497 [0,2,0,0,0,0|1,0,1]=4 9161 B16R2.42 C#Cc1ccc(nc1)OCc2c[nH]cn2 34a_200009884252_100000707719 [0,2,0,0,0,0|2,0,0]=4 9162 B16R2.42 C=Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000034074_100000756875 [0,2,0,0,0,0|2,0,0]=4 9163 B16R2.42 C=Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000034074 [0,2,0,0,0,0|2,0,0]=4 9164 B16R2.42 C=Cc1ccc(cc1)NCc2c[nH]cn2 34a_100011218248_100000707719 [0,2,0,0,0,0|0,0,0]=2 9165 B16R2.42 C=Cc1ccc(cc1)NCc2cc[nH]n2 207a_100011218248_100000738523 [0,2,0,0,0,0|2,0,0]=4 9166 B16R2.42 C=Cc1ccc(cc1)NCc2ccco2 207a_100011218248_100000186105 [0,2,0,0,0,0|2,0,0]=4 9167 B16R2.42 C=Cc1ccc(cc1)NCc2ccco2 270302a_100011218248_100000186105 [0,2,0,0,0,0|2,0,0]=4 9168 B16R2.42 C=Cc1ccc(cc1)NCc2cccs2 207a_100011218248_100000209959 [0,2,0,0,0,0|2,0,0]=4 9169 B16R2.42 C=Cc1ccc(cc1)NCc2cccs2 270302a_100011218248_100000209959 [0,2,0,0,0,0|2,0,0]=4 9170 B16R2.42 C=Cc1ccc(cc1)NCc2cccs2 271570a_100011290941_100000188760 [0,2,0,0,0,0|2,0,0]=4 9171 B16R2.42 C=Cc1ccc(cc1)NCc2ccoc2 207a_100011218248_100011215517 [0,2,0,0,0,0|2,0,0]=4 9172 B16R2.42 C=Cc1ccc(cc1)NCc2ccon2 34a_100011218248_100000234950 [0,2,0,0,0,0|2,0,0]=4 9173 B16R2.42 C=Cc1ccc(cc1)NCc2ccsc2 207a_100011218248_100000188534 [0,2,0,0,0,0|2,0,0]=4 9174 B16R2.42 C=Cc1ccc(cc1)NCc2ccsc2 270302a_100011218248_100000188534 [0,2,0,0,0,0|2,0,0]=4 9175 B16R2.42 C=Cc1ccc(cc1)NCc2ccsc2 34a_100011218248_100011261437 [0,2,0,0,0,0|2,0,0]=4 9176 B16R2.42 C=Cc1ccc(cc1)NCc2cn[nH]c2 207a_100011218248_100016992096 [0,2,0,0,0,0|2,0,0]=4 9177 B16R2.42 C=Cc1ccc(cc1)NCc2cn[nH]c2 270302a_100011218248_100016992096 [0,2,0,0,0,0|2,0,0]=4 9178 B16R2.42 C=Cc1ccc(cc1)NCc2cnc[nH]2 207a_100011218248_100000742939 [0,2,0,0,0,0|0,0,2]=4 9179 B16R2.42 C=Cc1ccc(cc1)NCc2cncs2 207a_100011218248_100000749870 [0,2,0,0,0,0|1,0,1]=4 9180 B16R2.42 C=Cc1ccc(cc1)NCc2cncs2 270302a_100011218248_100000749870 [0,2,0,0,0,0|1,0,1]=4 9181 B16R2.42 C=Cc1ccc(cc1)NCc2cncs2 34a_100011218248_100015185245 [0,2,0,0,0,0|1,0,1]=4 9182 B16R2.42 C=Cc1ccc(cc1)NCc2cscn2 207a_100011218248_100000743575 [0,2,0,0,0,0|1,0,0]=3 9183 B16R2.42 C=Cc1ccc(cc1)NCc2cscn2 270302a_100011218248_100000743575 [0,2,0,0,0,0|1,0,0]=3 9184 B16R2.42 C=Cc1ccc(cc1)NCc2cscn2 34a_100011218248_100000205941 [0,2,0,0,0,0|1,0,0]=3 9185 B16R2.42 C=Cc1ccc(cc1)NCc2ncc[nH]2 207a_100011218248_100000743867 [0,2,0,0,0,0|2,0,0]=4 9186 B16R2.42 C=Cc1ccc(cc1)NCc2ncc[nH]2 34a_100011218248_100016991755 [0,2,0,0,0,0|2,0,0]=4 9187 B16R2.42 C=Cc1ccc(cc1)NCc2ncco2 34a_100011218248_103436540062 [0,2,0,0,0,0|2,0,0]=4 9188 B16R2.42 C=Cc1ccc(cc1)NCc2nccs2 207a_100011218248_100000750902 [0,2,0,0,0,0|2,0,0]=4 9189 B16R2.42 C=Cc1ccc(cc1)NCc2nccs2 270302a_100011218248_100000750902 [0,2,0,0,0,0|2,0,0]=4 9190 B16R2.42 C=Cc1ccc(cc1)NCc2nccs2 34a_100011218248_100015184050 [0,2,0,0,0,0|2,0,0]=4 9191 B16R2.42 C=Cc1ccc(cc1)NCc2ncon2 34a_100011218248_100000233494 [0,2,0,0,0,0|2,0,0]=4 9192 B16R2.42 C=Cc1ccc(cc1)NCn2cncn2 34a_100011218248_200020645497 [0,2,0,0,0,0|1,0,1]=4 9193 B16R2.42 C=Cc1ccc(cc1)OCc2c[nH]cn2 34a_100000189437_100000707719 [0,2,0,0,0,0|1,0,0]=3 9194 B16R2.42 C=Cc1ccc(cc1)OCc2cscn2 34a_100000189437_100000205941 [0,2,0,0,0,0|2,0,0]=4 9195 B16R2.42 C=Cc1ccc(cc1)OCc2cscn2 7a_100000189437_100000205941 [0,2,0,0,0,0|2,0,0]=4 9196 B16R2.42 C=Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000748128 [0,2,0,0,0,0|1,0,0]=3 9197 B16R2.42 C=Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000748128_100000707719 [0,2,0,0,0,0|1,0,0]=3 9198 B16R2.42 C=Cc1ccc(cc1)SCc2cscn2 62a_100000205941_100000748128 [0,2,0,0,0,0|2,0,0]=4 9199 B16R2.42 C=Cc1ccc(cc1)SCc2cscn2 62a_100000748128_100000205941 [0,2,0,0,0,0|2,0,0]=4 9200 B16R2.42 C=Cc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_103436540071 [0,2,0,0,0,0|2,0,0]=4 9201 B16R2.42 C=Cc1ccc(nc1)SCc2c[nH]cn2 62a_103436540071_100000707719 [0,2,0,0,0,0|2,0,0]=4 9202 B16R2.42 C=Cc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_200000143982 [0,2,0,0,0,0|2,0,0]=4 9203 B16R2.42 CCc1ccc(cc1)C=Cc2c[nH]cn2 271570a_200000062238_100000756875 [0,2,0,0,0,0|1,0,1]=4 9204 B16R2.42 CCc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000747183 [0,2,0,0,0,0|2,0,0]=4 9205 B16R2.42 CCc1ccc(cc1)CSc2c[nH]cn2 62a_100000757233_100000756875 [0,2,0,0,0,0|2,0,0]=4 9206 B16R2.42 CCc1ccc(cc1)NCc2c[nH]cn2 2230a_100000211069_100000707719 [0,2,0,0,0,0|0,0,0]=2 9207 B16R2.42 CCc1ccc(cc1)NCc2c[nH]cn2 34a_100000211069_100000707719 [0,2,0,0,0,0|0,0,0]=2 9208 B16R2.42 CCc1ccc(cc1)NCc2cc[nH]n2 207a_100000211069_100000738523 [0,2,0,0,0,0|2,0,0]=4 9209 B16R2.42 CCc1ccc(cc1)NCc2ccco2 207a_100000211069_100000186105 [0,2,0,0,0,0|2,0,0]=4 9210 B16R2.42 CCc1ccc(cc1)NCc2ccco2 270302a_100000211069_100000186105 [0,2,0,0,0,0|2,0,0]=4 9211 B16R2.42 CCc1ccc(cc1)NCc2cccs2 207a_100000211069_100000209959 [0,2,0,0,0,0|2,0,0]=4 9212 B16R2.42 CCc1ccc(cc1)NCc2cccs2 270302a_100000211069_100000209959 [0,2,0,0,0,0|2,0,0]=4 9213 B16R2.42 CCc1ccc(cc1)NCc2ccoc2 207a_100000211069_100011215517 [0,2,0,0,0,0|2,0,0]=4 9214 B16R2.42 CCc1ccc(cc1)NCc2ccon2 2230a_100000211069_100000234950 [0,2,0,0,0,0|2,0,0]=4 9215 B16R2.42 CCc1ccc(cc1)NCc2ccon2 34a_100000211069_100000234950 [0,2,0,0,0,0|2,0,0]=4 9216 B16R2.42 CCc1ccc(cc1)NCc2ccsc2 207a_100000211069_100000188534 [0,2,0,0,0,0|2,0,0]=4 9217 B16R2.42 CCc1ccc(cc1)NCc2ccsc2 2230a_100000211069_100011261437 [0,2,0,0,0,0|2,0,0]=4 9218 B16R2.42 CCc1ccc(cc1)NCc2ccsc2 270302a_100000211069_100000188534 [0,2,0,0,0,0|2,0,0]=4 9219 B16R2.42 CCc1ccc(cc1)NCc2ccsc2 34a_100000211069_100011261437 [0,2,0,0,0,0|2,0,0]=4 9220 B16R2.42 CCc1ccc(cc1)NCc2cn[nH]c2 207a_100000211069_100016992096 [0,2,0,0,0,0|2,0,0]=4 9221 B16R2.42 CCc1ccc(cc1)NCc2cn[nH]c2 270302a_100000211069_100016992096 [0,2,0,0,0,0|2,0,0]=4 9222 B16R2.42 CCc1ccc(cc1)NCc2cnc[nH]2 207a_100000211069_100000742939 [0,2,0,0,0,0|0,0,2]=4 9223 B16R2.42 CCc1ccc(cc1)NCc2cncs2 207a_100000211069_100000749870 [0,2,0,0,0,0|1,0,1]=4 9224 B16R2.42 CCc1ccc(cc1)NCc2cncs2 2230a_100000211069_100015185245 [0,2,0,0,0,0|1,0,1]=4 9225 B16R2.42 CCc1ccc(cc1)NCc2cncs2 270302a_100000211069_100000749870 [0,2,0,0,0,0|1,0,1]=4 9226 B16R2.42 CCc1ccc(cc1)NCc2cncs2 34a_100000211069_100015185245 [0,2,0,0,0,0|1,0,1]=4 9227 B16R2.42 CCc1ccc(cc1)NCc2cscn2 207a_100000211069_100000743575 [0,2,0,0,0,0|1,0,0]=3 9228 B16R2.42 CCc1ccc(cc1)NCc2cscn2 2230a_100000211069_100000205941 [0,2,0,0,0,0|1,0,0]=3 9229 B16R2.42 CCc1ccc(cc1)NCc2cscn2 270302a_100000211069_100000743575 [0,2,0,0,0,0|1,0,0]=3 9230 B16R2.42 CCc1ccc(cc1)NCc2cscn2 34a_100000211069_100000205941 [0,2,0,0,0,0|1,0,0]=3 9231 B16R2.42 CCc1ccc(cc1)NCc2ncc[nH]2 207a_100000211069_100000743867 [0,2,0,0,0,0|2,0,0]=4 9232 B16R2.42 CCc1ccc(cc1)NCc2ncc[nH]2 2230a_100000211069_100016991755 [0,2,0,0,0,0|2,0,0]=4 9233 B16R2.42 CCc1ccc(cc1)NCc2ncc[nH]2 34a_100000211069_100016991755 [0,2,0,0,0,0|2,0,0]=4 9234 B16R2.42 CCc1ccc(cc1)NCc2ncco2 2230a_100000211069_103436540062 [0,2,0,0,0,0|2,0,0]=4 9235 B16R2.42 CCc1ccc(cc1)NCc2ncco2 34a_100000211069_103436540062 [0,2,0,0,0,0|2,0,0]=4 9236 B16R2.42 CCc1ccc(cc1)NCc2nccs2 207a_100000211069_100000750902 [0,2,0,0,0,0|2,0,0]=4 9237 B16R2.42 CCc1ccc(cc1)NCc2nccs2 2230a_100000211069_100015184050 [0,2,0,0,0,0|2,0,0]=4 9238 B16R2.42 CCc1ccc(cc1)NCc2nccs2 270302a_100000211069_100000750902 [0,2,0,0,0,0|2,0,0]=4 9239 B16R2.42 CCc1ccc(cc1)NCc2nccs2 34a_100000211069_100015184050 [0,2,0,0,0,0|2,0,0]=4 9240 B16R2.42 CCc1ccc(cc1)NCc2ncon2 34a_100000211069_100000233494 [0,2,0,0,0,0|2,0,0]=4 9241 B16R2.42 CCc1ccc(cc1)NCn2cncn2 2230a_100000211069_200020645497 [0,2,0,0,0,0|1,0,1]=4 9242 B16R2.42 CCc1ccc(cc1)NCn2cncn2 34a_100000211069_200020645497 [0,2,0,0,0,0|1,0,1]=4 9243 B16R2.42 CCc1ccc(cc1)OCc2c[nH]cn2 34a_100000211359_100000707719 [0,2,0,0,0,0|1,0,0]=3 9244 B16R2.42 CCc1ccc(cc1)OCc2cscn2 34a_100000211359_100000205941 [0,2,0,0,0,0|2,0,0]=4 9245 B16R2.42 CCc1ccc(cc1)OCc2cscn2 7a_100000211359_100000205941 [0,2,0,0,0,0|2,0,0]=4 9246 B16R2.42 CCc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100011215824 [0,2,0,0,0,0|1,0,0]=3 9247 B16R2.42 CCc1ccc(cc1)SCc2c[nH]cn2 62a_100011215824_100000707719 [0,2,0,0,0,0|1,0,0]=3 9248 B16R2.42 CCc1ccc(cc1)SCc2cscn2 62a_100000205941_100011215824 [0,2,0,0,0,0|2,0,0]=4 9249 B16R2.42 CCc1ccc(cc1)SCc2cscn2 62a_100011215824_100000205941 [0,2,0,0,0,0|2,0,0]=4 9250 B16R2.42 CCc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100009820025 [0,2,0,0,0,0|2,0,0]=4 9251 B16R2.42 CCc1ccc(cn1)SCc2c[nH]cn2 62a_100009820025_100000707719 [0,2,0,0,0,0|2,0,0]=4 9252 B16R2.42 CCc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100009843584 [0,2,0,0,0,0|2,0,0]=4 9253 B16R2.42 CCc1ccc(nc1)SCc2c[nH]cn2 62a_100009843584_100000707719 [0,2,0,0,0,0|2,0,0]=4 9254 B16R2.42 CCc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000033099 [0,2,0,0,0,0|2,0,0]=4 9255 B16R2.42 CNc1ccc(cc1)OCc2c[nH]cn2 34a_100000182112_100000707719 [0,2,0,0,0,0|1,0,0]=3 9256 B16R2.42 CNc1ccc(cc1)OCc2cscn2 34a_100000182112_100000205941 [0,2,0,0,0,0|2,0,0]=4 9257 B16R2.42 CNc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000743151 [0,2,0,0,0,0|1,0,0]=3 9258 B16R2.42 CNc1ccc(cc1)SCc2c[nH]cn2 62a_100000743151_100000707719 [0,2,0,0,0,0|1,0,0]=3 9259 B16R2.42 CNc1ccc(cc1)SCc2cscn2 62a_100000205941_100000743151 [0,2,0,0,0,0|2,0,0]=4 9260 B16R2.42 CNc1ccc(cc1)SCc2cscn2 62a_100000743151_100000205941 [0,2,0,0,0,0|2,0,0]=4 9261 B16R2.42 CNc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000741341 [0,2,0,0,0,0|2,0,0]=4 9262 B16R2.42 CNc1ccc(cn1)SCc2c[nH]cn2 62a_100000741341_100000707719 [0,2,0,0,0,0|2,0,0]=4 9263 B16R2.42 CNc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000764248 [0,2,0,0,0,0|2,0,0]=4 9264 B16R2.42 CNc1ccc(nc1)SCc2c[nH]cn2 62a_100000764248_100000707719 [0,2,0,0,0,0|2,0,0]=4 9265 B16R2.42 COc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100000062342_100000756875 [0,2,0,0,0,0|1,0,1]=4 9266 B16R2.42 COc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000742318 [0,2,0,0,0,0|2,0,0]=4 9267 B16R2.42 COc1ccc(cc1)NCc2c[nH]cn2 34a_100000184247_100000707719 [0,2,0,0,0,0|0,0,0]=2 9268 B16R2.42 COc1ccc(cc1)NCc2cc[nH]n2 207a_100000184247_100000738523 [0,2,0,0,0,0|2,0,0]=4 9269 B16R2.42 COc1ccc(cc1)NCc2ccco2 207a_100000184247_100000186105 [0,2,0,0,0,0|2,0,0]=4 9270 B16R2.42 COc1ccc(cc1)NCc2ccco2 270302a_100000184247_100000186105 [0,2,0,0,0,0|2,0,0]=4 9271 B16R2.42 COc1ccc(cc1)NCc2cccs2 207a_100000184247_100000209959 [0,2,0,0,0,0|2,0,0]=4 9272 B16R2.42 COc1ccc(cc1)NCc2cccs2 270302a_100000184247_100000209959 [0,2,0,0,0,0|2,0,0]=4 9273 B16R2.42 COc1ccc(cc1)NCc2ccoc2 207a_100000184247_100011215517 [0,2,0,0,0,0|2,0,0]=4 9274 B16R2.42 COc1ccc(cc1)NCc2ccon2 34a_100000184247_100000234950 [0,2,0,0,0,0|2,0,0]=4 9275 B16R2.42 COc1ccc(cc1)NCc2ccsc2 207a_100000184247_100000188534 [0,2,0,0,0,0|2,0,0]=4 9276 B16R2.42 COc1ccc(cc1)NCc2ccsc2 270302a_100000184247_100000188534 [0,2,0,0,0,0|2,0,0]=4 9277 B16R2.42 COc1ccc(cc1)NCc2ccsc2 34a_100000184247_100011261437 [0,2,0,0,0,0|2,0,0]=4 9278 B16R2.42 COc1ccc(cc1)NCc2cn[nH]c2 207a_100000184247_100016992096 [0,2,0,0,0,0|2,0,0]=4 9279 B16R2.42 COc1ccc(cc1)NCc2cn[nH]c2 270302a_100000184247_100016992096 [0,2,0,0,0,0|2,0,0]=4 9280 B16R2.42 COc1ccc(cc1)NCc2cnc[nH]2 207a_100000184247_100000742939 [0,2,0,0,0,0|0,0,2]=4 9281 B16R2.42 COc1ccc(cc1)NCc2cncs2 207a_100000184247_100000749870 [0,2,0,0,0,0|1,0,1]=4 9282 B16R2.42 COc1ccc(cc1)NCc2cncs2 270302a_100000184247_100000749870 [0,2,0,0,0,0|1,0,1]=4 9283 B16R2.42 COc1ccc(cc1)NCc2cncs2 34a_100000184247_100015185245 [0,2,0,0,0,0|1,0,1]=4 9284 B16R2.42 COc1ccc(cc1)NCc2cscn2 207a_100000184247_100000743575 [0,2,0,0,0,0|1,0,0]=3 9285 B16R2.42 COc1ccc(cc1)NCc2cscn2 270302a_100000184247_100000743575 [0,2,0,0,0,0|1,0,0]=3 9286 B16R2.42 COc1ccc(cc1)NCc2cscn2 34a_100000184247_100000205941 [0,2,0,0,0,0|1,0,0]=3 9287 B16R2.42 COc1ccc(cc1)NCc2ncc[nH]2 207a_100000184247_100000743867 [0,2,0,0,0,0|2,0,0]=4 9288 B16R2.42 COc1ccc(cc1)NCc2ncc[nH]2 34a_100000184247_100016991755 [0,2,0,0,0,0|2,0,0]=4 9289 B16R2.42 COc1ccc(cc1)NCc2ncco2 34a_100000184247_103436540062 [0,2,0,0,0,0|2,0,0]=4 9290 B16R2.42 COc1ccc(cc1)NCc2nccs2 207a_100000184247_100000750902 [0,2,0,0,0,0|2,0,0]=4 9291 B16R2.42 COc1ccc(cc1)NCc2nccs2 270302a_100000184247_100000750902 [0,2,0,0,0,0|2,0,0]=4 9292 B16R2.42 COc1ccc(cc1)NCc2nccs2 34a_100000184247_100015184050 [0,2,0,0,0,0|2,0,0]=4 9293 B16R2.42 COc1ccc(cc1)NCc2ncon2 34a_100000184247_100000233494 [0,2,0,0,0,0|2,0,0]=4 9294 B16R2.42 COc1ccc(cc1)NCn2cncn2 34a_100000184247_200020645497 [0,2,0,0,0,0|1,0,1]=4 9295 B16R2.42 COc1ccc(cc1)OCc2c[nH]cn2 34a_100000210503_100000707719 [0,2,0,0,0,0|1,0,0]=3 9296 B16R2.42 COc1ccc(cc1)OCc2cscn2 34a_100000210503_100000205941 [0,2,0,0,0,0|2,0,0]=4 9297 B16R2.42 COc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000171711 [0,2,0,0,0,0|1,0,0]=3 9298 B16R2.42 COc1ccc(cc1)SCc2cscn2 62a_100000205941_100000171711 [0,2,0,0,0,0|2,0,0]=4 9299 B16R2.42 COc1ccc(cn1)OCc2c[nH]cn2 34a_100011934560_100000707719 [0,2,0,0,0,0|2,0,0]=4 9300 B16R2.42 COc1ccc(cn1)SCc2c[nH]cn2 62a_100000047065_100000707719 [0,2,0,0,0,0|2,0,0]=4 9301 B16R2.42 COc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000047065 [0,2,0,0,0,0|2,0,0]=4 9302 B16R2.42 COc1ccc(nc1)OCc2c[nH]cn2 34a_100012002028_100000707719 [0,2,0,0,0,0|2,0,0]=4 9303 B16R2.42 COc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000744180 [0,2,0,0,0,0|2,0,0]=4 9304 B16R2.42 COc1ccc(nc1)SCc2c[nH]cn2 62a_100000755202_100000707719 [0,2,0,0,0,0|2,0,0]=4 9305 B16R2.42 COc1ccc(nn1)NCc2c[nH]cn2 27a_100000758547_100010231723 [0,2,0,0,0,0|2,0,0]=4 9306 B16R2.42 COc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000069167 [0,2,0,0,0,0|2,0,0]=4 9307 B16R2.42 CSc1ccc(cc1)CSc2c[nH]cn2 62a_100000181263_100000756875 [0,2,0,0,0,0|2,0,0]=4 9308 B16R2.42 CSc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000181263 [0,2,0,0,0,0|2,0,0]=4 9309 B16R2.42 CSc1ccc(cc1)NCc2c[nH]cn2 34a_100000212337_100000707719 [0,2,0,0,0,0|0,0,0]=2 9310 B16R2.42 CSc1ccc(cc1)NCc2cc[nH]n2 207a_100000212337_100000738523 [0,2,0,0,0,0|2,0,0]=4 9311 B16R2.42 CSc1ccc(cc1)NCc2ccco2 207a_100000212337_100000186105 [0,2,0,0,0,0|2,0,0]=4 9312 B16R2.42 CSc1ccc(cc1)NCc2ccco2 270302a_100000212337_100000186105 [0,2,0,0,0,0|2,0,0]=4 9313 B16R2.42 CSc1ccc(cc1)NCc2cccs2 207a_100000212337_100000209959 [0,2,0,0,0,0|2,0,0]=4 9314 B16R2.42 CSc1ccc(cc1)NCc2cccs2 270302a_100000212337_100000209959 [0,2,0,0,0,0|2,0,0]=4 9315 B16R2.42 CSc1ccc(cc1)NCc2cccs2 62a_100000188760_200000210301 [0,2,0,0,0,0|2,0,0]=4 9316 B16R2.42 CSc1ccc(cc1)NCc2cccs2 62a_200000210301_100000188760 [0,2,0,0,0,0|2,0,0]=4 9317 B16R2.42 CSc1ccc(cc1)NCc2ccoc2 207a_100000212337_100011215517 [0,2,0,0,0,0|2,0,0]=4 9318 B16R2.42 CSc1ccc(cc1)NCc2ccon2 34a_100000212337_100000234950 [0,2,0,0,0,0|2,0,0]=4 9319 B16R2.42 CSc1ccc(cc1)NCc2ccsc2 207a_100000212337_100000188534 [0,2,0,0,0,0|2,0,0]=4 9320 B16R2.42 CSc1ccc(cc1)NCc2ccsc2 270302a_100000212337_100000188534 [0,2,0,0,0,0|2,0,0]=4 9321 B16R2.42 CSc1ccc(cc1)NCc2ccsc2 34a_100000212337_100011261437 [0,2,0,0,0,0|2,0,0]=4 9322 B16R2.42 CSc1ccc(cc1)NCc2cn[nH]c2 207a_100000212337_100016992096 [0,2,0,0,0,0|2,0,0]=4 9323 B16R2.42 CSc1ccc(cc1)NCc2cn[nH]c2 270302a_100000212337_100016992096 [0,2,0,0,0,0|2,0,0]=4 9324 B16R2.42 CSc1ccc(cc1)NCc2cnc[nH]2 207a_100000212337_100000742939 [0,2,0,0,0,0|0,0,2]=4 9325 B16R2.42 CSc1ccc(cc1)NCc2cncs2 207a_100000212337_100000749870 [0,2,0,0,0,0|1,0,1]=4 9326 B16R2.42 CSc1ccc(cc1)NCc2cncs2 270302a_100000212337_100000749870 [0,2,0,0,0,0|1,0,1]=4 9327 B16R2.42 CSc1ccc(cc1)NCc2cncs2 34a_100000212337_100015185245 [0,2,0,0,0,0|1,0,1]=4 9328 B16R2.42 CSc1ccc(cc1)NCc2cscn2 207a_100000212337_100000743575 [0,2,0,0,0,0|1,0,0]=3 9329 B16R2.42 CSc1ccc(cc1)NCc2cscn2 270302a_100000212337_100000743575 [0,2,0,0,0,0|1,0,0]=3 9330 B16R2.42 CSc1ccc(cc1)NCc2cscn2 34a_100000212337_100000205941 [0,2,0,0,0,0|1,0,0]=3 9331 B16R2.42 CSc1ccc(cc1)NCc2ncc[nH]2 207a_100000212337_100000743867 [0,2,0,0,0,0|2,0,0]=4 9332 B16R2.42 CSc1ccc(cc1)NCc2ncc[nH]2 34a_100000212337_100016991755 [0,2,0,0,0,0|2,0,0]=4 9333 B16R2.42 CSc1ccc(cc1)NCc2ncco2 34a_100000212337_103436540062 [0,2,0,0,0,0|2,0,0]=4 9334 B16R2.42 CSc1ccc(cc1)NCc2nccs2 207a_100000212337_100000750902 [0,2,0,0,0,0|2,0,0]=4 9335 B16R2.42 CSc1ccc(cc1)NCc2nccs2 270302a_100000212337_100000750902 [0,2,0,0,0,0|2,0,0]=4 9336 B16R2.42 CSc1ccc(cc1)NCc2nccs2 34a_100000212337_100015184050 [0,2,0,0,0,0|2,0,0]=4 9337 B16R2.42 CSc1ccc(cc1)NCc2ncon2 34a_100000212337_100000233494 [0,2,0,0,0,0|2,0,0]=4 9338 B16R2.42 CSc1ccc(cc1)NCn2cncn2 34a_100000212337_200020645497 [0,2,0,0,0,0|1,0,1]=4 9339 B16R2.42 CSc1ccc(cc1)OCc2c[nH]cn2 34a_100000211864_100000707719 [0,2,0,0,0,0|1,0,0]=3 9340 B16R2.42 CSc1ccc(cc1)OCc2cscn2 34a_100000211864_100000205941 [0,2,0,0,0,0|2,0,0]=4 9341 B16R2.42 CSc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100011263217 [0,2,0,0,0,0|1,0,0]=3 9342 B16R2.42 CSc1ccc(cc1)SCc2c[nH]cn2 62a_100011263217_100000707719 [0,2,0,0,0,0|1,0,0]=3 9343 B16R2.42 CSc1ccc(cc1)SCc2cscn2 62a_100000205941_100011263217 [0,2,0,0,0,0|2,0,0]=4 9344 B16R2.42 CSc1ccc(cc1)SCc2cscn2 62a_100011263217_100000205941 [0,2,0,0,0,0|2,0,0]=4 9345 B16R2.42 CSc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100011408404 [0,2,0,0,0,0|2,0,0]=4 9346 B16R2.42 CSc1ccc(cn1)SCc2c[nH]cn2 62a_100011408404_100000707719 [0,2,0,0,0,0|2,0,0]=4 9347 B16R2.42 CSc1ccc(nc1)NCc2c[nH]cn2 27a_100000758547_100009820866 [0,2,0,0,0,0|1,0,0]=3 9348 B16R2.42 CSc1ccc(nc1)NCc2c[nH]nn2 27a_100020620823_100009820866 [0,2,0,0,0,0|2,0,0]=4 9349 B16R2.42 CSc1ccc(nc1)NCc2cocn2 27a_100015188801_100009820866 [0,2,0,0,0,0|2,0,0]=4 9350 B16R2.42 CSc1ccc(nc1)NCc2cscn2 27a_100015185402_100009820866 [0,2,0,0,0,0|2,0,0]=4 9351 B16R2.42 CSc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100009820866 [0,2,0,0,0,0|2,0,0]=4 9352 B16R2.42 CSc1ccc(nc1)SCc2c[nH]cn2 62a_100009820866_100000707719 [0,2,0,0,0,0|2,0,0]=4 9353 B16R2.42 CSc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_200012356277 [0,2,0,0,0,0|2,0,0]=4 9354 B16R2.42 CSc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000718988 [0,2,0,0,0,0|2,0,0]=4 9355 B16R2.42 FCc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100010268989 [0,2,0,0,0,0|1,0,0]=3 9356 B16R2.42 FCc1ccc(cc1)SCc2c[nH]cn2 62a_100010268989_100000707719 [0,2,0,0,0,0|1,0,0]=3 9357 B16R2.42 FCc1ccc(cc1)SCc2cscn2 62a_100000205941_100010268989 [0,2,0,0,0,0|2,0,0]=4 9358 B16R2.42 FCc1ccc(cc1)SCc2cscn2 62a_100010268989_100000205941 [0,2,0,0,0,0|2,0,0]=4 9359 B16R2.42 N#Cc1ccc(cc1)C=Cc2c[nH]cn2 271570a_100102527917_100000756875 [0,2,0,0,0,0|1,0,1]=4 9360 B16R2.42 N#Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000184898 [0,2,0,0,0,0|2,0,0]=4 9361 B16R2.42 N#Cc1ccc(cc1)NCc2c[nH]cn2 34a_100000185469_100000707719 [0,2,0,0,0,0|0,0,0]=2 9362 B16R2.42 N#Cc1ccc(cc1)NCc2ccco2 270302a_100000185469_100000186105 [0,2,0,0,0,0|2,0,0]=4 9363 B16R2.42 N#Cc1ccc(cc1)NCc2cccs2 270302a_100000185469_100000209959 [0,2,0,0,0,0|2,0,0]=4 9364 B16R2.42 N#Cc1ccc(cc1)NCc2ccon2 34a_100000185469_100000234950 [0,2,0,0,0,0|2,0,0]=4 9365 B16R2.42 N#Cc1ccc(cc1)NCc2ccsc2 270302a_100000185469_100000188534 [0,2,0,0,0,0|2,0,0]=4 9366 B16R2.42 N#Cc1ccc(cc1)NCc2ccsc2 34a_100000185469_100011261437 [0,2,0,0,0,0|2,0,0]=4 9367 B16R2.42 N#Cc1ccc(cc1)NCc2cn[nH]c2 270302a_100000185469_100016992096 [0,2,0,0,0,0|2,0,0]=4 9368 B16R2.42 N#Cc1ccc(cc1)NCc2cncs2 270302a_100000185469_100000749870 [0,2,0,0,0,0|1,0,1]=4 9369 B16R2.42 N#Cc1ccc(cc1)NCc2cncs2 34a_100000185469_100015185245 [0,2,0,0,0,0|1,0,1]=4 9370 B16R2.42 N#Cc1ccc(cc1)NCc2cscn2 270302a_100000185469_100000743575 [0,2,0,0,0,0|1,0,0]=3 9371 B16R2.42 N#Cc1ccc(cc1)NCc2cscn2 34a_100000185469_100000205941 [0,2,0,0,0,0|1,0,0]=3 9372 B16R2.42 N#Cc1ccc(cc1)NCc2ncc[nH]2 34a_100000185469_100016991755 [0,2,0,0,0,0|2,0,0]=4 9373 B16R2.42 N#Cc1ccc(cc1)NCc2ncco2 34a_100000185469_103436540062 [0,2,0,0,0,0|2,0,0]=4 9374 B16R2.42 N#Cc1ccc(cc1)NCc2nccs2 270302a_100000185469_100000750902 [0,2,0,0,0,0|2,0,0]=4 9375 B16R2.42 N#Cc1ccc(cc1)NCc2nccs2 34a_100000185469_100015184050 [0,2,0,0,0,0|2,0,0]=4 9376 B16R2.42 N#Cc1ccc(cc1)NCc2ncon2 34a_100000185469_100000233494 [0,2,0,0,0,0|2,0,0]=4 9377 B16R2.42 N#Cc1ccc(cc1)NCn2cncn2 34a_100000185469_200020645497 [0,2,0,0,0,0|1,0,1]=4 9378 B16R2.42 N#Cc1ccc(cc1)OCc2c[nH]cn2 34a_100000210344_100000707719 [0,2,0,0,0,0|1,0,0]=3 9379 B16R2.42 N#Cc1ccc(cc1)OCc2cscn2 34a_100000210344_100000205941 [0,2,0,0,0,0|2,0,0]=4 9380 B16R2.42 N#Cc1ccc(cc1)OCc2cscn2 7a_100000210344_100000205941 [0,2,0,0,0,0|2,0,0]=4 9381 B16R2.42 N#Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000184291 [0,2,0,0,0,0|1,0,0]=3 9382 B16R2.42 N#Cc1ccc(cc1)SCc2cscn2 62a_100000205941_100000184291 [0,2,0,0,0,0|2,0,0]=4 9383 B16R2.42 N#Cc1ccc(cn1)OCc2c[nH]cn2 34a_100011934750_100000707719 [0,2,0,0,0,0|2,0,0]=4 9384 B16R2.42 N#Cc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000760455 [0,2,0,0,0,0|2,0,0]=4 9385 B16R2.42 N#Cc1ccc(nc1)NCc2c[nH]cn2 27a_100000758547_100000241038 [0,2,0,0,0,0|1,0,0]=3 9386 B16R2.42 N#Cc1ccc(nc1)NCc2c[nH]nn2 27a_100020620823_100000241038 [0,2,0,0,0,0|2,0,0]=4 9387 B16R2.42 N#Cc1ccc(nc1)NCc2cocn2 27a_100015188801_100000241038 [0,2,0,0,0,0|2,0,0]=4 9388 B16R2.42 N#Cc1ccc(nc1)NCc2cscn2 27a_100015185402_100000241038 [0,2,0,0,0,0|2,0,0]=4 9389 B16R2.42 N#Cc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000241038 [0,2,0,0,0,0|2,0,0]=4 9390 B16R2.42 N#Cc1ccc(nn1)NCc2c[nH]cn2 27a_100000758547_100000094388 [0,2,0,0,0,0|2,0,0]=4 9391 B16R2.42 N#Cc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100000059812 [0,2,0,0,0,0|2,0,0]=4 9392 B16R2.42 N#Cc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000099682 [0,2,0,0,0,0|2,0,0]=4 9393 B16R2.42 N#Cc1ncc(cn1)NCc2c[nH]cn2 27a_100000758547_100000079764 [0,2,0,0,0,0|2,0,0]=4 9394 B16R2.42 NCc1ccc(cc1)OCc2c[nH]cn2 34a_100000185549_100000707719 [0,2,0,0,0,0|1,0,0]=3 9395 B16R2.42 NCc1ccc(cc1)OCc2cscn2 34a_100000185549_100000205941 [0,2,0,0,0,0|2,0,0]=4 9396 B16R2.42 NCc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100016989417 [0,2,0,0,0,0|1,0,0]=3 9397 B16R2.42 NCc1ccc(cc1)SCc2c[nH]cn2 62a_100016989417_100000707719 [0,2,0,0,0,0|1,0,0]=3 9398 B16R2.42 NCc1ccc(cc1)SCc2cscn2 62a_100000205941_100016989417 [0,2,0,0,0,0|2,0,0]=4 9399 B16R2.42 NCc1ccc(cc1)SCc2cscn2 62a_100016989417_100000205941 [0,2,0,0,0,0|2,0,0]=4 9400 B16R2.42 NCc1ccc(cn1)OCc2c[nH]cn2 34a_100020605196_100000707719 [0,2,0,0,0,0|2,0,0]=4 9401 B16R2.42 NCc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100015188789 [0,2,0,0,0,0|2,0,0]=4 9402 B16R2.42 NCc1ccc(cn1)SCc2c[nH]cn2 62a_100015188789_100000707719 [0,2,0,0,0,0|2,0,0]=4 9403 B16R2.42 NCc1ccc(nc1)OCc2c[nH]cn2 34a_100000757128_100000707719 [0,2,0,0,0,0|2,0,0]=4 9404 B16R2.42 NCc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000735879 [0,2,0,0,0,0|2,0,0]=4 9405 B16R2.42 NCc1ccc(nc1)SCc2c[nH]cn2 62a_100000735879_100000707719 [0,2,0,0,0,0|2,0,0]=4 9406 B16R2.42 NNc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100016988836 [0,2,0,0,0,0|1,0,0]=3 9407 B16R2.42 NNc1ccc(cc1)SCc2c[nH]cn2 62a_100016988836_100000707719 [0,2,0,0,0,0|1,0,0]=3 9408 B16R2.42 NNc1ccc(cc1)SCc2cscn2 62a_100000205941_100016988836 [0,2,0,0,0,0|2,0,0]=4 9409 B16R2.42 NNc1ccc(cc1)SCc2cscn2 62a_100016988836_100000205941 [0,2,0,0,0,0|2,0,0]=4 9410 B16R2.42 NNc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000750576 [0,2,0,0,0,0|2,0,0]=4 9411 B16R2.42 NNc1ccc(cn1)SCc2c[nH]cn2 62a_100000750576_100000707719 [0,2,0,0,0,0|2,0,0]=4 9412 B16R2.42 NNc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000119030 [0,2,0,0,0,0|2,0,0]=4 9413 B16R2.42 NNc1ccc(nc1)SCc2c[nH]cn2 62a_100000755011_100000707719 [0,2,0,0,0,0|2,0,0]=4 9414 B16R2.42 O=Cc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100009816848 [0,2,0,0,0,0|2,0,0]=4 9415 B16R2.42 O=Cc1ccc(cc1)CSc2c[nH]cn2 62a_100009816848_100000756875 [0,2,0,0,0,0|2,0,0]=4 9416 B16R2.42 O=Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000188517_100000707719 [0,2,0,0,0,0|1,0,0]=3 9417 B16R2.42 O=Cc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000188517 [0,2,0,0,0,0|1,0,0]=3 9418 B16R2.42 O=Cc1ccc(cc1)SCc2cscn2 62a_100000188517_100000205941 [0,2,0,0,0,0|2,0,0]=4 9419 B16R2.42 O=Cc1ccc(cc1)SCc2cscn2 62a_100000205941_100000188517 [0,2,0,0,0,0|2,0,0]=4 9420 B16R2.42 O=Cc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000754260 [0,2,0,0,0,0|2,0,0]=4 9421 B16R2.42 O=Cc1ccc(cn1)SCc2c[nH]cn2 62a_100000754260_100000707719 [0,2,0,0,0,0|2,0,0]=4 9422 B16R2.42 O=Cc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100000766901 [0,2,0,0,0,0|2,0,0]=4 9423 B16R2.42 O=Cc1ccc(nc1)SCc2c[nH]cn2 62a_100000766901_100000707719 [0,2,0,0,0,0|2,0,0]=4 9424 B16R2.42 O=Cc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100012001714 [0,2,0,0,0,0|2,0,0]=4 9425 B16R2.42 O=Cc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100000070856 [0,2,0,0,0,0|2,0,0]=4 9426 B16R2.42 OCc1ccc(cc1)CSc2c[nH]cn2 62a_100000067286_100000756875 [0,2,0,0,0,0|2,0,0]=4 9427 B16R2.42 OCc1ccc(cc1)CSc2c[nH]cn2 62a_100000756875_100000067286 [0,2,0,0,0,0|2,0,0]=4 9428 B16R2.42 OCc1ccc(cc1)NCc2c[nH]cn2 2230a_100011215238_100000707719 [0,2,0,0,0,0|0,0,0]=2 9429 B16R2.42 OCc1ccc(cc1)NCc2c[nH]cn2 34a_100011215238_100000707719 [0,2,0,0,0,0|0,0,0]=2 9430 B16R2.42 OCc1ccc(cc1)NCc2ccco2 270302a_100011215238_100000186105 [0,2,0,0,0,0|2,0,0]=4 9431 B16R2.42 OCc1ccc(cc1)NCc2cccs2 270302a_100011215238_100000209959 [0,2,0,0,0,0|2,0,0]=4 9432 B16R2.42 OCc1ccc(cc1)NCc2ccon2 2230a_100011215238_100000234950 [0,2,0,0,0,0|2,0,0]=4 9433 B16R2.42 OCc1ccc(cc1)NCc2ccon2 34a_100011215238_100000234950 [0,2,0,0,0,0|2,0,0]=4 9434 B16R2.42 OCc1ccc(cc1)NCc2ccsc2 2230a_100011215238_100011261437 [0,2,0,0,0,0|2,0,0]=4 9435 B16R2.42 OCc1ccc(cc1)NCc2ccsc2 270302a_100011215238_100000188534 [0,2,0,0,0,0|2,0,0]=4 9436 B16R2.42 OCc1ccc(cc1)NCc2ccsc2 34a_100011215238_100011261437 [0,2,0,0,0,0|2,0,0]=4 9437 B16R2.42 OCc1ccc(cc1)NCc2cn[nH]c2 270302a_100011215238_100016992096 [0,2,0,0,0,0|2,0,0]=4 9438 B16R2.42 OCc1ccc(cc1)NCc2cncs2 2230a_100011215238_100015185245 [0,2,0,0,0,0|1,0,1]=4 9439 B16R2.42 OCc1ccc(cc1)NCc2cncs2 270302a_100011215238_100000749870 [0,2,0,0,0,0|1,0,1]=4 9440 B16R2.42 OCc1ccc(cc1)NCc2cncs2 34a_100011215238_100015185245 [0,2,0,0,0,0|1,0,1]=4 9441 B16R2.42 OCc1ccc(cc1)NCc2cscn2 2230a_100011215238_100000205941 [0,2,0,0,0,0|1,0,0]=3 9442 B16R2.42 OCc1ccc(cc1)NCc2cscn2 270302a_100011215238_100000743575 [0,2,0,0,0,0|1,0,0]=3 9443 B16R2.42 OCc1ccc(cc1)NCc2cscn2 34a_100011215238_100000205941 [0,2,0,0,0,0|1,0,0]=3 9444 B16R2.42 OCc1ccc(cc1)NCc2ncc[nH]2 2230a_100011215238_100016991755 [0,2,0,0,0,0|2,0,0]=4 9445 B16R2.42 OCc1ccc(cc1)NCc2ncc[nH]2 34a_100011215238_100016991755 [0,2,0,0,0,0|2,0,0]=4 9446 B16R2.42 OCc1ccc(cc1)NCc2ncco2 2230a_100011215238_103436540062 [0,2,0,0,0,0|2,0,0]=4 9447 B16R2.42 OCc1ccc(cc1)NCc2ncco2 34a_100011215238_103436540062 [0,2,0,0,0,0|2,0,0]=4 9448 B16R2.42 OCc1ccc(cc1)NCc2nccs2 2230a_100011215238_100015184050 [0,2,0,0,0,0|2,0,0]=4 9449 B16R2.42 OCc1ccc(cc1)NCc2nccs2 270302a_100011215238_100000750902 [0,2,0,0,0,0|2,0,0]=4 9450 B16R2.42 OCc1ccc(cc1)NCc2nccs2 34a_100011215238_100015184050 [0,2,0,0,0,0|2,0,0]=4 9451 B16R2.42 OCc1ccc(cc1)NCc2ncon2 34a_100011215238_100000233494 [0,2,0,0,0,0|2,0,0]=4 9452 B16R2.42 OCc1ccc(cc1)NCn2cncn2 2230a_100011215238_200020645497 [0,2,0,0,0,0|1,0,1]=4 9453 B16R2.42 OCc1ccc(cc1)NCn2cncn2 34a_100011215238_200020645497 [0,2,0,0,0,0|1,0,1]=4 9454 B16R2.42 OCc1ccc(cc1)OCc2c[nH]cn2 34a_100000211755_100000707719 [0,2,0,0,0,0|1,0,0]=3 9455 B16R2.42 OCc1ccc(cc1)OCc2cscn2 34a_100000211755_100000205941 [0,2,0,0,0,0|2,0,0]=4 9456 B16R2.42 OCc1ccc(cc1)SCc2c[nH]cn2 62a_100000690907_100000707719 [0,2,0,0,0,0|1,0,0]=3 9457 B16R2.42 OCc1ccc(cc1)SCc2c[nH]cn2 62a_100000707719_100000690907 [0,2,0,0,0,0|1,0,0]=3 9458 B16R2.42 OCc1ccc(cc1)SCc2cscn2 62a_100000205941_100000690907 [0,2,0,0,0,0|2,0,0]=4 9459 B16R2.42 OCc1ccc(cc1)SCc2cscn2 62a_100000690907_100000205941 [0,2,0,0,0,0|2,0,0]=4 9460 B16R2.42 OCc1ccc(cn1)OCc2c[nH]cn2 34a_103436540053_100000707719 [0,2,0,0,0,0|2,0,0]=4 9461 B16R2.42 OCc1ccc(cn1)SCc2c[nH]cn2 62a_100000707719_100000754261 [0,2,0,0,0,0|2,0,0]=4 9462 B16R2.42 OCc1ccc(cn1)SCc2c[nH]cn2 62a_100000754261_100000707719 [0,2,0,0,0,0|2,0,0]=4 9463 B16R2.42 OCc1ccc(nc1)SCc2c[nH]cn2 62a_100000707719_100009816760 [0,2,0,0,0,0|2,0,0]=4 9464 B16R2.42 OCc1ccc(nc1)SCc2c[nH]cn2 62a_100009816760_100000707719 [0,2,0,0,0,0|2,0,0]=4 9465 B16R2.42 OCc1cnc(cn1)NCc2c[nH]cn2 27a_100000758547_100012002382 [0,2,0,0,0,0|2,0,0]=4 9466 B16R2.42 OCc1cnc(nc1)NCc2c[nH]cn2 27a_100000758547_100009855073 [0,2,0,0,0,0|2,0,0]=4 9467 B16R2.42 [13CH3]Sc1ccc(cc1)NCc2cccs2 62a_100000188760_200025704644 [0,2,0,0,0,0|2,0,0]=4 9468 B16R2.42 [13CH3]Sc1ccc(cc1)NCc2cccs2 62a_200025704644_100000188760 [0,2,0,0,0,0|2,0,0]=4 9469 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)Br 62a_100000755118_100000756875 [0,2,0,0,0,0|2,0,0]=4 9470 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)Br 62a_100000756875_100000755118 [0,2,0,0,0,0|2,0,0]=4 9471 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)Cl 62a_100000684792_100000756875 [0,2,0,0,0,0|2,0,0]=4 9472 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)Cl 62a_100000756875_100000684792 [0,2,0,0,0,0|2,0,0]=4 9473 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)F 62a_100000743420_100000756875 [0,2,0,0,0,0|2,0,0]=4 9474 B16R2.125 CC(Sc1c[nH]cn1)c2ccc(cc2)F 62a_100000756875_100000743420 [0,2,0,0,0,0|2,0,0]=4 9475 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Br 2230a_100000219623_100000707719 [0,2,0,0,0,0|0,0,0]=2 9476 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Br 269982a_100000219623_100000707719 [0,2,0,0,0,0|0,0,0]=2 9477 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Br 34a_100000219623_100000707719 [0,2,0,0,0,0|0,0,0]=2 9478 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Cl 2230a_100020629279_100000707719 [0,2,0,0,0,0|0,0,0]=2 9479 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Cl 269982a_100020629279_100000707719 [0,2,0,0,0,0|0,0,0]=2 9480 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)Cl 34a_100020629279_100000707719 [0,2,0,0,0,0|0,0,0]=2 9481 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)F 2230a_100000219829_100000707719 [0,2,0,0,0,0|0,0,0]=2 9482 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)F 269982a_100000219829_100000707719 [0,2,0,0,0,0|0,0,0]=2 9483 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)F 34a_100000219829_100000707719 [0,2,0,0,0,0|0,0,0]=2 9484 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)I 2230a_100000743151_100000707719 [0,2,0,0,0,0|0,0,0]=2 9485 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)I 269982a_100000743151_100000707719 [0,2,0,0,0,0|0,0,0]=2 9486 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)I 34a_100000743151_100000707719 [0,2,0,0,0,0|0,0,0]=2 9487 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)O 269982a_100000182112_100000707719 [0,2,0,0,0,0|0,0,0]=2 9488 B16R2.125 CN(Cc1c[nH]cn1)c2ccc(cc2)O 34a_100000182112_100000707719 [0,2,0,0,0,0|0,0,0]=2 9489 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)Cl 2230a_100000189056_200000210301 [0,2,0,0,0,0|2,0,0]=4 9490 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)Cl 269982a_100000189056_200000210301 [0,2,0,0,0,0|2,0,0]=4 9491 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)Cl 34a_100000189056_200000210301 [0,2,0,0,0,0|2,0,0]=4 9492 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)F 2230a_100000739240_200000210301 [0,2,0,0,0,0|2,0,0]=4 9493 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)F 269982a_100000739240_200000210301 [0,2,0,0,0,0|2,0,0]=4 9494 B16R2.125 CN(Cc1ccco1)c2ccc(cc2)F 34a_100000739240_200000210301 [0,2,0,0,0,0|2,0,0]=4 9495 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)Br 2230a_100000188760_200000210301 [0,2,0,0,0,0|2,0,0]=4 9496 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)Br 269982a_100000188760_200000210301 [0,2,0,0,0,0|2,0,0]=4 9497 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)Br 34a_100000188760_200000210301 [0,2,0,0,0,0|2,0,0]=4 9498 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)F 2230a_100000742479_200000210301 [0,2,0,0,0,0|2,0,0]=4 9499 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)F 269982a_100000742479_200000210301 [0,2,0,0,0,0|2,0,0]=4 9500 B16R2.125 CN(Cc1cccs1)c2ccc(cc2)F 34a_100000742479_200000210301 [0,2,0,0,0,0|2,0,0]=4 9501 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Br 2230a_100000219623_100000234950 [0,2,0,0,0,0|2,0,0]=4 9502 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Br 269982a_100000219623_100000234950 [0,2,0,0,0,0|2,0,0]=4 9503 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Br 34a_100000219623_100000234950 [0,2,0,0,0,0|2,0,0]=4 9504 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Cl 2230a_100020629279_100000234950 [0,2,0,0,0,0|2,0,0]=4 9505 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Cl 269982a_100020629279_100000234950 [0,2,0,0,0,0|2,0,0]=4 9506 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)Cl 34a_100020629279_100000234950 [0,2,0,0,0,0|2,0,0]=4 9507 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)F 2230a_100000219829_100000234950 [0,2,0,0,0,0|2,0,0]=4 9508 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)F 269982a_100000219829_100000234950 [0,2,0,0,0,0|2,0,0]=4 9509 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)F 34a_100000219829_100000234950 [0,2,0,0,0,0|2,0,0]=4 9510 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)I 2230a_100000743151_100000234950 [0,2,0,0,0,0|2,0,0]=4 9511 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)I 269982a_100000743151_100000234950 [0,2,0,0,0,0|2,0,0]=4 9512 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)I 34a_100000743151_100000234950 [0,2,0,0,0,0|2,0,0]=4 9513 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)O 269982a_100000182112_100000234950 [0,2,0,0,0,0|2,0,0]=4 9514 B16R2.125 CN(Cc1ccon1)c2ccc(cc2)O 34a_100000182112_100000234950 [0,2,0,0,0,0|2,0,0]=4 9515 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Br 2230a_100000219623_100011261437 [0,2,0,0,0,0|2,0,0]=4 9516 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Br 269982a_100000219623_100011233845 [0,2,0,0,0,0|2,0,0]=4 9517 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Br 34a_100000219623_100011261437 [0,2,0,0,0,0|2,0,0]=4 9518 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Cl 2230a_100020629279_100011261437 [0,2,0,0,0,0|2,0,0]=4 9519 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Cl 269982a_100020629279_100011233845 [0,2,0,0,0,0|2,0,0]=4 9520 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)Cl 34a_100020629279_100011261437 [0,2,0,0,0,0|2,0,0]=4 9521 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)F 2230a_100000219829_100011261437 [0,2,0,0,0,0|2,0,0]=4 9522 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)F 269982a_100000219829_100011233845 [0,2,0,0,0,0|2,0,0]=4 9523 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)F 34a_100000219829_100011261437 [0,2,0,0,0,0|2,0,0]=4 9524 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)I 2230a_100000743151_100011261437 [0,2,0,0,0,0|2,0,0]=4 9525 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)I 269982a_100000743151_100011233845 [0,2,0,0,0,0|2,0,0]=4 9526 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)I 34a_100000743151_100011261437 [0,2,0,0,0,0|2,0,0]=4 9527 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)O 269982a_100000182112_100011233845 [0,2,0,0,0,0|2,0,0]=4 9528 B16R2.125 CN(Cc1ccsc1)c2ccc(cc2)O 34a_100000182112_100011261437 [0,2,0,0,0,0|2,0,0]=4 9529 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Br 2230a_100000219623_100015185245 [0,2,0,0,0,0|1,0,1]=4 9530 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Br 269982a_100000219623_100015185245 [0,2,0,0,0,0|1,0,1]=4 9531 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Br 34a_100000219623_100015185245 [0,2,0,0,0,0|1,0,1]=4 9532 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Cl 2230a_100020629279_100015185245 [0,2,0,0,0,0|1,0,1]=4 9533 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Cl 269982a_100020629279_100015185245 [0,2,0,0,0,0|1,0,1]=4 9534 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)Cl 34a_100020629279_100015185245 [0,2,0,0,0,0|1,0,1]=4 9535 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)F 2230a_100000219829_100015185245 [0,2,0,0,0,0|1,0,1]=4 9536 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)F 269982a_100000219829_100015185245 [0,2,0,0,0,0|1,0,1]=4 9537 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)F 34a_100000219829_100015185245 [0,2,0,0,0,0|1,0,1]=4 9538 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)I 2230a_100000743151_100015185245 [0,2,0,0,0,0|1,0,1]=4 9539 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)I 269982a_100000743151_100015185245 [0,2,0,0,0,0|1,0,1]=4 9540 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)I 34a_100000743151_100015185245 [0,2,0,0,0,0|1,0,1]=4 9541 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)O 269982a_100000182112_100015185245 [0,2,0,0,0,0|1,0,1]=4 9542 B16R2.125 CN(Cc1cncs1)c2ccc(cc2)O 34a_100000182112_100015185245 [0,2,0,0,0,0|1,0,1]=4 9543 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Br 2230a_100000219623_100000205941 [0,2,0,0,0,0|1,0,0]=3 9544 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Br 269982a_100000219623_100000205941 [0,2,0,0,0,0|1,0,0]=3 9545 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Br 34a_100000219623_100000205941 [0,2,0,0,0,0|1,0,0]=3 9546 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Cl 2230a_100020629279_100000205941 [0,2,0,0,0,0|1,0,0]=3 9547 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Cl 269982a_100020629279_100000205941 [0,2,0,0,0,0|1,0,0]=3 9548 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)Cl 34a_100020629279_100000205941 [0,2,0,0,0,0|1,0,0]=3 9549 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)F 2230a_100000219829_100000205941 [0,2,0,0,0,0|1,0,0]=3 9550 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)F 269982a_100000219829_100000205941 [0,2,0,0,0,0|1,0,0]=3 9551 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)F 34a_100000219829_100000205941 [0,2,0,0,0,0|1,0,0]=3 9552 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)I 2230a_100000743151_100000205941 [0,2,0,0,0,0|1,0,0]=3 9553 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)I 269982a_100000743151_100000205941 [0,2,0,0,0,0|1,0,0]=3 9554 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)I 34a_100000743151_100000205941 [0,2,0,0,0,0|1,0,0]=3 9555 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)O 269982a_100000182112_100000205941 [0,2,0,0,0,0|1,0,0]=3 9556 B16R2.125 CN(Cc1cscn1)c2ccc(cc2)O 34a_100000182112_100000205941 [0,2,0,0,0,0|1,0,0]=3 9557 B16R2.125 CN(Cc1cscn1)c2ccc(cn2)Br 27a_100000225794_100000686858 [0,2,0,0,0,0|2,0,0]=4 9558 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Br 2230a_100000219623_100016991755 [0,2,0,0,0,0|2,0,0]=4 9559 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Br 269982a_100000219623_100016991755 [0,2,0,0,0,0|2,0,0]=4 9560 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Br 34a_100000219623_100016991755 [0,2,0,0,0,0|2,0,0]=4 9561 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Cl 2230a_100020629279_100016991755 [0,2,0,0,0,0|2,0,0]=4 9562 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Cl 269982a_100020629279_100016991755 [0,2,0,0,0,0|2,0,0]=4 9563 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Cl 269982a_100102558475_200000210301 [0,2,0,0,0,0|2,0,0]=4 9564 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Cl 34a_100020629279_100016991755 [0,2,0,0,0,0|2,0,0]=4 9565 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)Cl 34a_100102558475_200000210301 [0,2,0,0,0,0|2,0,0]=4 9566 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)F 2230a_100000219829_100016991755 [0,2,0,0,0,0|2,0,0]=4 9567 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)F 269982a_100000219829_100016991755 [0,2,0,0,0,0|2,0,0]=4 9568 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)F 34a_100000219829_100016991755 [0,2,0,0,0,0|2,0,0]=4 9569 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)I 2230a_100000743151_100016991755 [0,2,0,0,0,0|2,0,0]=4 9570 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)I 269982a_100000743151_100016991755 [0,2,0,0,0,0|2,0,0]=4 9571 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)I 34a_100000743151_100016991755 [0,2,0,0,0,0|2,0,0]=4 9572 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)O 269982a_100000182112_100016991755 [0,2,0,0,0,0|2,0,0]=4 9573 B16R2.125 CN(Cc1ncc[nH]1)c2ccc(cc2)O 34a_100000182112_100016991755 [0,2,0,0,0,0|2,0,0]=4 9574 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Br 2230a_100000219623_103436540062 [0,2,0,0,0,0|2,0,0]=4 9575 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Br 269982a_100000219623_103436540062 [0,2,0,0,0,0|2,0,0]=4 9576 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Br 34a_100000219623_103436540062 [0,2,0,0,0,0|2,0,0]=4 9577 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Cl 2230a_100020629279_103436540062 [0,2,0,0,0,0|2,0,0]=4 9578 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Cl 269982a_100020629279_103436540062 [0,2,0,0,0,0|2,0,0]=4 9579 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Cl 34a_100020629279_103436540062 [0,2,0,0,0,0|2,0,0]=4 9580 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)F 2230a_100000219829_103436540062 [0,2,0,0,0,0|2,0,0]=4 9581 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)F 269982a_100000219829_103436540062 [0,2,0,0,0,0|2,0,0]=4 9582 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)F 34a_100000219829_103436540062 [0,2,0,0,0,0|2,0,0]=4 9583 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)I 2230a_100000743151_103436540062 [0,2,0,0,0,0|2,0,0]=4 9584 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)I 269982a_100000743151_103436540062 [0,2,0,0,0,0|2,0,0]=4 9585 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)I 34a_100000743151_103436540062 [0,2,0,0,0,0|2,0,0]=4 9586 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)O 269982a_100000182112_103436540062 [0,2,0,0,0,0|2,0,0]=4 9587 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)O 34a_100000182112_103436540062 [0,2,0,0,0,0|2,0,0]=4 9588 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Br 2230a_100000219623_100015184050 [0,2,0,0,0,0|2,0,0]=4 9589 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Br 269982a_100000219623_100015184050 [0,2,0,0,0,0|2,0,0]=4 9590 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Br 34a_100000219623_100015184050 [0,2,0,0,0,0|2,0,0]=4 9591 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Cl 2230a_100020629279_100015184050 [0,2,0,0,0,0|2,0,0]=4 9592 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Cl 269982a_100020629279_100015184050 [0,2,0,0,0,0|2,0,0]=4 9593 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Cl 34a_100020629279_100015184050 [0,2,0,0,0,0|2,0,0]=4 9594 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)F 2230a_100000219829_100015184050 [0,2,0,0,0,0|2,0,0]=4 9595 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)F 269982a_100000219829_100015184050 [0,2,0,0,0,0|2,0,0]=4 9596 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)F 34a_100000219829_100015184050 [0,2,0,0,0,0|2,0,0]=4 9597 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)I 2230a_100000743151_100015184050 [0,2,0,0,0,0|2,0,0]=4 9598 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)I 269982a_100000743151_100015184050 [0,2,0,0,0,0|2,0,0]=4 9599 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)I 34a_100000743151_100015184050 [0,2,0,0,0,0|2,0,0]=4 9600 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)O 269982a_100000182112_100015184050 [0,2,0,0,0,0|2,0,0]=4 9601 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)O 34a_100000182112_100015184050 [0,2,0,0,0,0|2,0,0]=4 9602 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)Br 269982a_100000219623_100000233494 [0,2,0,0,0,0|2,0,0]=4 9603 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)Br 34a_100000219623_100000233494 [0,2,0,0,0,0|2,0,0]=4 9604 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)Cl 269982a_100020629279_100000233494 [0,2,0,0,0,0|2,0,0]=4 9605 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)Cl 34a_100020629279_100000233494 [0,2,0,0,0,0|2,0,0]=4 9606 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)F 269982a_100000219829_100000233494 [0,2,0,0,0,0|2,0,0]=4 9607 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)F 34a_100000219829_100000233494 [0,2,0,0,0,0|2,0,0]=4 9608 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)I 269982a_100000743151_100000233494 [0,2,0,0,0,0|2,0,0]=4 9609 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)I 34a_100000743151_100000233494 [0,2,0,0,0,0|2,0,0]=4 9610 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)O 269982a_100000182112_100000233494 [0,2,0,0,0,0|2,0,0]=4 9611 B16R2.125 CN(Cc1ncon1)c2ccc(cc2)O 34a_100000182112_100000233494 [0,2,0,0,0,0|2,0,0]=4 9612 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Br 2230a_100000219623_200020645497 [0,2,0,0,0,0|1,0,1]=4 9613 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Br 269982a_100000219623_200020645497 [0,2,0,0,0,0|1,0,1]=4 9614 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Br 34a_100000219623_200020645497 [0,2,0,0,0,0|1,0,1]=4 9615 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Cl 2230a_100020629279_200020645497 [0,2,0,0,0,0|1,0,1]=4 9616 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Cl 269982a_100020629279_200020645497 [0,2,0,0,0,0|1,0,1]=4 9617 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)Cl 34a_100020629279_200020645497 [0,2,0,0,0,0|1,0,1]=4 9618 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)F 2230a_100000219829_200020645497 [0,2,0,0,0,0|1,0,1]=4 9619 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)F 269982a_100000219829_200020645497 [0,2,0,0,0,0|1,0,1]=4 9620 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)F 34a_100000219829_200020645497 [0,2,0,0,0,0|1,0,1]=4 9621 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)I 2230a_100000743151_200020645497 [0,2,0,0,0,0|1,0,1]=4 9622 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)I 269982a_100000743151_200020645497 [0,2,0,0,0,0|1,0,1]=4 9623 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)I 34a_100000743151_200020645497 [0,2,0,0,0,0|1,0,1]=4 9624 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)O 269982a_100000182112_200020645497 [0,2,0,0,0,0|1,0,1]=4 9625 B16R2.125 CN(Cn1cncn1)c2ccc(cc2)O 34a_100000182112_200020645497 [0,2,0,0,0,0|1,0,1]=4 9626 B16R2.125 Cc1ccc(cc1)C(=O)Cc2c[nH]cn2 1458a_100000188618_100000707719 [0,2,0,0,0,0|1,0,0]=3 9627 B16R2.125 Cc1ccc(cc1)C(=O)Cc2cscn2 1458a_100000188618_100000205941 [0,2,0,0,0,0|2,0,0]=4 9628 B16R2.125 Cc1ccc(cc1)C(C)Sc2c[nH]cn2 62a_100000756875_100011261388 [0,2,0,0,0,0|2,0,0]=4 9629 B16R2.125 Cc1ccc(cc1)C(C)Sc2c[nH]cn2 62a_100011261388_100000756875 [0,2,0,0,0,0|2,0,0]=4 9630 B16R2.125 Cc1ccc(cc1)N(C)Cc2c[nH]cn2 2230a_100000219977_100000707719 [0,2,0,0,0,0|0,0,0]=2 9631 B16R2.125 Cc1ccc(cc1)N(C)Cc2c[nH]cn2 269982a_100000219977_100000707719 [0,2,0,0,0,0|0,0,0]=2 9632 B16R2.125 Cc1ccc(cc1)N(C)Cc2c[nH]cn2 34a_100000219977_100000707719 [0,2,0,0,0,0|0,0,0]=2 9633 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccco2 2230a_100000198071_200000210301 [0,2,0,0,0,0|2,0,0]=4 9634 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccco2 269982a_100000198071_200000210301 [0,2,0,0,0,0|2,0,0]=4 9635 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccco2 34a_100000198071_200000210301 [0,2,0,0,0,0|2,0,0]=4 9636 B16R2.125 Cc1ccc(cc1)N(C)Cc2cccs2 2230a_100000187402_200000210301 [0,2,0,0,0,0|2,0,0]=4 9637 B16R2.125 Cc1ccc(cc1)N(C)Cc2cccs2 269982a_100000187402_200000210301 [0,2,0,0,0,0|2,0,0]=4 9638 B16R2.125 Cc1ccc(cc1)N(C)Cc2cccs2 34a_100000187402_200000210301 [0,2,0,0,0,0|2,0,0]=4 9639 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccon2 2230a_100000219977_100000234950 [0,2,0,0,0,0|2,0,0]=4 9640 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccon2 269982a_100000219977_100000234950 [0,2,0,0,0,0|2,0,0]=4 9641 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccon2 34a_100000219977_100000234950 [0,2,0,0,0,0|2,0,0]=4 9642 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccsc2 2230a_100000219977_100011261437 [0,2,0,0,0,0|2,0,0]=4 9643 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccsc2 269982a_100000219977_100011233845 [0,2,0,0,0,0|2,0,0]=4 9644 B16R2.125 Cc1ccc(cc1)N(C)Cc2ccsc2 34a_100000219977_100011261437 [0,2,0,0,0,0|2,0,0]=4 9645 B16R2.125 Cc1ccc(cc1)N(C)Cc2cncs2 2230a_100000219977_100015185245 [0,2,0,0,0,0|1,0,1]=4 9646 B16R2.125 Cc1ccc(cc1)N(C)Cc2cncs2 269982a_100000219977_100015185245 [0,2,0,0,0,0|1,0,1]=4 9647 B16R2.125 Cc1ccc(cc1)N(C)Cc2cncs2 34a_100000219977_100015185245 [0,2,0,0,0,0|1,0,1]=4 9648 B16R2.125 Cc1ccc(cc1)N(C)Cc2cscn2 2230a_100000219977_100000205941 [0,2,0,0,0,0|1,0,0]=3 9649 B16R2.125 Cc1ccc(cc1)N(C)Cc2cscn2 269982a_100000219977_100000205941 [0,2,0,0,0,0|1,0,0]=3 9650 B16R2.125 Cc1ccc(cc1)N(C)Cc2cscn2 34a_100000219977_100000205941 [0,2,0,0,0,0|1,0,0]=3 9651 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncc[nH]2 2230a_100000219977_100016991755 [0,2,0,0,0,0|2,0,0]=4 9652 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncc[nH]2 269982a_100000219977_100016991755 [0,2,0,0,0,0|2,0,0]=4 9653 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncc[nH]2 34a_100000219977_100016991755 [0,2,0,0,0,0|2,0,0]=4 9654 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncco2 2230a_100000219977_103436540062 [0,2,0,0,0,0|2,0,0]=4 9655 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncco2 269982a_100000219977_103436540062 [0,2,0,0,0,0|2,0,0]=4 9656 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncco2 34a_100000219977_103436540062 [0,2,0,0,0,0|2,0,0]=4 9657 B16R2.125 Cc1ccc(cc1)N(C)Cc2nccs2 2230a_100000219977_100015184050 [0,2,0,0,0,0|2,0,0]=4 9658 B16R2.125 Cc1ccc(cc1)N(C)Cc2nccs2 269982a_100000219977_100015184050 [0,2,0,0,0,0|2,0,0]=4 9659 B16R2.125 Cc1ccc(cc1)N(C)Cc2nccs2 34a_100000219977_100015184050 [0,2,0,0,0,0|2,0,0]=4 9660 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncon2 269982a_100000219977_100000233494 [0,2,0,0,0,0|2,0,0]=4 9661 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncon2 34a_100000219977_100000233494 [0,2,0,0,0,0|2,0,0]=4 9662 B16R2.125 Cc1ccc(cc1)N(C)Cn2cncn2 2230a_100000219977_200020645497 [0,2,0,0,0,0|1,0,1]=4 9663 B16R2.125 Cc1ccc(cc1)N(C)Cn2cncn2 269982a_100000219977_200020645497 [0,2,0,0,0,0|1,0,1]=4 9664 B16R2.125 Cc1ccc(cc1)N(C)Cn2cncn2 34a_100000219977_200020645497 [0,2,0,0,0,0|1,0,1]=4 9665 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2ccco2 2230a_100000198071_200025704644 [0,2,0,0,0,0|2,0,0]=4 9666 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2ccco2 269982a_100000198071_200025704644 [0,2,0,0,0,0|2,0,0]=4 9667 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2ccco2 34a_100000198071_200025704644 [0,2,0,0,0,0|2,0,0]=4 9668 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2cccs2 2230a_100000187402_200025704644 [0,2,0,0,0,0|2,0,0]=4 9669 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2cccs2 269982a_100000187402_200025704644 [0,2,0,0,0,0|2,0,0]=4 9670 B16R2.125 Cc1ccc(cc1)N([13CH3])Cc2cccs2 34a_100000187402_200025704644 [0,2,0,0,0,0|2,0,0]=4 9671 B16R2.125 O=C(Cc1c[nH]cn1)c2ccc(cc2)Br 1458a_100000185839_100000707719 [0,2,0,0,0,0|1,0,0]=3 9672 B16R2.125 O=C(Cc1c[nH]cn1)c2ccc(cc2)Cl 1458a_100000210187_100000707719 [0,2,0,0,0,0|1,0,0]=3 9673 B16R2.125 O=C(Cc1c[nH]cn1)c2ccc(cc2)F 1458a_100000187176_100000707719 [0,2,0,0,0,0|1,0,0]=3 9674 B16R2.125 O=C(Cc1c[nH]cn1)c2ccc(cc2)I 1458a_100000187904_100000707719 [0,2,0,0,0,0|1,0,0]=3 9675 B16R2.125 O=C(Cc1c[nH]cn1)c2ccc(cc2)O 1458a_100000212099_100000707719 [0,2,0,0,0,0|1,0,0]=3 9676 B16R2.125 O=C(Cc1cscn1)c2ccc(cc2)Br 1458a_100000185839_100000205941 [0,2,0,0,0,0|2,0,0]=4 9677 B16R2.125 O=C(Cc1cscn1)c2ccc(cc2)Cl 1458a_100000210187_100000205941 [0,2,0,0,0,0|2,0,0]=4 9678 B16R2.125 O=C(Cc1cscn1)c2ccc(cc2)F 1458a_100000187176_100000205941 [0,2,0,0,0,0|2,0,0]=4 9679 B16R2.125 O=C(Cc1cscn1)c2ccc(cc2)I 1458a_100000187904_100000205941 [0,2,0,0,0,0|2,0,0]=4 9680 B16R2.125 O=C(Cc1cscn1)c2ccc(cc2)O 1458a_100000212099_100000205941 [0,2,0,0,0,0|2,0,0]=4 9681 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)Cl 2230a_100000189056_200025704644 [0,2,0,0,0,0|2,0,0]=4 9682 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)Cl 269982a_100000189056_200025704644 [0,2,0,0,0,0|2,0,0]=4 9683 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)Cl 34a_100000189056_200025704644 [0,2,0,0,0,0|2,0,0]=4 9684 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)F 2230a_100000739240_200025704644 [0,2,0,0,0,0|2,0,0]=4 9685 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)F 269982a_100000739240_200025704644 [0,2,0,0,0,0|2,0,0]=4 9686 B16R2.125 [13CH3]N(Cc1ccco1)c2ccc(cc2)F 34a_100000739240_200025704644 [0,2,0,0,0,0|2,0,0]=4 9687 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)Br 2230a_100000188760_200025704644 [0,2,0,0,0,0|2,0,0]=4 9688 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)Br 269982a_100000188760_200025704644 [0,2,0,0,0,0|2,0,0]=4 9689 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)Br 34a_100000188760_200025704644 [0,2,0,0,0,0|2,0,0]=4 9690 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)F 2230a_100000742479_200025704644 [0,2,0,0,0,0|2,0,0]=4 9691 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)F 269982a_100000742479_200025704644 [0,2,0,0,0,0|2,0,0]=4 9692 B16R2.125 [13CH3]N(Cc1cccs1)c2ccc(cc2)F 34a_100000742479_200025704644 [0,2,0,0,0,0|2,0,0]=4 9693 B16R2.125 [13CH3]N(Cc1ncc[nH]1)c2ccc(cc2)Cl 269982a_100102558475_200025704644 [0,2,0,0,0,0|2,0,0]=4 9694 B16R2.125 [13CH3]N(Cc1ncc[nH]1)c2ccc(cc2)Cl 34a_100102558475_200025704644 [0,2,0,0,0,0|2,0,0]=4 9695 B16R2.137 Brc1cc(cs1)CNc2ccc(cc2)I 207a_100000185761_100000737087 [0,2,0,0,0,0|2,0,0]=4 9696 B16R2.137 Brc1cc(cs1)CNc2ccc(cc2)I 270302a_100000185761_100000737087 [0,2,0,0,0,0|2,0,0]=4 9697 B16R2.137 Brc1ccc(cc1)NCc2cc(co2)Br 270302a_100000210018_100000747035 [0,2,0,0,0,0|2,0,0]=4 9698 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)Br 207a_100000210018_100000211722 [0,2,0,0,0,0|2,0,0]=4 9699 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)Br 2230a_100000210018_100000746031 [0,2,0,0,0,0|2,0,0]=4 9700 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)Br 270302a_100000210018_100000211722 [0,2,0,0,0,0|2,0,0]=4 9701 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)Br 34a_100000210018_100000746031 [0,2,0,0,0,0|2,0,0]=4 9702 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)I 207a_100000210018_100010179861 [0,2,0,0,0,0|2,0,0]=4 9703 B16R2.137 Brc1ccc(cc1)NCc2cc(cs2)I 270302a_100000210018_100010179861 [0,2,0,0,0,0|2,0,0]=4 9704 B16R2.137 Brc1ccc(cc1)NCc2ccc(o2)Br 207a_100000210018_100000185145 [0,2,0,0,0,0|2,0,0]=4 9705 B16R2.137 Brc1ccc(cc1)NCc2ccc(o2)I 207a_100000210018_100000186757 [0,2,0,0,0,0|2,0,0]=4 9706 B16R2.137 Brc1ccc(cc1)NCc2ccc(s2)Br 207a_100000210018_100000179771 [0,2,0,0,0,0|2,0,0]=4 9707 B16R2.137 Brc1ccc(cc1)NCc2ccc(s2)Br 2230a_100000210018_100000708592 [0,2,0,0,0,0|2,0,0]=4 9708 B16R2.137 Brc1ccc(cc1)NCc2ccc(s2)Br 270302a_100000210018_100000179771 [0,2,0,0,0,0|2,0,0]=4 9709 B16R2.137 Brc1ccc(cc1)NCc2ccc(s2)Br 34a_100000210018_100000708592 [0,2,0,0,0,0|2,0,0]=4 9710 B16R2.137 Brc1ccc(cc1)NCc2cnc(s2)Br 2230a_100000210018_100000717027 [0,2,0,0,0,0|1,0,1]=4 9711 B16R2.137 Brc1ccc(cc1)NCc2cnc(s2)Br 34a_100000210018_100000717027 [0,2,0,0,0,0|1,0,1]=4 9712 B16R2.137 Brc1ccc(cc1)NCc2csc(c2)Br 207a_100000210018_100000737087 [0,2,0,0,0,0|2,0,0]=4 9713 B16R2.137 Brc1ccc(cc1)NCc2csc(c2)Br 270302a_100000210018_100000737087 [0,2,0,0,0,0|2,0,0]=4 9714 B16R2.137 Brc1ccc(cc1)NCc2ncc(s2)Br 270302a_100000210018_100000699580 [0,2,0,0,0,0|2,0,0]=4 9715 B16R2.137 Brc1ccc(o1)CNc2ccc(cc2)I 207a_100000185761_100000185145 [0,2,0,0,0,0|2,0,0]=4 9716 B16R2.137 Brc1ccc(s1)CNc2ccc(cc2)I 207a_100000185761_100000179771 [0,2,0,0,0,0|2,0,0]=4 9717 B16R2.137 Brc1ccc(s1)CNc2ccc(cc2)I 270302a_100000185761_100000179771 [0,2,0,0,0,0|2,0,0]=4 9718 B16R2.137 Brc1ccc(s1)CNc2ccc(cc2)I 34a_100000185761_100000708592 [0,2,0,0,0,0|2,0,0]=4 9719 B16R2.137 Brc1cnc(s1)CNc2ccc(cc2)I 270302a_100000185761_100000699580 [0,2,0,0,0,0|2,0,0]=4 9720 B16R2.137 Brc1coc(c1)CNc2ccc(cc2)I 270302a_100000185761_100000747035 [0,2,0,0,0,0|2,0,0]=4 9721 B16R2.137 Brc1csc(c1)CNc2ccc(cc2)I 207a_100000185761_100000211722 [0,2,0,0,0,0|2,0,0]=4 9722 B16R2.137 Brc1csc(c1)CNc2ccc(cc2)I 270302a_100000185761_100000211722 [0,2,0,0,0,0|2,0,0]=4 9723 B16R2.137 Brc1csc(c1)CNc2ccc(cc2)I 34a_100000185761_100000746031 [0,2,0,0,0,0|2,0,0]=4 9724 B16R2.137 Brc1ncc(s1)CNc2ccc(cc2)I 34a_100000185761_100000717027 [0,2,0,0,0,0|1,0,1]=4 9725 B16R2.137 Cc1c[nH]c(n1)CNc2ccc(cc2)Br 207a_100000210018_100000082322 [0,2,0,0,0,0|2,0,0]=4 9726 B16R2.137 Cc1c[nH]c(n1)CNc2ccc(cc2)Cl 207a_100000210052_100000082322 [0,2,0,0,0,0|2,0,0]=4 9727 B16R2.137 Cc1c[nH]c(n1)CNc2ccc(cc2)F 207a_100000185862_100000082322 [0,2,0,0,0,0|2,0,0]=4 9728 B16R2.137 Cc1c[nH]c(n1)CNc2ccc(cc2)I 207a_100000185761_100000082322 [0,2,0,0,0,0|2,0,0]=4 9729 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)Br 207a_100000210018_100011998532 [0,2,0,0,0,0|2,0,0]=4 9730 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)Br 270302a_100000210018_100011998532 [0,2,0,0,0,0|2,0,0]=4 9731 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)Cl 207a_100000210052_100011998532 [0,2,0,0,0,0|2,0,0]=4 9732 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)Cl 270302a_100000210052_100011998532 [0,2,0,0,0,0|2,0,0]=4 9733 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)F 207a_100000185862_100011998532 [0,2,0,0,0,0|2,0,0]=4 9734 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)F 270302a_100000185862_100011998532 [0,2,0,0,0,0|2,0,0]=4 9735 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)I 207a_100000185761_100011998532 [0,2,0,0,0,0|2,0,0]=4 9736 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)I 270302a_100000185761_100011998532 [0,2,0,0,0,0|2,0,0]=4 9737 B16R2.137 Cc1cc(cs1)CNc2ccc(cc2)O 270302a_100000185829_100011998532 [0,2,0,0,0,0|2,0,0]=4 9738 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Br 207a_100000210018_100011217994 [0,2,0,0,0,0|2,0,0]=4 9739 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Br 2230a_100000210018_100000199038 [0,2,0,0,0,0|2,0,0]=4 9740 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Br 34a_100000210018_100000199038 [0,2,0,0,0,0|2,0,0]=4 9741 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Cl 207a_100000210052_100011217994 [0,2,0,0,0,0|2,0,0]=4 9742 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Cl 2230a_100000210052_100000199038 [0,2,0,0,0,0|2,0,0]=4 9743 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)Cl 34a_100000210052_100000199038 [0,2,0,0,0,0|2,0,0]=4 9744 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)F 207a_100000185862_100011217994 [0,2,0,0,0,0|2,0,0]=4 9745 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)F 34a_100000185862_100000199038 [0,2,0,0,0,0|2,0,0]=4 9746 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)I 207a_100000185761_100011217994 [0,2,0,0,0,0|2,0,0]=4 9747 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)I 34a_100000185761_100000199038 [0,2,0,0,0,0|2,0,0]=4 9748 B16R2.137 Cc1cc(no1)CNc2ccc(cc2)O 34a_100000185829_100000199038 [0,2,0,0,0,0|2,0,0]=4 9749 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)Br 207a_100000210018_200000100279 [0,2,0,0,0,0|2,0,0]=4 9750 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)Br 270302a_100000210018_200000100279 [0,2,0,0,0,0|2,0,0]=4 9751 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)Cl 207a_100000210052_200000100279 [0,2,0,0,0,0|2,0,0]=4 9752 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)Cl 270302a_100000210052_200000100279 [0,2,0,0,0,0|2,0,0]=4 9753 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)F 207a_100000185862_200000100279 [0,2,0,0,0,0|2,0,0]=4 9754 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)F 270302a_100000185862_200000100279 [0,2,0,0,0,0|2,0,0]=4 9755 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)I 207a_100000185761_200000100279 [0,2,0,0,0,0|2,0,0]=4 9756 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)I 270302a_100000185761_200000100279 [0,2,0,0,0,0|2,0,0]=4 9757 B16R2.137 Cc1cc(ns1)CNc2ccc(cc2)O 270302a_100000185829_200000100279 [0,2,0,0,0,0|2,0,0]=4 9758 B16R2.137 Cc1ccc(cc1)C=Cc2c[nH]c(n2)C 271570a_100102527916_100009814057 [0,2,0,0,0,0|1,0,1]=4 9759 B16R2.137 Cc1ccc(cc1)C=Cc2cn(cn2)C 271570a_100102527916_100000040308 [0,2,0,0,0,0|1,0,1]=4 9760 B16R2.137 Cc1ccc(cc1)CSc2c[nH]c(n2)C 62a_100000210814_100009814057 [0,2,0,0,0,0|2,0,0]=4 9761 B16R2.137 Cc1ccc(cc1)CSc2c[nH]c(n2)C 62a_100009814057_100000210814 [0,2,0,0,0,0|2,0,0]=4 9762 B16R2.137 Cc1ccc(cc1)CSc2cn(cn2)C 62a_100000040308_100000210814 [0,2,0,0,0,0|2,0,0]=4 9763 B16R2.137 Cc1ccc(cc1)CSc2cn(cn2)C 62a_100000210814_100000040308 [0,2,0,0,0,0|2,0,0]=4 9764 B16R2.137 Cc1ccc(cc1)NCc2c[nH]c(n2)C 207a_100000124888_100011219055 [0,2,0,0,0,0|0,0,0]=2 9765 B16R2.137 Cc1ccc(cc1)NCc2cc(co2)Br 270302a_100000124888_100000747035 [0,2,0,0,0,0|2,0,0]=4 9766 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)Br 207a_100000124888_100000211722 [0,2,0,0,0,0|2,0,0]=4 9767 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)Br 270302a_100000124888_100000211722 [0,2,0,0,0,0|2,0,0]=4 9768 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)Br 34a_100000124888_100000746031 [0,2,0,0,0,0|2,0,0]=4 9769 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)C 207a_100000124888_100102525248 [0,2,0,0,0,0|2,0,0]=4 9770 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)C 270302a_100000124888_100102525248 [0,2,0,0,0,0|2,0,0]=4 9771 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)Cl 207a_100000124888_100000102487 [0,2,0,0,0,0|2,0,0]=4 9772 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)Cl 270302a_100000124888_100000102487 [0,2,0,0,0,0|2,0,0]=4 9773 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)I 207a_100000124888_100010179861 [0,2,0,0,0,0|2,0,0]=4 9774 B16R2.137 Cc1ccc(cc1)NCc2cc(cs2)I 270302a_100000124888_100010179861 [0,2,0,0,0,0|2,0,0]=4 9775 B16R2.137 Cc1ccc(cc1)NCc2cc(on2)C 207a_100000124888_100011217994 [0,2,0,0,0,0|2,0,0]=4 9776 B16R2.137 Cc1ccc(cc1)NCc2cc(on2)C 34a_100000124888_100000199038 [0,2,0,0,0,0|2,0,0]=4 9777 B16R2.137 Cc1ccc(cc1)NCc2cc(sn2)C 207a_100000124888_200000100279 [0,2,0,0,0,0|2,0,0]=4 9778 B16R2.137 Cc1ccc(cc1)NCc2cc(sn2)C 270302a_100000124888_200000100279 [0,2,0,0,0,0|2,0,0]=4 9779 B16R2.137 Cc1ccc(cc1)NCc2ccc(o2)Br 207a_100000124888_100000185145 [0,2,0,0,0,0|2,0,0]=4 9780 B16R2.137 Cc1ccc(cc1)NCc2ccc(o2)C 207a_100000124888_100000183696 [0,2,0,0,0,0|2,0,0]=4 9781 B16R2.137 Cc1ccc(cc1)NCc2ccc(o2)C 270302a_100000124888_100000183696 [0,2,0,0,0,0|2,0,0]=4 9782 B16R2.137 Cc1ccc(cc1)NCc2ccc(o2)Cl 207a_100000124888_100000188459 [0,2,0,0,0,0|2,0,0]=4 9783 B16R2.137 Cc1ccc(cc1)NCc2ccc(o2)I 207a_100000124888_100000186757 [0,2,0,0,0,0|2,0,0]=4 9784 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Br 207a_100000124888_100000179771 [0,2,0,0,0,0|2,0,0]=4 9785 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Br 270302a_100000124888_100000179771 [0,2,0,0,0,0|2,0,0]=4 9786 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Br 34a_100000124888_100000708592 [0,2,0,0,0,0|2,0,0]=4 9787 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)C 207a_100000124888_100000211121 [0,2,0,0,0,0|2,0,0]=4 9788 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)C 270302a_100000124888_100000211121 [0,2,0,0,0,0|2,0,0]=4 9789 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Cl 207a_100000124888_100000242774 [0,2,0,0,0,0|2,0,0]=4 9790 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Cl 270302a_100000124888_100000242774 [0,2,0,0,0,0|2,0,0]=4 9791 B16R2.137 Cc1ccc(cc1)NCc2ccc(s2)Cl 34a_100000124888_100000185097 [0,2,0,0,0,0|2,0,0]=4 9792 B16R2.137 Cc1ccc(cc1)NCc2ccn(n2)C 207a_100000124888_100000750880 [0,2,0,0,0,0|2,0,0]=4 9793 B16R2.137 Cc1ccc(cc1)NCc2ccn(n2)C 270302a_100000124888_100000750880 [0,2,0,0,0,0|2,0,0]=4 9794 B16R2.137 Cc1ccc(cc1)NCc2ccn(n2)C 34a_100000124888_100000726502 [0,2,0,0,0,0|2,0,0]=4 9795 B16R2.137 Cc1ccc(cc1)NCc2cn(cn2)C 207a_100000124888_100000684808 [0,2,0,0,0,0|0,0,0]=2 9796 B16R2.137 Cc1ccc(cc1)NCc2cn(cn2)C 34a_100000124888_100000717665 [0,2,0,0,0,0|0,0,0]=2 9797 B16R2.137 Cc1ccc(cc1)NCc2cn(nn2)C 207a_100000124888_100000749909 [0,2,0,0,0,0|1,0,0]=3 9798 B16R2.137 Cc1ccc(cc1)NCc2cnc(o2)C 207a_100000124888_100000084308 [0,2,0,0,0,0|1,0,1]=4 9799 B16R2.137 Cc1ccc(cc1)NCc2cnc(o2)C 270302a_100000124888_100000084308 [0,2,0,0,0,0|1,0,1]=4 9800 B16R2.137 Cc1ccc(cc1)NCc2cnc(s2)Br 34a_100000124888_100000717027 [0,2,0,0,0,0|1,0,1]=4 9801 B16R2.137 Cc1ccc(cc1)NCc2cnc(s2)C 207a_100000124888_100000740557 [0,2,0,0,0,0|1,0,1]=4 9802 B16R2.137 Cc1ccc(cc1)NCc2cnc(s2)C 34a_100000124888_100020635045 [0,2,0,0,0,0|1,0,1]=4 9803 B16R2.137 Cc1ccc(cc1)NCc2cnc(s2)Cl 34a_100000124888_100000058068 [0,2,0,0,0,0|1,0,1]=4 9804 B16R2.137 Cc1ccc(cc1)NCc2cnn(c2)C 207a_100000124888_100000206001 [0,2,0,0,0,0|2,0,0]=4 9805 B16R2.137 Cc1ccc(cc1)NCc2cnn(c2)C 270302a_100000124888_100000206001 [0,2,0,0,0,0|2,0,0]=4 9806 B16R2.137 Cc1ccc(cc1)NCc2cnn(c2)C 34a_100000124888_100000744441 [0,2,0,0,0,0|2,0,0]=4 9807 B16R2.137 Cc1ccc(cc1)NCc2coc(n2)C 207a_100000124888_100011361629 [0,2,0,0,0,0|1,0,0]=3 9808 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)Br 207a_100000124888_100000737087 [0,2,0,0,0,0|2,0,0]=4 9809 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)Br 270302a_100000124888_100000737087 [0,2,0,0,0,0|2,0,0]=4 9810 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)C 207a_100000124888_100011998532 [0,2,0,0,0,0|2,0,0]=4 9811 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)C 270302a_100000124888_100011998532 [0,2,0,0,0,0|2,0,0]=4 9812 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)Cl 207a_100000124888_100009844934 [0,2,0,0,0,0|2,0,0]=4 9813 B16R2.137 Cc1ccc(cc1)NCc2csc(c2)Cl 270302a_100000124888_100009844934 [0,2,0,0,0,0|2,0,0]=4 9814 B16R2.137 Cc1ccc(cc1)NCc2csc(n2)C 207a_100000124888_100000203724 [0,2,0,0,0,0|1,0,0]=3 9815 B16R2.137 Cc1ccc(cc1)NCc2csc(n2)C 270302a_100000124888_100000203724 [0,2,0,0,0,0|1,0,0]=3 9816 B16R2.137 Cc1ccc(cc1)NCc2csc(n2)C 34a_100000124888_100015186478 [0,2,0,0,0,0|1,0,0]=3 9817 B16R2.137 Cc1ccc(cc1)NCc2csc(n2)Cl 34a_100000124888_100000024076 [0,2,0,0,0,0|1,0,0]=3 9818 B16R2.137 Cc1ccc(cc1)NCc2nc(c[nH]2)C 207a_100000124888_100000082322 [0,2,0,0,0,0|2,0,0]=4 9819 B16R2.137 Cc1ccc(cc1)NCc2nc(cs2)C 207a_100000124888_100000756994 [0,2,0,0,0,0|2,0,0]=4 9820 B16R2.137 Cc1ccc(cc1)NCc2nc(no2)C 34a_100000124888_100000735555 [0,2,0,0,0,0|1,0,1]=4 9821 B16R2.137 Cc1ccc(cc1)NCc2ncc(s2)Br 270302a_100000124888_100000699580 [0,2,0,0,0,0|2,0,0]=4 9822 B16R2.137 Cc1ccc(cc1)NCc2ncc(s2)C 207a_100000124888_100011361622 [0,2,0,0,0,0|2,0,0]=4 9823 B16R2.137 Cc1ccc(cc1)NCc2ncc(s2)C 270302a_100000124888_100011361622 [0,2,0,0,0,0|2,0,0]=4 9824 B16R2.137 Cc1ccc(cc1)NCc2ncc(s2)Cl 270302a_100000124888_100000699884 [0,2,0,0,0,0|2,0,0]=4 9825 B16R2.137 Cc1ccc(cc1)NCc2ncn(n2)C 207a_100000124888_100010630104 [0,2,0,0,0,0|1,0,0]=3 9826 B16R2.137 Cc1ccc(cc1)NCc2ncn(n2)C 34a_100000124888_100016995526 [0,2,0,0,0,0|1,0,0]=3 9827 B16R2.137 Cc1ccc(cc1)NCc2noc(n2)C 34a_100000124888_100000231061 [0,2,0,0,0,0|2,0,0]=4 9828 B16R2.137 Cc1ccc(cc1)NCc2nsc(n2)Cl 34a_100000124888_100000043760 [0,2,0,0,0,0|2,0,0]=4 9829 B16R2.137 Cc1ccc(cc1)OCc2cn(cn2)C 34a_100000210336_100000717665 [0,2,0,0,0,0|1,0,0]=3 9830 B16R2.137 Cc1ccc(cc1)OCc2cn(cn2)C 7a_100000210336_100000717665 [0,2,0,0,0,0|1,0,0]=3 9831 B16R2.137 Cc1ccc(cc1)OCc2csc(n2)C 34a_100000210336_100015186478 [0,2,0,0,0,0|2,0,0]=4 9832 B16R2.137 Cc1ccc(cc1)OCc2csc(n2)C 7a_100000210336_100015186478 [0,2,0,0,0,0|2,0,0]=4 9833 B16R2.137 Cc1ccc(cc1)OCc2csc(n2)Cl 34a_100000210336_100000024076 [0,2,0,0,0,0|2,0,0]=4 9834 B16R2.137 Cc1ccc(cc1)OCc2csc(n2)Cl 7a_100000210336_100000024076 [0,2,0,0,0,0|2,0,0]=4 9835 B16R2.137 Cc1ccc(cc1)OCc2ncn(n2)C 34a_100000210336_100016995526 [0,2,0,0,0,0|2,0,0]=4 9836 B16R2.137 Cc1ccc(cc1)OCc2ncn(n2)C 7a_100000210336_100016995526 [0,2,0,0,0,0|2,0,0]=4 9837 B16R2.137 Cc1ccc(cc1)SCc2cn(cn2)C 62a_100000186775_100000717665 [0,2,0,0,0,0|1,0,0]=3 9838 B16R2.137 Cc1ccc(cc1)SCc2cn(cn2)C 62a_100000717665_100000186775 [0,2,0,0,0,0|1,0,0]=3 9839 B16R2.137 Cc1ccc(cc1)SCc2csc(n2)C 62a_100000186775_100015186478 [0,2,0,0,0,0|2,0,0]=4 9840 B16R2.137 Cc1ccc(cc1)SCc2csc(n2)C 62a_100015186478_100000186775 [0,2,0,0,0,0|2,0,0]=4 9841 B16R2.137 Cc1ccc(cc1)SCc2csc(n2)Cl 62a_100000024076_100000186775 [0,2,0,0,0,0|2,0,0]=4 9842 B16R2.137 Cc1ccc(cc1)SCc2csc(n2)Cl 62a_100000186775_100000024076 [0,2,0,0,0,0|2,0,0]=4 9843 B16R2.137 Cc1ccc(cc1)SCc2ncn(n2)C 62a_100000186775_100016995526 [0,2,0,0,0,0|2,0,0]=4 9844 B16R2.137 Cc1ccc(cc1)SCc2ncn(n2)C 62a_100016995526_100000186775 [0,2,0,0,0,0|2,0,0]=4 9845 B16R2.137 Cc1ccc(cn1)OCc2cn(cn2)C 34a_100000745506_100000717665 [0,2,0,0,0,0|2,0,0]=4 9846 B16R2.137 Cc1ccc(cn1)OCc2cn(cn2)C 7a_100000745506_100000717665 [0,2,0,0,0,0|2,0,0]=4 9847 B16R2.137 Cc1ccc(cn1)SCc2cn(cn2)C 62a_100000717665_100000751577 [0,2,0,0,0,0|2,0,0]=4 9848 B16R2.137 Cc1ccc(cn1)SCc2cn(cn2)C 62a_100000751577_100000717665 [0,2,0,0,0,0|2,0,0]=4 9849 B16R2.137 Cc1ccc(nc1)OCc2cn(cn2)C 34a_100000759353_100000717665 [0,2,0,0,0,0|2,0,0]=4 9850 B16R2.137 Cc1ccc(nc1)SCc2cn(cn2)C 62a_100000717665_100000754016 [0,2,0,0,0,0|2,0,0]=4 9851 B16R2.137 Cc1ccc(nc1)SCc2cn(cn2)C 62a_100011192072_100000717665 [0,2,0,0,0,0|2,0,0]=4 9852 B16R2.137 Cc1ccc(nn1)NCc2cn(cn2)C 27a_100011834058_100000744512 [0,2,0,0,0,0|2,0,0]=4 9853 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)Br 207a_100000210018_100000183696 [0,2,0,0,0,0|2,0,0]=4 9854 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)Br 270302a_100000210018_100000183696 [0,2,0,0,0,0|2,0,0]=4 9855 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)Cl 207a_100000210052_100000183696 [0,2,0,0,0,0|2,0,0]=4 9856 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)Cl 270302a_100000210052_100000183696 [0,2,0,0,0,0|2,0,0]=4 9857 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)F 207a_100000185862_100000183696 [0,2,0,0,0,0|2,0,0]=4 9858 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)F 270302a_100000185862_100000183696 [0,2,0,0,0,0|2,0,0]=4 9859 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)I 207a_100000185761_100000183696 [0,2,0,0,0,0|2,0,0]=4 9860 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)I 270302a_100000185761_100000183696 [0,2,0,0,0,0|2,0,0]=4 9861 B16R2.137 Cc1ccc(o1)CNc2ccc(cc2)O 270302a_100000185829_100000183696 [0,2,0,0,0,0|2,0,0]=4 9862 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)Br 207a_100000210018_100000211121 [0,2,0,0,0,0|2,0,0]=4 9863 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)Br 270302a_100000210018_100000211121 [0,2,0,0,0,0|2,0,0]=4 9864 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)Cl 207a_100000210052_100000211121 [0,2,0,0,0,0|2,0,0]=4 9865 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)Cl 270302a_100000210052_100000211121 [0,2,0,0,0,0|2,0,0]=4 9866 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)F 207a_100000185862_100000211121 [0,2,0,0,0,0|2,0,0]=4 9867 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)F 270302a_100000185862_100000211121 [0,2,0,0,0,0|2,0,0]=4 9868 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)I 207a_100000185761_100000211121 [0,2,0,0,0,0|2,0,0]=4 9869 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)I 270302a_100000185761_100000211121 [0,2,0,0,0,0|2,0,0]=4 9870 B16R2.137 Cc1ccc(s1)CNc2ccc(cc2)O 270302a_100000185829_100000211121 [0,2,0,0,0,0|2,0,0]=4 9871 B16R2.137 Cc1cnc(cn1)NCc2cn(cn2)C 27a_100011834058_100000074397 [0,2,0,0,0,0|2,0,0]=4 9872 B16R2.137 Cc1cnc(nc1)NCc2cn(cn2)C 27a_100011834058_100000061069 [0,2,0,0,0,0|2,0,0]=4 9873 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)Br 207a_100000210018_100011361622 [0,2,0,0,0,0|2,0,0]=4 9874 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)Br 270302a_100000210018_100011361622 [0,2,0,0,0,0|2,0,0]=4 9875 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)Cl 207a_100000210052_100011361622 [0,2,0,0,0,0|2,0,0]=4 9876 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)Cl 270302a_100000210052_100011361622 [0,2,0,0,0,0|2,0,0]=4 9877 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)F 207a_100000185862_100011361622 [0,2,0,0,0,0|2,0,0]=4 9878 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)F 270302a_100000185862_100011361622 [0,2,0,0,0,0|2,0,0]=4 9879 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)I 207a_100000185761_100011361622 [0,2,0,0,0,0|2,0,0]=4 9880 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)I 270302a_100000185761_100011361622 [0,2,0,0,0,0|2,0,0]=4 9881 B16R2.137 Cc1cnc(s1)CNc2ccc(cc2)O 270302a_100000185829_100011361622 [0,2,0,0,0,0|2,0,0]=4 9882 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)Br 207a_100000210018_100102525248 [0,2,0,0,0,0|2,0,0]=4 9883 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)Br 270302a_100000210018_100102525248 [0,2,0,0,0,0|2,0,0]=4 9884 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)Cl 207a_100000210052_100102525248 [0,2,0,0,0,0|2,0,0]=4 9885 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)Cl 270302a_100000210052_100102525248 [0,2,0,0,0,0|2,0,0]=4 9886 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)F 207a_100000185862_100102525248 [0,2,0,0,0,0|2,0,0]=4 9887 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)F 270302a_100000185862_100102525248 [0,2,0,0,0,0|2,0,0]=4 9888 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)I 207a_100000185761_100102525248 [0,2,0,0,0,0|2,0,0]=4 9889 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)I 270302a_100000185761_100102525248 [0,2,0,0,0,0|2,0,0]=4 9890 B16R2.137 Cc1csc(c1)CNc2ccc(cc2)O 270302a_100000185829_100102525248 [0,2,0,0,0,0|2,0,0]=4 9891 B16R2.137 Cc1csc(n1)CNc2ccc(cc2)Br 207a_100000210018_100000756994 [0,2,0,0,0,0|2,0,0]=4 9892 B16R2.137 Cc1csc(n1)CNc2ccc(cc2)Cl 207a_100000210052_100000756994 [0,2,0,0,0,0|2,0,0]=4 9893 B16R2.137 Cc1csc(n1)CNc2ccc(cc2)F 207a_100000185862_100000756994 [0,2,0,0,0,0|2,0,0]=4 9894 B16R2.137 Cc1csc(n1)CNc2ccc(cc2)I 207a_100000185761_100000756994 [0,2,0,0,0,0|2,0,0]=4 9895 B16R2.137 Cc1nc(c[nH]1)C=Cc2ccc(cc2)Br 271570a_100102527914_100009814057 [0,2,0,0,0,0|1,0,1]=4 9896 B16R2.137 Cc1nc(c[nH]1)C=Cc2ccc(cc2)Cl 271570a_100102527930_100009814057 [0,2,0,0,0,0|1,0,1]=4 9897 B16R2.137 Cc1nc(c[nH]1)C=Cc2ccc(cc2)F 271570a_100102525539_100009814057 [0,2,0,0,0,0|1,0,1]=4 9898 B16R2.137 Cc1nc(c[nH]1)CNc2ccc(cc2)Br 207a_100000210018_100011219055 [0,2,0,0,0,0|0,0,0]=2 9899 B16R2.137 Cc1nc(c[nH]1)CNc2ccc(cc2)Cl 207a_100000210052_100011219055 [0,2,0,0,0,0|0,0,0]=2 9900 B16R2.137 Cc1nc(c[nH]1)CNc2ccc(cc2)F 207a_100000185862_100011219055 [0,2,0,0,0,0|0,0,0]=2 9901 B16R2.137 Cc1nc(c[nH]1)CNc2ccc(cc2)I 207a_100000185761_100011219055 [0,2,0,0,0,0|0,0,0]=2 9902 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)Br 62a_100000189115_100009814057 [0,2,0,0,0,0|2,0,0]=4 9903 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)Br 62a_100009814057_100000189115 [0,2,0,0,0,0|2,0,0]=4 9904 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)Cl 62a_100000187161_100009814057 [0,2,0,0,0,0|2,0,0]=4 9905 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)Cl 62a_100009814057_100000187161 [0,2,0,0,0,0|2,0,0]=4 9906 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)F 62a_100000198546_100009814057 [0,2,0,0,0,0|2,0,0]=4 9907 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)F 62a_100009814057_100000187164 [0,2,0,0,0,0|2,0,0]=4 9908 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)I 62a_100000189116_100009814057 [0,2,0,0,0,0|2,0,0]=4 9909 B16R2.137 Cc1nc(c[nH]1)SCc2ccc(cc2)I 62a_100009814057_100000189116 [0,2,0,0,0,0|2,0,0]=4 9910 B16R2.137 Cc1nc(co1)CNc2ccc(cc2)Br 207a_100000210018_100011361629 [0,2,0,0,0,0|1,0,0]=3 9911 B16R2.137 Cc1nc(co1)CNc2ccc(cc2)Cl 207a_100000210052_100011361629 [0,2,0,0,0,0|1,0,0]=3 9912 B16R2.137 Cc1nc(co1)CNc2ccc(cc2)F 207a_100000185862_100011361629 [0,2,0,0,0,0|1,0,0]=3 9913 B16R2.137 Cc1nc(co1)CNc2ccc(cc2)I 207a_100000185761_100011361629 [0,2,0,0,0,0|1,0,0]=3 9914 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Br 207a_100000210018_100000203724 [0,2,0,0,0,0|1,0,0]=3 9915 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Br 2230a_100000210018_100015186478 [0,2,0,0,0,0|1,0,0]=3 9916 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Br 270302a_100000210018_100000203724 [0,2,0,0,0,0|1,0,0]=3 9917 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Br 34a_100000210018_100015186478 [0,2,0,0,0,0|1,0,0]=3 9918 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Cl 207a_100000210052_100000203724 [0,2,0,0,0,0|1,0,0]=3 9919 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Cl 2230a_100000210052_100015186478 [0,2,0,0,0,0|1,0,0]=3 9920 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Cl 270302a_100000210052_100000203724 [0,2,0,0,0,0|1,0,0]=3 9921 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)Cl 34a_100000210052_100015186478 [0,2,0,0,0,0|1,0,0]=3 9922 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)F 207a_100000185862_100000203724 [0,2,0,0,0,0|1,0,0]=3 9923 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)F 270302a_100000185862_100000203724 [0,2,0,0,0,0|1,0,0]=3 9924 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)F 34a_100000185862_100015186478 [0,2,0,0,0,0|1,0,0]=3 9925 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)I 207a_100000185761_100000203724 [0,2,0,0,0,0|1,0,0]=3 9926 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)I 270302a_100000185761_100000203724 [0,2,0,0,0,0|1,0,0]=3 9927 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)I 34a_100000185761_100015186478 [0,2,0,0,0,0|1,0,0]=3 9928 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)O 270302a_100000185829_100000203724 [0,2,0,0,0,0|1,0,0]=3 9929 B16R2.137 Cc1nc(cs1)CNc2ccc(cc2)O 34a_100000185829_100015186478 [0,2,0,0,0,0|1,0,0]=3 9930 B16R2.137 Cc1nc(cs1)CNc2ccc(cn2)Br 27a_100000707933_100000686858 [0,2,0,0,0,0|2,0,0]=4 9931 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)Br 34a_100000185759_100015186478 [0,2,0,0,0,0|2,0,0]=4 9932 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)Br 7a_100000185759_100015186478 [0,2,0,0,0,0|2,0,0]=4 9933 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)Cl 34a_100000210216_100015186478 [0,2,0,0,0,0|2,0,0]=4 9934 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)Cl 7a_100000210216_100015186478 [0,2,0,0,0,0|2,0,0]=4 9935 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)F 34a_100000210339_100015186478 [0,2,0,0,0,0|2,0,0]=4 9936 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)I 34a_100000212066_100015186478 [0,2,0,0,0,0|2,0,0]=4 9937 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)I 7a_100000212066_100015186478 [0,2,0,0,0,0|2,0,0]=4 9938 B16R2.137 Cc1nc(cs1)COc2ccc(cc2)N 34a_100000185829_100015186478 [0,2,0,0,0,0|2,0,0]=4 9939 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)Br 62a_100000752885_100015186478 [0,2,0,0,0,0|2,0,0]=4 9940 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)Br 62a_100015186478_100000752885 [0,2,0,0,0,0|2,0,0]=4 9941 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)Cl 62a_100000755918_100015186478 [0,2,0,0,0,0|2,0,0]=4 9942 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)Cl 62a_100015186478_100000755918 [0,2,0,0,0,0|2,0,0]=4 9943 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)F 62a_100000211213_100015186478 [0,2,0,0,0,0|2,0,0]=4 9944 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)F 62a_100015186478_100000211213 [0,2,0,0,0,0|2,0,0]=4 9945 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)N 62a_100000185761_100015186478 [0,2,0,0,0,0|2,0,0]=4 9946 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)N 62a_100015186478_100000185761 [0,2,0,0,0,0|2,0,0]=4 9947 B16R2.137 Cc1nc(cs1)CSc2ccc(cc2)O 62a_100015186478_100000185759 [0,2,0,0,0,0|2,0,0]=4 9948 B16R2.137 Cc1nc(n[nH]1)CNc2ccc(cn2)Br 27a_100000752542_100000686858 [0,2,0,0,0,0|2,0,0]=4 9949 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)Br 2230a_100000210018_100000231061 [0,2,0,0,0,0|2,0,0]=4 9950 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)Br 34a_100000210018_100000231061 [0,2,0,0,0,0|2,0,0]=4 9951 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)Cl 2230a_100000210052_100000231061 [0,2,0,0,0,0|2,0,0]=4 9952 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)Cl 34a_100000210052_100000231061 [0,2,0,0,0,0|2,0,0]=4 9953 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)F 34a_100000185862_100000231061 [0,2,0,0,0,0|2,0,0]=4 9954 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)I 34a_100000185761_100000231061 [0,2,0,0,0,0|2,0,0]=4 9955 B16R2.137 Cc1nc(no1)CNc2ccc(cc2)O 34a_100000185829_100000231061 [0,2,0,0,0,0|2,0,0]=4 9956 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)Br 207a_100000210018_100000084308 [0,2,0,0,0,0|1,0,1]=4 9957 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)Br 270302a_100000210018_100000084308 [0,2,0,0,0,0|1,0,1]=4 9958 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)Cl 207a_100000210052_100000084308 [0,2,0,0,0,0|1,0,1]=4 9959 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)Cl 270302a_100000210052_100000084308 [0,2,0,0,0,0|1,0,1]=4 9960 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)F 207a_100000185862_100000084308 [0,2,0,0,0,0|1,0,1]=4 9961 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)F 270302a_100000185862_100000084308 [0,2,0,0,0,0|1,0,1]=4 9962 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)I 207a_100000185761_100000084308 [0,2,0,0,0,0|1,0,1]=4 9963 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)I 270302a_100000185761_100000084308 [0,2,0,0,0,0|1,0,1]=4 9964 B16R2.137 Cc1ncc(o1)CNc2ccc(cc2)O 270302a_100000185829_100000084308 [0,2,0,0,0,0|1,0,1]=4 9965 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Br 207a_100000210018_100000740557 [0,2,0,0,0,0|1,0,1]=4 9966 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Br 2230a_100000210018_100020635045 [0,2,0,0,0,0|1,0,1]=4 9967 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Br 34a_100000210018_100020635045 [0,2,0,0,0,0|1,0,1]=4 9968 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Cl 207a_100000210052_100000740557 [0,2,0,0,0,0|1,0,1]=4 9969 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Cl 2230a_100000210052_100020635045 [0,2,0,0,0,0|1,0,1]=4 9970 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)Cl 34a_100000210052_100020635045 [0,2,0,0,0,0|1,0,1]=4 9971 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)F 207a_100000185862_100000740557 [0,2,0,0,0,0|1,0,1]=4 9972 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)F 34a_100000185862_100020635045 [0,2,0,0,0,0|1,0,1]=4 9973 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)I 207a_100000185761_100000740557 [0,2,0,0,0,0|1,0,1]=4 9974 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)I 34a_100000185761_100020635045 [0,2,0,0,0,0|1,0,1]=4 9975 B16R2.137 Cc1ncc(s1)CNc2ccc(cc2)O 34a_100000185829_100020635045 [0,2,0,0,0,0|1,0,1]=4 9976 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)Br 2230a_100000210018_100000735555 [0,2,0,0,0,0|1,0,1]=4 9977 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)Br 34a_100000210018_100000735555 [0,2,0,0,0,0|1,0,1]=4 9978 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)Cl 2230a_100000210052_100000735555 [0,2,0,0,0,0|1,0,1]=4 9979 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)Cl 34a_100000210052_100000735555 [0,2,0,0,0,0|1,0,1]=4 9980 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)F 34a_100000185862_100000735555 [0,2,0,0,0,0|1,0,1]=4 9981 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)I 34a_100000185761_100000735555 [0,2,0,0,0,0|1,0,1]=4 9982 B16R2.137 Cc1noc(n1)CNc2ccc(cc2)O 34a_100000185829_100000735555 [0,2,0,0,0,0|1,0,1]=4 9983 B16R2.137 Clc1cc(cs1)CNc2ccc(cc2)Br 207a_100000210018_100009844934 [0,2,0,0,0,0|2,0,0]=4 9984 B16R2.137 Clc1cc(cs1)CNc2ccc(cc2)Br 270302a_100000210018_100009844934 [0,2,0,0,0,0|2,0,0]=4 9985 B16R2.137 Clc1cc(cs1)CNc2ccc(cc2)I 207a_100000185761_100009844934 [0,2,0,0,0,0|2,0,0]=4 9986 B16R2.137 Clc1cc(cs1)CNc2ccc(cc2)I 270302a_100000185761_100009844934 [0,2,0,0,0,0|2,0,0]=4 9987 B16R2.137 Clc1ccc(cc1)NCc2cc(co2)Br 270302a_100000210052_100000747035 [0,2,0,0,0,0|2,0,0]=4 9988 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Br 207a_100000210052_100000211722 [0,2,0,0,0,0|2,0,0]=4 9989 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Br 2230a_100000210052_100000746031 [0,2,0,0,0,0|2,0,0]=4 9990 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Br 270302a_100000210052_100000211722 [0,2,0,0,0,0|2,0,0]=4 9991 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Br 34a_100000210052_100000746031 [0,2,0,0,0,0|2,0,0]=4 9992 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Cl 207a_100000210052_100000102487 [0,2,0,0,0,0|2,0,0]=4 9993 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)Cl 270302a_100000210052_100000102487 [0,2,0,0,0,0|2,0,0]=4 9994 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)I 207a_100000210052_100010179861 [0,2,0,0,0,0|2,0,0]=4 9995 B16R2.137 Clc1ccc(cc1)NCc2cc(cs2)I 270302a_100000210052_100010179861 [0,2,0,0,0,0|2,0,0]=4 9996 B16R2.137 Clc1ccc(cc1)NCc2ccc(o2)Br 207a_100000210052_100000185145 [0,2,0,0,0,0|2,0,0]=4 9997 B16R2.137 Clc1ccc(cc1)NCc2ccc(o2)Cl 207a_100000210052_100000188459 [0,2,0,0,0,0|2,0,0]=4 9998 B16R2.137 Clc1ccc(cc1)NCc2ccc(o2)I 207a_100000210052_100000186757 [0,2,0,0,0,0|2,0,0]=4 9999 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Br 207a_100000210052_100000179771 [0,2,0,0,0,0|2,0,0]=4 10000 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Br 2230a_100000210052_100000708592 [0,2,0,0,0,0|2,0,0]=4 10001 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Br 270302a_100000210052_100000179771 [0,2,0,0,0,0|2,0,0]=4 10002 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Br 34a_100000210052_100000708592 [0,2,0,0,0,0|2,0,0]=4 10003 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Cl 207a_100000210052_100000242774 [0,2,0,0,0,0|2,0,0]=4 10004 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Cl 2230a_100000210052_100000185097 [0,2,0,0,0,0|2,0,0]=4 10005 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Cl 270302a_100000210052_100000242774 [0,2,0,0,0,0|2,0,0]=4 10006 B16R2.137 Clc1ccc(cc1)NCc2ccc(s2)Cl 34a_100000210052_100000185097 [0,2,0,0,0,0|2,0,0]=4 10007 B16R2.137 Clc1ccc(cc1)NCc2cnc(s2)Br 2230a_100000210052_100000717027 [0,2,0,0,0,0|1,0,1]=4 10008 B16R2.137 Clc1ccc(cc1)NCc2cnc(s2)Br 34a_100000210052_100000717027 [0,2,0,0,0,0|1,0,1]=4 10009 B16R2.137 Clc1ccc(cc1)NCc2cnc(s2)Cl 2230a_100000210052_100000058068 [0,2,0,0,0,0|1,0,1]=4 10010 B16R2.137 Clc1ccc(cc1)NCc2cnc(s2)Cl 34a_100000210052_100000058068 [0,2,0,0,0,0|1,0,1]=4 10011 B16R2.137 Clc1ccc(cc1)NCc2csc(c2)Br 207a_100000210052_100000737087 [0,2,0,0,0,0|2,0,0]=4 10012 B16R2.137 Clc1ccc(cc1)NCc2csc(c2)Br 270302a_100000210052_100000737087 [0,2,0,0,0,0|2,0,0]=4 10013 B16R2.137 Clc1ccc(cc1)NCc2csc(c2)Cl 207a_100000210052_100009844934 [0,2,0,0,0,0|2,0,0]=4 10014 B16R2.137 Clc1ccc(cc1)NCc2csc(c2)Cl 270302a_100000210052_100009844934 [0,2,0,0,0,0|2,0,0]=4 10015 B16R2.137 Clc1ccc(cc1)NCc2csc(n2)Cl 2230a_100000210052_100000024076 [0,2,0,0,0,0|1,0,0]=3 10016 B16R2.137 Clc1ccc(cc1)NCc2csc(n2)Cl 34a_100000210052_100000024076 [0,2,0,0,0,0|1,0,0]=3 10017 B16R2.137 Clc1ccc(cc1)NCc2ncc(s2)Br 270302a_100000210052_100000699580 [0,2,0,0,0,0|2,0,0]=4 10018 B16R2.137 Clc1ccc(cc1)NCc2ncc(s2)Cl 270302a_100000210052_100000699884 [0,2,0,0,0,0|2,0,0]=4 10019 B16R2.137 Clc1ccc(cc1)NCc2nsc(n2)Cl 2230a_100000210052_100000043760 [0,2,0,0,0,0|2,0,0]=4 10020 B16R2.137 Clc1ccc(cc1)NCc2nsc(n2)Cl 34a_100000210052_100000043760 [0,2,0,0,0,0|2,0,0]=4 10021 B16R2.137 Clc1ccc(cc1)OCc2csc(n2)Cl 34a_100000210216_100000024076 [0,2,0,0,0,0|2,0,0]=4 10022 B16R2.137 Clc1ccc(cc1)OCc2csc(n2)Cl 7a_100000210216_100000024076 [0,2,0,0,0,0|2,0,0]=4 10023 B16R2.137 Clc1ccc(cc1)SCc2csc(n2)Cl 62a_100000024076_100000755918 [0,2,0,0,0,0|2,0,0]=4 10024 B16R2.137 Clc1ccc(cc1)SCc2csc(n2)Cl 62a_100000755918_100000024076 [0,2,0,0,0,0|2,0,0]=4 10025 B16R2.137 Clc1ccc(o1)CNc2ccc(cc2)Br 207a_100000210018_100000188459 [0,2,0,0,0,0|2,0,0]=4 10026 B16R2.137 Clc1ccc(o1)CNc2ccc(cc2)I 207a_100000185761_100000188459 [0,2,0,0,0,0|2,0,0]=4 10027 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)Br 207a_100000210018_100000242774 [0,2,0,0,0,0|2,0,0]=4 10028 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)Br 2230a_100000210018_100000185097 [0,2,0,0,0,0|2,0,0]=4 10029 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)Br 270302a_100000210018_100000242774 [0,2,0,0,0,0|2,0,0]=4 10030 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)Br 34a_100000210018_100000185097 [0,2,0,0,0,0|2,0,0]=4 10031 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)I 207a_100000185761_100000242774 [0,2,0,0,0,0|2,0,0]=4 10032 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)I 270302a_100000185761_100000242774 [0,2,0,0,0,0|2,0,0]=4 10033 B16R2.137 Clc1ccc(s1)CNc2ccc(cc2)I 34a_100000185761_100000185097 [0,2,0,0,0,0|2,0,0]=4 10034 B16R2.137 Clc1cnc(s1)CNc2ccc(cc2)Br 270302a_100000210018_100000699884 [0,2,0,0,0,0|2,0,0]=4 10035 B16R2.137 Clc1cnc(s1)CNc2ccc(cc2)I 270302a_100000185761_100000699884 [0,2,0,0,0,0|2,0,0]=4 10036 B16R2.137 Clc1csc(c1)CNc2ccc(cc2)Br 207a_100000210018_100000102487 [0,2,0,0,0,0|2,0,0]=4 10037 B16R2.137 Clc1csc(c1)CNc2ccc(cc2)Br 270302a_100000210018_100000102487 [0,2,0,0,0,0|2,0,0]=4 10038 B16R2.137 Clc1csc(c1)CNc2ccc(cc2)I 207a_100000185761_100000102487 [0,2,0,0,0,0|2,0,0]=4 10039 B16R2.137 Clc1csc(c1)CNc2ccc(cc2)I 270302a_100000185761_100000102487 [0,2,0,0,0,0|2,0,0]=4 10040 B16R2.137 Clc1nc(cs1)CNc2ccc(cc2)Br 2230a_100000210018_100000024076 [0,2,0,0,0,0|1,0,0]=3 10041 B16R2.137 Clc1nc(cs1)CNc2ccc(cc2)Br 34a_100000210018_100000024076 [0,2,0,0,0,0|1,0,0]=3 10042 B16R2.137 Clc1nc(cs1)CNc2ccc(cc2)I 34a_100000185761_100000024076 [0,2,0,0,0,0|1,0,0]=3 10043 B16R2.137 Clc1nc(cs1)COc2ccc(cc2)Br 34a_100000185759_100000024076 [0,2,0,0,0,0|2,0,0]=4 10044 B16R2.137 Clc1nc(cs1)COc2ccc(cc2)Br 7a_100000185759_100000024076 [0,2,0,0,0,0|2,0,0]=4 10045 B16R2.137 Clc1nc(cs1)COc2ccc(cc2)I 34a_100000212066_100000024076 [0,2,0,0,0,0|2,0,0]=4 10046 B16R2.137 Clc1nc(cs1)COc2ccc(cc2)I 7a_100000212066_100000024076 [0,2,0,0,0,0|2,0,0]=4 10047 B16R2.137 Clc1nc(cs1)CSc2ccc(cc2)Br 62a_100000024076_100000752885 [0,2,0,0,0,0|2,0,0]=4 10048 B16R2.137 Clc1nc(cs1)CSc2ccc(cc2)Br 62a_100000752885_100000024076 [0,2,0,0,0,0|2,0,0]=4 10049 B16R2.137 Clc1nc(ns1)CNc2ccc(cc2)Br 2230a_100000210018_100000043760 [0,2,0,0,0,0|2,0,0]=4 10050 B16R2.137 Clc1nc(ns1)CNc2ccc(cc2)Br 34a_100000210018_100000043760 [0,2,0,0,0,0|2,0,0]=4 10051 B16R2.137 Clc1nc(ns1)CNc2ccc(cc2)I 34a_100000185761_100000043760 [0,2,0,0,0,0|2,0,0]=4 10052 B16R2.137 Clc1ncc(s1)CNc2ccc(cc2)Br 2230a_100000210018_100000058068 [0,2,0,0,0,0|1,0,1]=4 10053 B16R2.137 Clc1ncc(s1)CNc2ccc(cc2)Br 34a_100000210018_100000058068 [0,2,0,0,0,0|1,0,1]=4 10054 B16R2.137 Clc1ncc(s1)CNc2ccc(cc2)I 34a_100000185761_100000058068 [0,2,0,0,0,0|1,0,1]=4 10055 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Br 207a_100000210018_100000206001 [0,2,0,0,0,0|2,0,0]=4 10056 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Br 2230a_100000210018_100000744441 [0,2,0,0,0,0|2,0,0]=4 10057 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Br 270302a_100000210018_100000206001 [0,2,0,0,0,0|2,0,0]=4 10058 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Br 34a_100000210018_100000744441 [0,2,0,0,0,0|2,0,0]=4 10059 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Cl 207a_100000210052_100000206001 [0,2,0,0,0,0|2,0,0]=4 10060 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Cl 2230a_100000210052_100000744441 [0,2,0,0,0,0|2,0,0]=4 10061 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Cl 270302a_100000210052_100000206001 [0,2,0,0,0,0|2,0,0]=4 10062 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)Cl 34a_100000210052_100000744441 [0,2,0,0,0,0|2,0,0]=4 10063 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)F 207a_100000185862_100000206001 [0,2,0,0,0,0|2,0,0]=4 10064 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)F 270302a_100000185862_100000206001 [0,2,0,0,0,0|2,0,0]=4 10065 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)F 34a_100000185862_100000744441 [0,2,0,0,0,0|2,0,0]=4 10066 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)I 207a_100000185761_100000206001 [0,2,0,0,0,0|2,0,0]=4 10067 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)I 270302a_100000185761_100000206001 [0,2,0,0,0,0|2,0,0]=4 10068 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)I 34a_100000185761_100000744441 [0,2,0,0,0,0|2,0,0]=4 10069 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)O 270302a_100000185829_100000206001 [0,2,0,0,0,0|2,0,0]=4 10070 B16R2.137 Cn1cc(cn1)CNc2ccc(cc2)O 34a_100000185829_100000744441 [0,2,0,0,0,0|2,0,0]=4 10071 B16R2.137 Cn1cc(nn1)CNc2ccc(cc2)Br 207a_100000210018_100000749909 [0,2,0,0,0,0|1,0,0]=3 10072 B16R2.137 Cn1cc(nn1)CNc2ccc(cc2)Cl 207a_100000210052_100000749909 [0,2,0,0,0,0|1,0,0]=3 10073 B16R2.137 Cn1cc(nn1)CNc2ccc(cc2)F 207a_100000185862_100000749909 [0,2,0,0,0,0|1,0,0]=3 10074 B16R2.137 Cn1cc(nn1)CNc2ccc(cc2)I 207a_100000185761_100000749909 [0,2,0,0,0,0|1,0,0]=3 10075 B16R2.137 Cn1cc(nn1)COc2ccc(cc2)Br 274090a_200000210301_100000172629 [0,2,0,0,0,0|2,0,0]=4 10076 B16R2.137 Cn1cc(nn1)COc2ccc(cc2)Cl 274090a_200000210301_100000172631 [0,2,0,0,0,0|2,0,0]=4 10077 B16R2.137 Cn1cc(nn1)COc2ccc(cc2)F 274090a_200000210301_100000172637 [0,2,0,0,0,0|2,0,0]=4 10078 B16R2.137 Cn1cc(nn1)COc2ccc(cc2)I 274090a_200000210301_100000172739 [0,2,0,0,0,0|2,0,0]=4 10079 B16R2.137 Cn1cc(nn1)COc2ccc(cc2)N 274090a_200000210301_100000753246 [0,2,0,0,0,0|2,0,0]=4 10080 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Br 207a_100000210018_100000750880 [0,2,0,0,0,0|2,0,0]=4 10081 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Br 2230a_100000210018_100000726502 [0,2,0,0,0,0|2,0,0]=4 10082 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Br 270302a_100000210018_100000750880 [0,2,0,0,0,0|2,0,0]=4 10083 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Br 34a_100000210018_100000726502 [0,2,0,0,0,0|2,0,0]=4 10084 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Cl 207a_100000210052_100000750880 [0,2,0,0,0,0|2,0,0]=4 10085 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Cl 2230a_100000210052_100000726502 [0,2,0,0,0,0|2,0,0]=4 10086 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Cl 270302a_100000210052_100000750880 [0,2,0,0,0,0|2,0,0]=4 10087 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)Cl 34a_100000210052_100000726502 [0,2,0,0,0,0|2,0,0]=4 10088 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)F 207a_100000185862_100000750880 [0,2,0,0,0,0|2,0,0]=4 10089 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)F 270302a_100000185862_100000750880 [0,2,0,0,0,0|2,0,0]=4 10090 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)F 34a_100000185862_100000726502 [0,2,0,0,0,0|2,0,0]=4 10091 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)I 207a_100000185761_100000750880 [0,2,0,0,0,0|2,0,0]=4 10092 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)I 270302a_100000185761_100000750880 [0,2,0,0,0,0|2,0,0]=4 10093 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)I 34a_100000185761_100000726502 [0,2,0,0,0,0|2,0,0]=4 10094 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)O 270302a_100000185829_100000750880 [0,2,0,0,0,0|2,0,0]=4 10095 B16R2.137 Cn1ccc(n1)CNc2ccc(cc2)O 34a_100000185829_100000726502 [0,2,0,0,0,0|2,0,0]=4 10096 B16R2.137 Cn1cnc(c1)C=Cc2ccc(cc2)Br 271570a_100102527914_100000040308 [0,2,0,0,0,0|1,0,1]=4 10097 B16R2.137 Cn1cnc(c1)C=Cc2ccc(cc2)Cl 271570a_100102527930_100000040308 [0,2,0,0,0,0|1,0,1]=4 10098 B16R2.137 Cn1cnc(c1)C=Cc2ccc(cc2)F 271570a_100102525539_100000040308 [0,2,0,0,0,0|1,0,1]=4 10099 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Br 207a_100000210018_100000684808 [0,2,0,0,0,0|0,0,0]=2 10100 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Br 2230a_100000210018_100000717665 [0,2,0,0,0,0|0,0,0]=2 10101 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Br 34a_100000210018_100000717665 [0,2,0,0,0,0|0,0,0]=2 10102 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Cl 207a_100000210052_100000684808 [0,2,0,0,0,0|0,0,0]=2 10103 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Cl 2230a_100000210052_100000717665 [0,2,0,0,0,0|0,0,0]=2 10104 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)Cl 34a_100000210052_100000717665 [0,2,0,0,0,0|0,0,0]=2 10105 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)F 207a_100000185862_100000684808 [0,2,0,0,0,0|0,0,0]=2 10106 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)F 34a_100000185862_100000717665 [0,2,0,0,0,0|0,0,0]=2 10107 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)I 207a_100000185761_100000684808 [0,2,0,0,0,0|0,0,0]=2 10108 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)I 34a_100000185761_100000717665 [0,2,0,0,0,0|0,0,0]=2 10109 B16R2.137 Cn1cnc(c1)CNc2ccc(cc2)O 34a_100000185829_100000717665 [0,2,0,0,0,0|0,0,0]=2 10110 B16R2.137 Cn1cnc(c1)CNc2ccc(cn2)Br 27a_100011834058_100000686858 [0,2,0,0,0,0|1,0,0]=3 10111 B16R2.137 Cn1cnc(c1)CNc2cnc(cn2)Br 27a_100011834058_100010187541 [0,2,0,0,0,0|2,0,0]=4 10112 B16R2.137 Cn1cnc(c1)CNc2cnc(cn2)F 27a_100011834058_100009856528 [0,2,0,0,0,0|2,0,0]=4 10113 B16R2.137 Cn1cnc(c1)CNc2ncc(cn2)Br 27a_100011834058_100000690281 [0,2,0,0,0,0|2,0,0]=4 10114 B16R2.137 Cn1cnc(c1)CNc2ncc(cn2)Cl 27a_100011834058_100011356929 [0,2,0,0,0,0|2,0,0]=4 10115 B16R2.137 Cn1cnc(c1)CNc2ncc(cn2)F 27a_100011834058_100000685220 [0,2,0,0,0,0|2,0,0]=4 10116 B16R2.137 Cn1cnc(c1)COc2ccc(=O)[nH]c2 34a_100000075641_100000717665 [0,2,0,0,0,0|2,0,0]=4 10117 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)Br 34a_100000185759_100000717665 [0,2,0,0,0,0|1,0,0]=3 10118 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)Br 7a_100000185759_100000717665 [0,2,0,0,0,0|1,0,0]=3 10119 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)Cl 34a_100000210216_100000717665 [0,2,0,0,0,0|1,0,0]=3 10120 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)Cl 7a_100000210216_100000717665 [0,2,0,0,0,0|1,0,0]=3 10121 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)F 34a_100000210339_100000717665 [0,2,0,0,0,0|1,0,0]=3 10122 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)I 34a_100000212066_100000717665 [0,2,0,0,0,0|1,0,0]=3 10123 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)I 7a_100000212066_100000717665 [0,2,0,0,0,0|1,0,0]=3 10124 B16R2.137 Cn1cnc(c1)COc2ccc(cc2)N 34a_100000185829_100000717665 [0,2,0,0,0,0|1,0,0]=3 10125 B16R2.137 Cn1cnc(c1)COc2ccc(cn2)Cl 34a_100011215309_100000717665 [0,2,0,0,0,0|2,0,0]=4 10126 B16R2.137 Cn1cnc(c1)COc2ccc(cn2)F 34a_100000742473_100000717665 [0,2,0,0,0,0|2,0,0]=4 10127 B16R2.137 Cn1cnc(c1)COc2ccc(cn2)N 34a_100000729260_100000717665 [0,2,0,0,0,0|2,0,0]=4 10128 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)Br 34a_100000685995_100000717665 [0,2,0,0,0,0|2,0,0]=4 10129 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)Br 7a_100000685995_100000717665 [0,2,0,0,0,0|2,0,0]=4 10130 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)Cl 34a_100000744096_100000717665 [0,2,0,0,0,0|2,0,0]=4 10131 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)Cl 7a_100000744096_100000717665 [0,2,0,0,0,0|2,0,0]=4 10132 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)F 34a_100000688820_100000717665 [0,2,0,0,0,0|2,0,0]=4 10133 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)F 7a_100000688820_100000717665 [0,2,0,0,0,0|2,0,0]=4 10134 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)I 34a_100000687607_100000717665 [0,2,0,0,0,0|2,0,0]=4 10135 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)I 7a_100000687607_100000717665 [0,2,0,0,0,0|2,0,0]=4 10136 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)N 34a_100015188713_100000717665 [0,2,0,0,0,0|2,0,0]=4 10137 B16R2.137 Cn1cnc(c1)COc2ccc(nc2)N 7a_100015188713_100000717665 [0,2,0,0,0,0|2,0,0]=4 10138 B16R2.137 Cn1cnc(c1)CSc2cc[n+](cc2)[O-] 62a_100000717665_100000039755 [0,2,0,0,0,0|2,0,0]=4 10139 B16R2.137 Cn1cnc(c1)CSc2ccc(=O)[nH]c2 62a_100000212171_100000717665 [0,2,0,0,0,0|2,0,0]=4 10140 B16R2.137 Cn1cnc(c1)CSc2ccc(=O)[nH]c2 62a_100000717665_100000212171 [0,2,0,0,0,0|2,0,0]=4 10141 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)Br 62a_100000717665_100000752885 [0,2,0,0,0,0|1,0,0]=3 10142 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)Br 62a_100000752885_100000717665 [0,2,0,0,0,0|1,0,0]=3 10143 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)Cl 62a_100000717665_100000755918 [0,2,0,0,0,0|1,0,0]=3 10144 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)Cl 62a_100000755918_100000717665 [0,2,0,0,0,0|1,0,0]=3 10145 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)F 62a_100000211213_100000717665 [0,2,0,0,0,0|1,0,0]=3 10146 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)F 62a_100000717665_100000211213 [0,2,0,0,0,0|1,0,0]=3 10147 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)N 62a_100000185761_100000717665 [0,2,0,0,0,0|1,0,0]=3 10148 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)N 62a_100000717665_100000185761 [0,2,0,0,0,0|1,0,0]=3 10149 B16R2.137 Cn1cnc(c1)CSc2ccc(cc2)O 62a_100000717665_100000185759 [0,2,0,0,0,0|1,0,0]=3 10150 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)Br 62a_100000686858_100000717665 [0,2,0,0,0,0|2,0,0]=4 10151 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)Br 62a_100000717665_100000686858 [0,2,0,0,0,0|2,0,0]=4 10152 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)Cl 62a_100000717665_100011356976 [0,2,0,0,0,0|2,0,0]=4 10153 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)Cl 62a_100011356976_100000717665 [0,2,0,0,0,0|2,0,0]=4 10154 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)F 62a_100000717665_100000744514 [0,2,0,0,0,0|2,0,0]=4 10155 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)F 62a_100000744514_100000717665 [0,2,0,0,0,0|2,0,0]=4 10156 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)N 62a_100000717665_100000737798 [0,2,0,0,0,0|2,0,0]=4 10157 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)N 62a_100000737798_100000717665 [0,2,0,0,0,0|2,0,0]=4 10158 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)O 62a_100000685995_100000717665 [0,2,0,0,0,0|2,0,0]=4 10159 B16R2.137 Cn1cnc(c1)CSc2ccc(cn2)O 62a_100000717665_100000744096 [0,2,0,0,0,0|2,0,0]=4 10160 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)Br 62a_100000717665_100009814638 [0,2,0,0,0,0|2,0,0]=4 10161 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)Br 62a_100009814638_100000717665 [0,2,0,0,0,0|2,0,0]=4 10162 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)Cl 62a_100000034144_100000717665 [0,2,0,0,0,0|2,0,0]=4 10163 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)Cl 62a_100000717665_100000034144 [0,2,0,0,0,0|2,0,0]=4 10164 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)F 62a_100000042367_100000717665 [0,2,0,0,0,0|2,0,0]=4 10165 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)F 62a_100000717665_100000042367 [0,2,0,0,0,0|2,0,0]=4 10166 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)N 62a_100000187370_100000717665 [0,2,0,0,0,0|2,0,0]=4 10167 B16R2.137 Cn1cnc(c1)CSc2ccc(nc2)N 62a_100000717665_100000187370 [0,2,0,0,0,0|2,0,0]=4 10168 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)Br 62a_100000040308_100000189115 [0,2,0,0,0,0|2,0,0]=4 10169 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)Br 62a_100000189115_100000040308 [0,2,0,0,0,0|2,0,0]=4 10170 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)Cl 62a_100000040308_100000187161 [0,2,0,0,0,0|2,0,0]=4 10171 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)Cl 62a_100000187161_100000040308 [0,2,0,0,0,0|2,0,0]=4 10172 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)F 62a_100000040308_100000187164 [0,2,0,0,0,0|2,0,0]=4 10173 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)F 62a_100000198546_100000040308 [0,2,0,0,0,0|2,0,0]=4 10174 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)I 62a_100000040308_100000189116 [0,2,0,0,0,0|2,0,0]=4 10175 B16R2.137 Cn1cnc(c1)SCc2ccc(cc2)I 62a_100000189116_100000040308 [0,2,0,0,0,0|2,0,0]=4 10176 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Br 207a_100000210018_100010630104 [0,2,0,0,0,0|1,0,0]=3 10177 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Br 2230a_100000210018_100016995526 [0,2,0,0,0,0|1,0,0]=3 10178 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Br 34a_100000210018_100016995526 [0,2,0,0,0,0|1,0,0]=3 10179 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Cl 207a_100000210052_100010630104 [0,2,0,0,0,0|1,0,0]=3 10180 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Cl 2230a_100000210052_100016995526 [0,2,0,0,0,0|1,0,0]=3 10181 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)Cl 34a_100000210052_100016995526 [0,2,0,0,0,0|1,0,0]=3 10182 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)F 207a_100000185862_100010630104 [0,2,0,0,0,0|1,0,0]=3 10183 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)F 34a_100000185862_100016995526 [0,2,0,0,0,0|1,0,0]=3 10184 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)I 207a_100000185761_100010630104 [0,2,0,0,0,0|1,0,0]=3 10185 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)I 34a_100000185761_100016995526 [0,2,0,0,0,0|1,0,0]=3 10186 B16R2.137 Cn1cnc(n1)CNc2ccc(cc2)O 34a_100000185829_100016995526 [0,2,0,0,0,0|1,0,0]=3 10187 B16R2.137 Cn1cnc(n1)CNc2ccc(cn2)Br 27a_100000695864_100000686858 [0,2,0,0,0,0|2,0,0]=4 10188 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)Br 34a_100000185759_100016995526 [0,2,0,0,0,0|2,0,0]=4 10189 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)Br 7a_100000185759_100016995526 [0,2,0,0,0,0|2,0,0]=4 10190 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)Cl 34a_100000210216_100016995526 [0,2,0,0,0,0|2,0,0]=4 10191 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)Cl 7a_100000210216_100016995526 [0,2,0,0,0,0|2,0,0]=4 10192 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)F 34a_100000210339_100016995526 [0,2,0,0,0,0|2,0,0]=4 10193 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)I 34a_100000212066_100016995526 [0,2,0,0,0,0|2,0,0]=4 10194 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)I 7a_100000212066_100016995526 [0,2,0,0,0,0|2,0,0]=4 10195 B16R2.137 Cn1cnc(n1)COc2ccc(cc2)N 34a_100000185829_100016995526 [0,2,0,0,0,0|2,0,0]=4 10196 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)Br 62a_100000752885_100016995526 [0,2,0,0,0,0|2,0,0]=4 10197 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)Br 62a_100016995526_100000752885 [0,2,0,0,0,0|2,0,0]=4 10198 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)Cl 62a_100000755918_100016995526 [0,2,0,0,0,0|2,0,0]=4 10199 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)Cl 62a_100016995526_100000755918 [0,2,0,0,0,0|2,0,0]=4 10200 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)F 62a_100000211213_100016995526 [0,2,0,0,0,0|2,0,0]=4 10201 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)F 62a_100016995526_100000211213 [0,2,0,0,0,0|2,0,0]=4 10202 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)N 62a_100000185761_100016995526 [0,2,0,0,0,0|2,0,0]=4 10203 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)N 62a_100016995526_100000185761 [0,2,0,0,0,0|2,0,0]=4 10204 B16R2.137 Cn1cnc(n1)CSc2ccc(cc2)O 62a_100016995526_100000185759 [0,2,0,0,0,0|2,0,0]=4 10205 B16R2.137 Fc1ccc(cc1)NCc2cc(co2)Br 270302a_100000185862_100000747035 [0,2,0,0,0,0|2,0,0]=4 10206 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)Br 207a_100000185862_100000211722 [0,2,0,0,0,0|2,0,0]=4 10207 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)Br 270302a_100000185862_100000211722 [0,2,0,0,0,0|2,0,0]=4 10208 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)Br 34a_100000185862_100000746031 [0,2,0,0,0,0|2,0,0]=4 10209 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)Cl 207a_100000185862_100000102487 [0,2,0,0,0,0|2,0,0]=4 10210 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)Cl 270302a_100000185862_100000102487 [0,2,0,0,0,0|2,0,0]=4 10211 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)I 207a_100000185862_100010179861 [0,2,0,0,0,0|2,0,0]=4 10212 B16R2.137 Fc1ccc(cc1)NCc2cc(cs2)I 270302a_100000185862_100010179861 [0,2,0,0,0,0|2,0,0]=4 10213 B16R2.137 Fc1ccc(cc1)NCc2ccc(o2)Br 207a_100000185862_100000185145 [0,2,0,0,0,0|2,0,0]=4 10214 B16R2.137 Fc1ccc(cc1)NCc2ccc(o2)Cl 207a_100000185862_100000188459 [0,2,0,0,0,0|2,0,0]=4 10215 B16R2.137 Fc1ccc(cc1)NCc2ccc(o2)I 207a_100000185862_100000186757 [0,2,0,0,0,0|2,0,0]=4 10216 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Br 207a_100000185862_100000179771 [0,2,0,0,0,0|2,0,0]=4 10217 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Br 270302a_100000185862_100000179771 [0,2,0,0,0,0|2,0,0]=4 10218 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Br 34a_100000185862_100000708592 [0,2,0,0,0,0|2,0,0]=4 10219 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Cl 207a_100000185862_100000242774 [0,2,0,0,0,0|2,0,0]=4 10220 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Cl 270302a_100000185862_100000242774 [0,2,0,0,0,0|2,0,0]=4 10221 B16R2.137 Fc1ccc(cc1)NCc2ccc(s2)Cl 34a_100000185862_100000185097 [0,2,0,0,0,0|2,0,0]=4 10222 B16R2.137 Fc1ccc(cc1)NCc2cnc(s2)Br 34a_100000185862_100000717027 [0,2,0,0,0,0|1,0,1]=4 10223 B16R2.137 Fc1ccc(cc1)NCc2cnc(s2)Cl 34a_100000185862_100000058068 [0,2,0,0,0,0|1,0,1]=4 10224 B16R2.137 Fc1ccc(cc1)NCc2csc(c2)Br 207a_100000185862_100000737087 [0,2,0,0,0,0|2,0,0]=4 10225 B16R2.137 Fc1ccc(cc1)NCc2csc(c2)Br 270302a_100000185862_100000737087 [0,2,0,0,0,0|2,0,0]=4 10226 B16R2.137 Fc1ccc(cc1)NCc2csc(c2)Cl 207a_100000185862_100009844934 [0,2,0,0,0,0|2,0,0]=4 10227 B16R2.137 Fc1ccc(cc1)NCc2csc(c2)Cl 270302a_100000185862_100009844934 [0,2,0,0,0,0|2,0,0]=4 10228 B16R2.137 Fc1ccc(cc1)NCc2csc(n2)Cl 34a_100000185862_100000024076 [0,2,0,0,0,0|1,0,0]=3 10229 B16R2.137 Fc1ccc(cc1)NCc2ncc(s2)Br 270302a_100000185862_100000699580 [0,2,0,0,0,0|2,0,0]=4 10230 B16R2.137 Fc1ccc(cc1)NCc2ncc(s2)Cl 270302a_100000185862_100000699884 [0,2,0,0,0,0|2,0,0]=4 10231 B16R2.137 Fc1ccc(cc1)NCc2nsc(n2)Cl 34a_100000185862_100000043760 [0,2,0,0,0,0|2,0,0]=4 10232 B16R2.137 Fc1ccc(cc1)OCc2csc(n2)Cl 34a_100000210339_100000024076 [0,2,0,0,0,0|2,0,0]=4 10233 B16R2.137 Fc1ccc(cc1)SCc2csc(n2)Cl 62a_100000024076_100000211213 [0,2,0,0,0,0|2,0,0]=4 10234 B16R2.137 Fc1ccc(cc1)SCc2csc(n2)Cl 62a_100000211213_100000024076 [0,2,0,0,0,0|2,0,0]=4 10235 B16R2.137 Ic1ccc(cc1)NCc2cc(cs2)I 207a_100000185761_100010179861 [0,2,0,0,0,0|2,0,0]=4 10236 B16R2.137 Ic1ccc(cc1)NCc2cc(cs2)I 270302a_100000185761_100010179861 [0,2,0,0,0,0|2,0,0]=4 10237 B16R2.137 Ic1ccc(cc1)NCc2ccc(o2)I 207a_100000185761_100000186757 [0,2,0,0,0,0|2,0,0]=4 10238 B16R2.137 Nc1ccc(cc1)OCc2csc(n2)Cl 34a_100000185829_100000024076 [0,2,0,0,0,0|2,0,0]=4 10239 B16R2.137 Nc1ccc(cc1)SCc2csc(n2)Cl 62a_100000024076_100000185761 [0,2,0,0,0,0|2,0,0]=4 10240 B16R2.137 Nc1ccc(cc1)SCc2csc(n2)Cl 62a_100000185761_100000024076 [0,2,0,0,0,0|2,0,0]=4 10241 B16R2.137 O=c1[nH]nc([nH]1)CNc2ccc(cc2)Br 2230a_100000210018_100000754189 [0,2,0,0,0,0|1,0,1]=4 10242 B16R2.137 O=c1[nH]nc([nH]1)CNc2ccc(cc2)Cl 2230a_100000210052_100000754189 [0,2,0,0,0,0|1,0,1]=4 10243 B16R2.137 Oc1ccc(cc1)NCc2cc(co2)Br 270302a_100000185829_100000747035 [0,2,0,0,0,0|2,0,0]=4 10244 B16R2.137 Oc1ccc(cc1)NCc2cc(cs2)Br 270302a_100000185829_100000211722 [0,2,0,0,0,0|2,0,0]=4 10245 B16R2.137 Oc1ccc(cc1)NCc2cc(cs2)Br 34a_100000185829_100000746031 [0,2,0,0,0,0|2,0,0]=4 10246 B16R2.137 Oc1ccc(cc1)NCc2cc(cs2)Cl 270302a_100000185829_100000102487 [0,2,0,0,0,0|2,0,0]=4 10247 B16R2.137 Oc1ccc(cc1)NCc2cc(cs2)I 270302a_100000185829_100010179861 [0,2,0,0,0,0|2,0,0]=4 10248 B16R2.137 Oc1ccc(cc1)NCc2ccc(s2)Br 270302a_100000185829_100000179771 [0,2,0,0,0,0|2,0,0]=4 10249 B16R2.137 Oc1ccc(cc1)NCc2ccc(s2)Br 34a_100000185829_100000708592 [0,2,0,0,0,0|2,0,0]=4 10250 B16R2.137 Oc1ccc(cc1)NCc2ccc(s2)Cl 270302a_100000185829_100000242774 [0,2,0,0,0,0|2,0,0]=4 10251 B16R2.137 Oc1ccc(cc1)NCc2ccc(s2)Cl 34a_100000185829_100000185097 [0,2,0,0,0,0|2,0,0]=4 10252 B16R2.137 Oc1ccc(cc1)NCc2cnc(s2)Br 34a_100000185829_100000717027 [0,2,0,0,0,0|1,0,1]=4 10253 B16R2.137 Oc1ccc(cc1)NCc2cnc(s2)Cl 34a_100000185829_100000058068 [0,2,0,0,0,0|1,0,1]=4 10254 B16R2.137 Oc1ccc(cc1)NCc2csc(c2)Br 270302a_100000185829_100000737087 [0,2,0,0,0,0|2,0,0]=4 10255 B16R2.137 Oc1ccc(cc1)NCc2csc(c2)Cl 270302a_100000185829_100009844934 [0,2,0,0,0,0|2,0,0]=4 10256 B16R2.137 Oc1ccc(cc1)NCc2csc(n2)Cl 34a_100000185829_100000024076 [0,2,0,0,0,0|1,0,0]=3 10257 B16R2.137 Oc1ccc(cc1)NCc2ncc(s2)Br 270302a_100000185829_100000699580 [0,2,0,0,0,0|2,0,0]=4 10258 B16R2.137 Oc1ccc(cc1)NCc2ncc(s2)Cl 270302a_100000185829_100000699884 [0,2,0,0,0,0|2,0,0]=4 10259 B16R2.137 Oc1ccc(cc1)NCc2nsc(n2)Cl 34a_100000185829_100000043760 [0,2,0,0,0,0|2,0,0]=4 10260 B16R2.137 Oc1ccc(cc1)SCc2csc(n2)Cl 62a_100000024076_100000185759 [0,2,0,0,0,0|2,0,0]=4 10261 B16R2.137 [13CH3]n1cc(nn1)COc2ccc(cc2)Br 274090a_200025704644_100000172629 [0,2,0,0,0,0|2,0,0]=4 10262 B16R2.137 [13CH3]n1cc(nn1)COc2ccc(cc2)Cl 274090a_200025704644_100000172631 [0,2,0,0,0,0|2,0,0]=4 10263 B16R2.137 [13CH3]n1cc(nn1)COc2ccc(cc2)F 274090a_200025704644_100000172637 [0,2,0,0,0,0|2,0,0]=4 10264 B16R2.137 [13CH3]n1cc(nn1)COc2ccc(cc2)I 274090a_200025704644_100000172739 [0,2,0,0,0,0|2,0,0]=4 10265 B16R2.137 [13CH3]n1cc(nn1)COc2ccc(cc2)N 274090a_200025704644_100000753246 [0,2,0,0,0,0|2,0,0]=4 10266 B16R2.1063 Brc1cc(ccc1I)NCc2c[nH]cn2 34a_100000750458_100000707719 [0,2,0,0,0,0|0,0,0]=2 10267 B16R2.1063 Brc1cc(ccc1I)NCc2cc[nH]n2 207a_100000750458_100000738523 [0,2,0,0,0,0|2,0,0]=4 10268 B16R2.1063 Brc1cc(ccc1I)NCc2ccco2 207a_100000750458_100000186105 [0,2,0,0,0,0|2,0,0]=4 10269 B16R2.1063 Brc1cc(ccc1I)NCc2ccco2 270302a_100000750458_100000186105 [0,2,0,0,0,0|2,0,0]=4 10270 B16R2.1063 Brc1cc(ccc1I)NCc2cccs2 207a_100000750458_100000209959 [0,2,0,0,0,0|2,0,0]=4 10271 B16R2.1063 Brc1cc(ccc1I)NCc2cccs2 270302a_100000750458_100000209959 [0,2,0,0,0,0|2,0,0]=4 10272 B16R2.1063 Brc1cc(ccc1I)NCc2ccoc2 207a_100000750458_100011215517 [0,2,0,0,0,0|2,0,0]=4 10273 B16R2.1063 Brc1cc(ccc1I)NCc2ccon2 34a_100000750458_100000234950 [0,2,0,0,0,0|2,0,0]=4 10274 B16R2.1063 Brc1cc(ccc1I)NCc2ccsc2 207a_100000750458_100000188534 [0,2,0,0,0,0|2,0,0]=4 10275 B16R2.1063 Brc1cc(ccc1I)NCc2ccsc2 270302a_100000750458_100000188534 [0,2,0,0,0,0|2,0,0]=4 10276 B16R2.1063 Brc1cc(ccc1I)NCc2ccsc2 34a_100000750458_100011261437 [0,2,0,0,0,0|2,0,0]=4 10277 B16R2.1063 Brc1cc(ccc1I)NCc2cn[nH]c2 207a_100000750458_100016992096 [0,2,0,0,0,0|2,0,0]=4 10278 B16R2.1063 Brc1cc(ccc1I)NCc2cn[nH]c2 270302a_100000750458_100016992096 [0,2,0,0,0,0|2,0,0]=4 10279 B16R2.1063 Brc1cc(ccc1I)NCc2cnc[nH]2 207a_100000750458_100000742939 [0,2,0,0,0,0|0,0,2]=4 10280 B16R2.1063 Brc1cc(ccc1I)NCc2cncs2 207a_100000750458_100000749870 [0,2,0,0,0,0|1,0,1]=4 10281 B16R2.1063 Brc1cc(ccc1I)NCc2cncs2 270302a_100000750458_100000749870 [0,2,0,0,0,0|1,0,1]=4 10282 B16R2.1063 Brc1cc(ccc1I)NCc2cncs2 34a_100000750458_100015185245 [0,2,0,0,0,0|1,0,1]=4 10283 B16R2.1063 Brc1cc(ccc1I)NCc2cscn2 207a_100000750458_100000743575 [0,2,0,0,0,0|1,0,0]=3 10284 B16R2.1063 Brc1cc(ccc1I)NCc2cscn2 270302a_100000750458_100000743575 [0,2,0,0,0,0|1,0,0]=3 10285 B16R2.1063 Brc1cc(ccc1I)NCc2cscn2 34a_100000750458_100000205941 [0,2,0,0,0,0|1,0,0]=3 10286 B16R2.1063 Brc1cc(ccc1I)NCc2ncc[nH]2 207a_100000750458_100000743867 [0,2,0,0,0,0|2,0,0]=4 10287 B16R2.1063 Brc1cc(ccc1I)NCc2ncc[nH]2 34a_100000750458_100016991755 [0,2,0,0,0,0|2,0,0]=4 10288 B16R2.1063 Brc1cc(ccc1I)NCc2ncco2 34a_100000750458_103436540062 [0,2,0,0,0,0|2,0,0]=4 10289 B16R2.1063 Brc1cc(ccc1I)NCc2nccs2 207a_100000750458_100000750902 [0,2,0,0,0,0|2,0,0]=4 10290 B16R2.1063 Brc1cc(ccc1I)NCc2nccs2 270302a_100000750458_100000750902 [0,2,0,0,0,0|2,0,0]=4 10291 B16R2.1063 Brc1cc(ccc1I)NCc2nccs2 34a_100000750458_100015184050 [0,2,0,0,0,0|2,0,0]=4 10292 B16R2.1063 Brc1cc(ccc1I)NCc2ncon2 34a_100000750458_100000233494 [0,2,0,0,0,0|2,0,0]=4 10293 B16R2.1063 Brc1cc(ccc1I)NCn2cncn2 34a_100000750458_200020645497 [0,2,0,0,0,0|1,0,1]=4 10294 B16R2.1063 Brc1cc(ccc1I)OCc2c[nH]cn2 34a_100000701344_100000707719 [0,2,0,0,0,0|1,0,0]=3 10295 B16R2.1063 Brc1cc(ccc1I)OCc2cscn2 34a_100000701344_100000205941 [0,2,0,0,0,0|2,0,0]=4 10296 B16R2.1063 Brc1cc(ccc1I)OCc2cscn2 7a_100000701344_100000205941 [0,2,0,0,0,0|2,0,0]=4 10297 B16R2.1063 Brc1ccc(cc1Br)CSc2c[nH]cn2 62a_100000756875_100012353900 [0,2,0,0,0,0|2,0,0]=4 10298 B16R2.1063 Brc1ccc(cc1Br)CSc2c[nH]cn2 62a_100012353900_100000756875 [0,2,0,0,0,0|2,0,0]=4 10299 B16R2.1063 Brc1ccc(cc1Br)NCc2c[nH]cn2 2230a_100011306057_100000707719 [0,2,0,0,0,0|0,0,0]=2 10300 B16R2.1063 Brc1ccc(cc1Br)NCc2c[nH]cn2 34a_100011306057_100000707719 [0,2,0,0,0,0|0,0,0]=2 10301 B16R2.1063 Brc1ccc(cc1Br)NCc2cc[nH]n2 207a_100011306057_100000738523 [0,2,0,0,0,0|2,0,0]=4 10302 B16R2.1063 Brc1ccc(cc1Br)NCc2ccco2 207a_100011306057_100000186105 [0,2,0,0,0,0|2,0,0]=4 10303 B16R2.1063 Brc1ccc(cc1Br)NCc2ccco2 270302a_100011306057_100000186105 [0,2,0,0,0,0|2,0,0]=4 10304 B16R2.1063 Brc1ccc(cc1Br)NCc2cccs2 207a_100011306057_100000209959 [0,2,0,0,0,0|2,0,0]=4 10305 B16R2.1063 Brc1ccc(cc1Br)NCc2cccs2 270302a_100011306057_100000209959 [0,2,0,0,0,0|2,0,0]=4 10306 B16R2.1063 Brc1ccc(cc1Br)NCc2ccoc2 207a_100011306057_100011215517 [0,2,0,0,0,0|2,0,0]=4 10307 B16R2.1063 Brc1ccc(cc1Br)NCc2ccon2 2230a_100011306057_100000234950 [0,2,0,0,0,0|2,0,0]=4 10308 B16R2.1063 Brc1ccc(cc1Br)NCc2ccon2 34a_100011306057_100000234950 [0,2,0,0,0,0|2,0,0]=4 10309 B16R2.1063 Brc1ccc(cc1Br)NCc2ccon2 7a_100011306057_100000234950 [0,2,0,0,0,0|2,0,0]=4 10310 B16R2.1063 Brc1ccc(cc1Br)NCc2ccsc2 207a_100011306057_100000188534 [0,2,0,0,0,0|2,0,0]=4 10311 B16R2.1063 Brc1ccc(cc1Br)NCc2ccsc2 2230a_100011306057_100011261437 [0,2,0,0,0,0|2,0,0]=4 10312 B16R2.1063 Brc1ccc(cc1Br)NCc2ccsc2 270302a_100011306057_100000188534 [0,2,0,0,0,0|2,0,0]=4 10313 B16R2.1063 Brc1ccc(cc1Br)NCc2ccsc2 34a_100011306057_100011261437 [0,2,0,0,0,0|2,0,0]=4 10314 B16R2.1063 Brc1ccc(cc1Br)NCc2ccsc2 7a_100011306057_100011261437 [0,2,0,0,0,0|2,0,0]=4 10315 B16R2.1063 Brc1ccc(cc1Br)NCc2cn[nH]c2 207a_100011306057_100016992096 [0,2,0,0,0,0|2,0,0]=4 10316 B16R2.1063 Brc1ccc(cc1Br)NCc2cn[nH]c2 270302a_100011306057_100016992096 [0,2,0,0,0,0|2,0,0]=4 10317 B16R2.1063 Brc1ccc(cc1Br)NCc2cnc[nH]2 207a_100011306057_100000742939 [0,2,0,0,0,0|0,0,2]=4 10318 B16R2.1063 Brc1ccc(cc1Br)NCc2cncs2 207a_100011306057_100000749870 [0,2,0,0,0,0|1,0,1]=4 10319 B16R2.1063 Brc1ccc(cc1Br)NCc2cncs2 2230a_100011306057_100015185245 [0,2,0,0,0,0|1,0,1]=4 10320 B16R2.1063 Brc1ccc(cc1Br)NCc2cncs2 270302a_100011306057_100000749870 [0,2,0,0,0,0|1,0,1]=4 10321 B16R2.1063 Brc1ccc(cc1Br)NCc2cncs2 34a_100011306057_100015185245 [0,2,0,0,0,0|1,0,1]=4 10322 B16R2.1063 Brc1ccc(cc1Br)NCc2cncs2 7a_100011306057_100015185245 [0,2,0,0,0,0|1,0,1]=4 10323 B16R2.1063 Brc1ccc(cc1Br)NCc2cscn2 207a_100011306057_100000743575 [0,2,0,0,0,0|1,0,0]=3 10324 B16R2.1063 Brc1ccc(cc1Br)NCc2cscn2 2230a_100011306057_100000205941 [0,2,0,0,0,0|1,0,0]=3 10325 B16R2.1063 Brc1ccc(cc1Br)NCc2cscn2 270302a_100011306057_100000743575 [0,2,0,0,0,0|1,0,0]=3 10326 B16R2.1063 Brc1ccc(cc1Br)NCc2cscn2 34a_100011306057_100000205941 [0,2,0,0,0,0|1,0,0]=3 10327 B16R2.1063 Brc1ccc(cc1Br)NCc2cscn2 7a_100011306057_100000205941 [0,2,0,0,0,0|1,0,0]=3 10328 B16R2.1063 Brc1ccc(cc1Br)NCc2ncc[nH]2 207a_100011306057_100000743867 [0,2,0,0,0,0|2,0,0]=4 10329 B16R2.1063 Brc1ccc(cc1Br)NCc2ncc[nH]2 2230a_100011306057_100016991755 [0,2,0,0,0,0|2,0,0]=4 10330 B16R2.1063 Brc1ccc(cc1Br)NCc2ncc[nH]2 34a_100011306057_100016991755 [0,2,0,0,0,0|2,0,0]=4 10331 B16R2.1063 Brc1ccc(cc1Br)NCc2ncc[nH]2 7a_100011306057_100000753453 [0,2,0,0,0,0|2,0,0]=4 10332 B16R2.1063 Brc1ccc(cc1Br)NCc2ncco2 2230a_100011306057_103436540062 [0,2,0,0,0,0|2,0,0]=4 10333 B16R2.1063 Brc1ccc(cc1Br)NCc2ncco2 34a_100011306057_103436540062 [0,2,0,0,0,0|2,0,0]=4 10334 B16R2.1063 Brc1ccc(cc1Br)NCc2ncco2 7a_100011306057_103436540062 [0,2,0,0,0,0|2,0,0]=4 10335 B16R2.1063 Brc1ccc(cc1Br)NCc2nccs2 207a_100011306057_100000750902 [0,2,0,0,0,0|2,0,0]=4 10336 B16R2.1063 Brc1ccc(cc1Br)NCc2nccs2 2230a_100011306057_100015184050 [0,2,0,0,0,0|2,0,0]=4 10337 B16R2.1063 Brc1ccc(cc1Br)NCc2nccs2 270302a_100011306057_100000750902 [0,2,0,0,0,0|2,0,0]=4 10338 B16R2.1063 Brc1ccc(cc1Br)NCc2nccs2 34a_100011306057_100015184050 [0,2,0,0,0,0|2,0,0]=4 10339 B16R2.1063 Brc1ccc(cc1Br)NCc2nccs2 7a_100011306057_100015184050 [0,2,0,0,0,0|2,0,0]=4 10340 B16R2.1063 Brc1ccc(cc1Br)NCc2ncon2 34a_100011306057_100000233494 [0,2,0,0,0,0|2,0,0]=4 10341 B16R2.1063 Brc1ccc(cc1Br)NCn2cncn2 2230a_100011306057_200020645497 [0,2,0,0,0,0|1,0,1]=4 10342 B16R2.1063 Brc1ccc(cc1Br)NCn2cncn2 34a_100011306057_200020645497 [0,2,0,0,0,0|1,0,1]=4 10343 B16R2.1063 Brc1ccc(cc1Br)NCn2cncn2 7a_100011306057_200020645497 [0,2,0,0,0,0|1,0,1]=4 10344 B16R2.1063 Brc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100012356285 [0,2,0,0,0,0|1,0,0]=3 10345 B16R2.1063 Brc1ccc(cc1Br)SCc2c[nH]cn2 62a_100012356285_100000707719 [0,2,0,0,0,0|1,0,0]=3 10346 B16R2.1063 Brc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100012356285 [0,2,0,0,0,0|2,0,0]=4 10347 B16R2.1063 Brc1ccc(cc1Br)SCc2cscn2 62a_100012356285_100000205941 [0,2,0,0,0,0|2,0,0]=4 10348 B16R2.1063 Brc1ccc(cc1I)CSc2c[nH]cn2 62a_100000756875_100010146616 [0,2,0,0,0,0|2,0,0]=4 10349 B16R2.1063 Brc1ccc(cc1I)CSc2c[nH]cn2 62a_100010146616_100000756875 [0,2,0,0,0,0|2,0,0]=4 10350 B16R2.1063 Brc1ccc(cc1I)NCc2c[nH]cn2 34a_100000750459_100000707719 [0,2,0,0,0,0|0,0,0]=2 10351 B16R2.1063 Brc1ccc(cc1I)NCc2cc[nH]n2 207a_100000750459_100000738523 [0,2,0,0,0,0|2,0,0]=4 10352 B16R2.1063 Brc1ccc(cc1I)NCc2ccco2 207a_100000750459_100000186105 [0,2,0,0,0,0|2,0,0]=4 10353 B16R2.1063 Brc1ccc(cc1I)NCc2ccco2 270302a_100000750459_100000186105 [0,2,0,0,0,0|2,0,0]=4 10354 B16R2.1063 Brc1ccc(cc1I)NCc2cccs2 207a_100000750459_100000209959 [0,2,0,0,0,0|2,0,0]=4 10355 B16R2.1063 Brc1ccc(cc1I)NCc2cccs2 270302a_100000750459_100000209959 [0,2,0,0,0,0|2,0,0]=4 10356 B16R2.1063 Brc1ccc(cc1I)NCc2ccoc2 207a_100000750459_100011215517 [0,2,0,0,0,0|2,0,0]=4 10357 B16R2.1063 Brc1ccc(cc1I)NCc2ccon2 34a_100000750459_100000234950 [0,2,0,0,0,0|2,0,0]=4 10358 B16R2.1063 Brc1ccc(cc1I)NCc2ccsc2 207a_100000750459_100000188534 [0,2,0,0,0,0|2,0,0]=4 10359 B16R2.1063 Brc1ccc(cc1I)NCc2ccsc2 270302a_100000750459_100000188534 [0,2,0,0,0,0|2,0,0]=4 10360 B16R2.1063 Brc1ccc(cc1I)NCc2ccsc2 34a_100000750459_100011261437 [0,2,0,0,0,0|2,0,0]=4 10361 B16R2.1063 Brc1ccc(cc1I)NCc2cn[nH]c2 207a_100000750459_100016992096 [0,2,0,0,0,0|2,0,0]=4 10362 B16R2.1063 Brc1ccc(cc1I)NCc2cn[nH]c2 270302a_100000750459_100016992096 [0,2,0,0,0,0|2,0,0]=4 10363 B16R2.1063 Brc1ccc(cc1I)NCc2cnc[nH]2 207a_100000750459_100000742939 [0,2,0,0,0,0|0,0,2]=4 10364 B16R2.1063 Brc1ccc(cc1I)NCc2cncs2 207a_100000750459_100000749870 [0,2,0,0,0,0|1,0,1]=4 10365 B16R2.1063 Brc1ccc(cc1I)NCc2cncs2 270302a_100000750459_100000749870 [0,2,0,0,0,0|1,0,1]=4 10366 B16R2.1063 Brc1ccc(cc1I)NCc2cncs2 34a_100000750459_100015185245 [0,2,0,0,0,0|1,0,1]=4 10367 B16R2.1063 Brc1ccc(cc1I)NCc2cscn2 207a_100000750459_100000743575 [0,2,0,0,0,0|1,0,0]=3 10368 B16R2.1063 Brc1ccc(cc1I)NCc2cscn2 270302a_100000750459_100000743575 [0,2,0,0,0,0|1,0,0]=3 10369 B16R2.1063 Brc1ccc(cc1I)NCc2cscn2 34a_100000750459_100000205941 [0,2,0,0,0,0|1,0,0]=3 10370 B16R2.1063 Brc1ccc(cc1I)NCc2ncc[nH]2 207a_100000750459_100000743867 [0,2,0,0,0,0|2,0,0]=4 10371 B16R2.1063 Brc1ccc(cc1I)NCc2ncc[nH]2 34a_100000750459_100016991755 [0,2,0,0,0,0|2,0,0]=4 10372 B16R2.1063 Brc1ccc(cc1I)NCc2ncco2 34a_100000750459_103436540062 [0,2,0,0,0,0|2,0,0]=4 10373 B16R2.1063 Brc1ccc(cc1I)NCc2nccs2 207a_100000750459_100000750902 [0,2,0,0,0,0|2,0,0]=4 10374 B16R2.1063 Brc1ccc(cc1I)NCc2nccs2 270302a_100000750459_100000750902 [0,2,0,0,0,0|2,0,0]=4 10375 B16R2.1063 Brc1ccc(cc1I)NCc2nccs2 34a_100000750459_100015184050 [0,2,0,0,0,0|2,0,0]=4 10376 B16R2.1063 Brc1ccc(cc1I)NCc2ncon2 34a_100000750459_100000233494 [0,2,0,0,0,0|2,0,0]=4 10377 B16R2.1063 Brc1ccc(cc1I)NCn2cncn2 34a_100000750459_200020645497 [0,2,0,0,0,0|1,0,1]=4 10378 B16R2.1063 Brc1ccc(cc1I)OCc2c[nH]cn2 34a_100012339312_100000707719 [0,2,0,0,0,0|1,0,0]=3 10379 B16R2.1063 Brc1ccc(cc1I)OCc2cscn2 34a_100012339312_100000205941 [0,2,0,0,0,0|2,0,0]=4 10380 B16R2.1063 Brc1ccc(cc1I)OCc2cscn2 7a_100012339312_100000205941 [0,2,0,0,0,0|2,0,0]=4 10381 B16R2.1063 Cc1cc(ccc1Br)CSc2c[nH]cn2 62a_100000727479_100000756875 [0,2,0,0,0,0|2,0,0]=4 10382 B16R2.1063 Cc1cc(ccc1Br)CSc2c[nH]cn2 62a_100000756875_100000727479 [0,2,0,0,0,0|2,0,0]=4 10383 B16R2.1063 Cc1cc(ccc1Br)NCc2c[nH]cn2 2230a_100000210723_100000707719 [0,2,0,0,0,0|0,0,0]=2 10384 B16R2.1063 Cc1cc(ccc1Br)NCc2c[nH]cn2 34a_100000210723_100000707719 [0,2,0,0,0,0|0,0,0]=2 10385 B16R2.1063 Cc1cc(ccc1Br)NCc2cc[nH]n2 207a_100000210723_100000738523 [0,2,0,0,0,0|2,0,0]=4 10386 B16R2.1063 Cc1cc(ccc1Br)NCc2ccco2 207a_100000210723_100000186105 [0,2,0,0,0,0|2,0,0]=4 10387 B16R2.1063 Cc1cc(ccc1Br)NCc2ccco2 270302a_100000210723_100000186105 [0,2,0,0,0,0|2,0,0]=4 10388 B16R2.1063 Cc1cc(ccc1Br)NCc2cccs2 207a_100000210723_100000209959 [0,2,0,0,0,0|2,0,0]=4 10389 B16R2.1063 Cc1cc(ccc1Br)NCc2cccs2 270302a_100000210723_100000209959 [0,2,0,0,0,0|2,0,0]=4 10390 B16R2.1063 Cc1cc(ccc1Br)NCc2ccoc2 207a_100000210723_100011215517 [0,2,0,0,0,0|2,0,0]=4 10391 B16R2.1063 Cc1cc(ccc1Br)NCc2ccon2 2230a_100000210723_100000234950 [0,2,0,0,0,0|2,0,0]=4 10392 B16R2.1063 Cc1cc(ccc1Br)NCc2ccon2 34a_100000210723_100000234950 [0,2,0,0,0,0|2,0,0]=4 10393 B16R2.1063 Cc1cc(ccc1Br)NCc2ccon2 7a_100000210723_100000234950 [0,2,0,0,0,0|2,0,0]=4 10394 B16R2.1063 Cc1cc(ccc1Br)NCc2ccsc2 207a_100000210723_100000188534 [0,2,0,0,0,0|2,0,0]=4 10395 B16R2.1063 Cc1cc(ccc1Br)NCc2ccsc2 2230a_100000210723_100011261437 [0,2,0,0,0,0|2,0,0]=4 10396 B16R2.1063 Cc1cc(ccc1Br)NCc2ccsc2 270302a_100000210723_100000188534 [0,2,0,0,0,0|2,0,0]=4 10397 B16R2.1063 Cc1cc(ccc1Br)NCc2ccsc2 34a_100000210723_100011261437 [0,2,0,0,0,0|2,0,0]=4 10398 B16R2.1063 Cc1cc(ccc1Br)NCc2ccsc2 7a_100000210723_100011261437 [0,2,0,0,0,0|2,0,0]=4 10399 B16R2.1063 Cc1cc(ccc1Br)NCc2cn[nH]c2 207a_100000210723_100016992096 [0,2,0,0,0,0|2,0,0]=4 10400 B16R2.1063 Cc1cc(ccc1Br)NCc2cn[nH]c2 270302a_100000210723_100016992096 [0,2,0,0,0,0|2,0,0]=4 10401 B16R2.1063 Cc1cc(ccc1Br)NCc2cnc[nH]2 207a_100000210723_100000742939 [0,2,0,0,0,0|0,0,2]=4 10402 B16R2.1063 Cc1cc(ccc1Br)NCc2cncs2 207a_100000210723_100000749870 [0,2,0,0,0,0|1,0,1]=4 10403 B16R2.1063 Cc1cc(ccc1Br)NCc2cncs2 2230a_100000210723_100015185245 [0,2,0,0,0,0|1,0,1]=4 10404 B16R2.1063 Cc1cc(ccc1Br)NCc2cncs2 270302a_100000210723_100000749870 [0,2,0,0,0,0|1,0,1]=4 10405 B16R2.1063 Cc1cc(ccc1Br)NCc2cncs2 34a_100000210723_100015185245 [0,2,0,0,0,0|1,0,1]=4 10406 B16R2.1063 Cc1cc(ccc1Br)NCc2cncs2 7a_100000210723_100015185245 [0,2,0,0,0,0|1,0,1]=4 10407 B16R2.1063 Cc1cc(ccc1Br)NCc2cscn2 207a_100000210723_100000743575 [0,2,0,0,0,0|1,0,0]=3 10408 B16R2.1063 Cc1cc(ccc1Br)NCc2cscn2 2230a_100000210723_100000205941 [0,2,0,0,0,0|1,0,0]=3 10409 B16R2.1063 Cc1cc(ccc1Br)NCc2cscn2 270302a_100000210723_100000743575 [0,2,0,0,0,0|1,0,0]=3 10410 B16R2.1063 Cc1cc(ccc1Br)NCc2cscn2 34a_100000210723_100000205941 [0,2,0,0,0,0|1,0,0]=3 10411 B16R2.1063 Cc1cc(ccc1Br)NCc2cscn2 7a_100000210723_100000205941 [0,2,0,0,0,0|1,0,0]=3 10412 B16R2.1063 Cc1cc(ccc1Br)NCc2ncc[nH]2 207a_100000210723_100000743867 [0,2,0,0,0,0|2,0,0]=4 10413 B16R2.1063 Cc1cc(ccc1Br)NCc2ncc[nH]2 2230a_100000210723_100016991755 [0,2,0,0,0,0|2,0,0]=4 10414 B16R2.1063 Cc1cc(ccc1Br)NCc2ncc[nH]2 34a_100000210723_100016991755 [0,2,0,0,0,0|2,0,0]=4 10415 B16R2.1063 Cc1cc(ccc1Br)NCc2ncc[nH]2 7a_100000210723_100000753453 [0,2,0,0,0,0|2,0,0]=4 10416 B16R2.1063 Cc1cc(ccc1Br)NCc2ncco2 2230a_100000210723_103436540062 [0,2,0,0,0,0|2,0,0]=4 10417 B16R2.1063 Cc1cc(ccc1Br)NCc2ncco2 34a_100000210723_103436540062 [0,2,0,0,0,0|2,0,0]=4 10418 B16R2.1063 Cc1cc(ccc1Br)NCc2ncco2 7a_100000210723_103436540062 [0,2,0,0,0,0|2,0,0]=4 10419 B16R2.1063 Cc1cc(ccc1Br)NCc2nccs2 207a_100000210723_100000750902 [0,2,0,0,0,0|2,0,0]=4 10420 B16R2.1063 Cc1cc(ccc1Br)NCc2nccs2 2230a_100000210723_100015184050 [0,2,0,0,0,0|2,0,0]=4 10421 B16R2.1063 Cc1cc(ccc1Br)NCc2nccs2 270302a_100000210723_100000750902 [0,2,0,0,0,0|2,0,0]=4 10422 B16R2.1063 Cc1cc(ccc1Br)NCc2nccs2 34a_100000210723_100015184050 [0,2,0,0,0,0|2,0,0]=4 10423 B16R2.1063 Cc1cc(ccc1Br)NCc2nccs2 7a_100000210723_100015184050 [0,2,0,0,0,0|2,0,0]=4 10424 B16R2.1063 Cc1cc(ccc1Br)NCc2ncon2 34a_100000210723_100000233494 [0,2,0,0,0,0|2,0,0]=4 10425 B16R2.1063 Cc1cc(ccc1Br)NCn2cncn2 2230a_100000210723_200020645497 [0,2,0,0,0,0|1,0,1]=4 10426 B16R2.1063 Cc1cc(ccc1Br)NCn2cncn2 34a_100000210723_200020645497 [0,2,0,0,0,0|1,0,1]=4 10427 B16R2.1063 Cc1cc(ccc1Br)NCn2cncn2 7a_100000210723_200020645497 [0,2,0,0,0,0|1,0,1]=4 10428 B16R2.1063 Cc1cc(ccc1Br)OCc2c[nH]cn2 34a_100000690111_100000707719 [0,2,0,0,0,0|1,0,0]=3 10429 B16R2.1063 Cc1cc(ccc1Br)OCc2cscn2 34a_100000690111_100000205941 [0,2,0,0,0,0|2,0,0]=4 10430 B16R2.1063 Cc1cc(ccc1Br)OCc2cscn2 7a_100000690111_100000205941 [0,2,0,0,0,0|2,0,0]=4 10431 B16R2.1063 Cc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100009813585 [0,2,0,0,0,0|1,0,0]=3 10432 B16R2.1063 Cc1cc(ccc1Br)SCc2c[nH]cn2 62a_100009813585_100000707719 [0,2,0,0,0,0|1,0,0]=3 10433 B16R2.1063 Cc1cc(ccc1Br)SCc2cscn2 62a_100000205941_100009813585 [0,2,0,0,0,0|2,0,0]=4 10434 B16R2.1063 Cc1cc(ccc1Br)SCc2cscn2 62a_100009813585_100000205941 [0,2,0,0,0,0|2,0,0]=4 10435 B16R2.1063 Cc1cc(ccc1Cl)CSc2c[nH]cn2 62a_100000756875_100012184735 [0,2,0,0,0,0|2,0,0]=4 10436 B16R2.1063 Cc1cc(ccc1Cl)CSc2c[nH]cn2 62a_100012184735_100000756875 [0,2,0,0,0,0|2,0,0]=4 10437 B16R2.1063 Cc1cc(ccc1Cl)NCc2c[nH]cn2 2230a_100000187808_100000707719 [0,2,0,0,0,0|0,0,0]=2 10438 B16R2.1063 Cc1cc(ccc1Cl)NCc2c[nH]cn2 34a_100000187808_100000707719 [0,2,0,0,0,0|0,0,0]=2 10439 B16R2.1063 Cc1cc(ccc1Cl)NCc2cc[nH]n2 207a_100000187808_100000738523 [0,2,0,0,0,0|2,0,0]=4 10440 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccco2 207a_100000187808_100000186105 [0,2,0,0,0,0|2,0,0]=4 10441 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccco2 270302a_100000187808_100000186105 [0,2,0,0,0,0|2,0,0]=4 10442 B16R2.1063 Cc1cc(ccc1Cl)NCc2cccs2 207a_100000187808_100000209959 [0,2,0,0,0,0|2,0,0]=4 10443 B16R2.1063 Cc1cc(ccc1Cl)NCc2cccs2 270302a_100000187808_100000209959 [0,2,0,0,0,0|2,0,0]=4 10444 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccoc2 207a_100000187808_100011215517 [0,2,0,0,0,0|2,0,0]=4 10445 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccon2 2230a_100000187808_100000234950 [0,2,0,0,0,0|2,0,0]=4 10446 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccon2 34a_100000187808_100000234950 [0,2,0,0,0,0|2,0,0]=4 10447 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccon2 7a_100000187808_100000234950 [0,2,0,0,0,0|2,0,0]=4 10448 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccsc2 207a_100000187808_100000188534 [0,2,0,0,0,0|2,0,0]=4 10449 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccsc2 2230a_100000187808_100011261437 [0,2,0,0,0,0|2,0,0]=4 10450 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccsc2 270302a_100000187808_100000188534 [0,2,0,0,0,0|2,0,0]=4 10451 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccsc2 34a_100000187808_100011261437 [0,2,0,0,0,0|2,0,0]=4 10452 B16R2.1063 Cc1cc(ccc1Cl)NCc2ccsc2 7a_100000187808_100011261437 [0,2,0,0,0,0|2,0,0]=4 10453 B16R2.1063 Cc1cc(ccc1Cl)NCc2cn[nH]c2 207a_100000187808_100016992096 [0,2,0,0,0,0|2,0,0]=4 10454 B16R2.1063 Cc1cc(ccc1Cl)NCc2cn[nH]c2 270302a_100000187808_100016992096 [0,2,0,0,0,0|2,0,0]=4 10455 B16R2.1063 Cc1cc(ccc1Cl)NCc2cnc[nH]2 207a_100000187808_100000742939 [0,2,0,0,0,0|0,0,2]=4 10456 B16R2.1063 Cc1cc(ccc1Cl)NCc2cncs2 207a_100000187808_100000749870 [0,2,0,0,0,0|1,0,1]=4 10457 B16R2.1063 Cc1cc(ccc1Cl)NCc2cncs2 2230a_100000187808_100015185245 [0,2,0,0,0,0|1,0,1]=4 10458 B16R2.1063 Cc1cc(ccc1Cl)NCc2cncs2 270302a_100000187808_100000749870 [0,2,0,0,0,0|1,0,1]=4 10459 B16R2.1063 Cc1cc(ccc1Cl)NCc2cncs2 34a_100000187808_100015185245 [0,2,0,0,0,0|1,0,1]=4 10460 B16R2.1063 Cc1cc(ccc1Cl)NCc2cncs2 7a_100000187808_100015185245 [0,2,0,0,0,0|1,0,1]=4 10461 B16R2.1063 Cc1cc(ccc1Cl)NCc2cscn2 207a_100000187808_100000743575 [0,2,0,0,0,0|1,0,0]=3 10462 B16R2.1063 Cc1cc(ccc1Cl)NCc2cscn2 2230a_100000187808_100000205941 [0,2,0,0,0,0|1,0,0]=3 10463 B16R2.1063 Cc1cc(ccc1Cl)NCc2cscn2 270302a_100000187808_100000743575 [0,2,0,0,0,0|1,0,0]=3 10464 B16R2.1063 Cc1cc(ccc1Cl)NCc2cscn2 34a_100000187808_100000205941 [0,2,0,0,0,0|1,0,0]=3 10465 B16R2.1063 Cc1cc(ccc1Cl)NCc2cscn2 7a_100000187808_100000205941 [0,2,0,0,0,0|1,0,0]=3 10466 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncc[nH]2 207a_100000187808_100000743867 [0,2,0,0,0,0|2,0,0]=4 10467 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncc[nH]2 2230a_100000187808_100016991755 [0,2,0,0,0,0|2,0,0]=4 10468 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncc[nH]2 34a_100000187808_100016991755 [0,2,0,0,0,0|2,0,0]=4 10469 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncc[nH]2 7a_100000187808_100000753453 [0,2,0,0,0,0|2,0,0]=4 10470 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncco2 2230a_100000187808_103436540062 [0,2,0,0,0,0|2,0,0]=4 10471 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncco2 34a_100000187808_103436540062 [0,2,0,0,0,0|2,0,0]=4 10472 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncco2 7a_100000187808_103436540062 [0,2,0,0,0,0|2,0,0]=4 10473 B16R2.1063 Cc1cc(ccc1Cl)NCc2nccs2 207a_100000187808_100000750902 [0,2,0,0,0,0|2,0,0]=4 10474 B16R2.1063 Cc1cc(ccc1Cl)NCc2nccs2 2230a_100000187808_100015184050 [0,2,0,0,0,0|2,0,0]=4 10475 B16R2.1063 Cc1cc(ccc1Cl)NCc2nccs2 270302a_100000187808_100000750902 [0,2,0,0,0,0|2,0,0]=4 10476 B16R2.1063 Cc1cc(ccc1Cl)NCc2nccs2 34a_100000187808_100015184050 [0,2,0,0,0,0|2,0,0]=4 10477 B16R2.1063 Cc1cc(ccc1Cl)NCc2nccs2 7a_100000187808_100015184050 [0,2,0,0,0,0|2,0,0]=4 10478 B16R2.1063 Cc1cc(ccc1Cl)NCc2ncon2 34a_100000187808_100000233494 [0,2,0,0,0,0|2,0,0]=4 10479 B16R2.1063 Cc1cc(ccc1Cl)NCn2cncn2 2230a_100000187808_200020645497 [0,2,0,0,0,0|1,0,1]=4 10480 B16R2.1063 Cc1cc(ccc1Cl)NCn2cncn2 34a_100000187808_200020645497 [0,2,0,0,0,0|1,0,1]=4 10481 B16R2.1063 Cc1cc(ccc1Cl)NCn2cncn2 7a_100000187808_200020645497 [0,2,0,0,0,0|1,0,1]=4 10482 B16R2.1063 Cc1cc(ccc1Cl)OCc2c[nH]cn2 34a_100000211092_100000707719 [0,2,0,0,0,0|1,0,0]=3 10483 B16R2.1063 Cc1cc(ccc1Cl)OCc2cscn2 34a_100000211092_100000205941 [0,2,0,0,0,0|2,0,0]=4 10484 B16R2.1063 Cc1cc(ccc1Cl)OCc2cscn2 7a_100000211092_100000205941 [0,2,0,0,0,0|2,0,0]=4 10485 B16R2.1063 Cc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100000049509_100000707719 [0,2,0,0,0,0|1,0,0]=3 10486 B16R2.1063 Cc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100000707719_100000049509 [0,2,0,0,0,0|1,0,0]=3 10487 B16R2.1063 Cc1cc(ccc1Cl)SCc2cscn2 62a_100000049509_100000205941 [0,2,0,0,0,0|2,0,0]=4 10488 B16R2.1063 Cc1cc(ccc1Cl)SCc2cscn2 62a_100000205941_100000049509 [0,2,0,0,0,0|2,0,0]=4 10489 B16R2.1063 Cc1cc(ccc1F)CSc2c[nH]cn2 62a_100000756875_100011216667 [0,2,0,0,0,0|2,0,0]=4 10490 B16R2.1063 Cc1cc(ccc1F)CSc2c[nH]cn2 62a_100011216667_100000756875 [0,2,0,0,0,0|2,0,0]=4 10491 B16R2.1063 Cc1cc(ccc1F)NCc2c[nH]cn2 2230a_100000750164_100000707719 [0,2,0,0,0,0|0,0,0]=2 10492 B16R2.1063 Cc1cc(ccc1F)NCc2c[nH]cn2 34a_100000750164_100000707719 [0,2,0,0,0,0|0,0,0]=2 10493 B16R2.1063 Cc1cc(ccc1F)NCc2cc[nH]n2 207a_100000750164_100000738523 [0,2,0,0,0,0|2,0,0]=4 10494 B16R2.1063 Cc1cc(ccc1F)NCc2ccco2 207a_100000750164_100000186105 [0,2,0,0,0,0|2,0,0]=4 10495 B16R2.1063 Cc1cc(ccc1F)NCc2ccco2 270302a_100000750164_100000186105 [0,2,0,0,0,0|2,0,0]=4 10496 B16R2.1063 Cc1cc(ccc1F)NCc2cccs2 207a_100000750164_100000209959 [0,2,0,0,0,0|2,0,0]=4 10497 B16R2.1063 Cc1cc(ccc1F)NCc2cccs2 270302a_100000750164_100000209959 [0,2,0,0,0,0|2,0,0]=4 10498 B16R2.1063 Cc1cc(ccc1F)NCc2ccoc2 207a_100000750164_100011215517 [0,2,0,0,0,0|2,0,0]=4 10499 B16R2.1063 Cc1cc(ccc1F)NCc2ccon2 2230a_100000750164_100000234950 [0,2,0,0,0,0|2,0,0]=4 10500 B16R2.1063 Cc1cc(ccc1F)NCc2ccon2 34a_100000750164_100000234950 [0,2,0,0,0,0|2,0,0]=4 10501 B16R2.1063 Cc1cc(ccc1F)NCc2ccon2 7a_100000750164_100000234950 [0,2,0,0,0,0|2,0,0]=4 10502 B16R2.1063 Cc1cc(ccc1F)NCc2ccsc2 207a_100000750164_100000188534 [0,2,0,0,0,0|2,0,0]=4 10503 B16R2.1063 Cc1cc(ccc1F)NCc2ccsc2 2230a_100000750164_100011261437 [0,2,0,0,0,0|2,0,0]=4 10504 B16R2.1063 Cc1cc(ccc1F)NCc2ccsc2 270302a_100000750164_100000188534 [0,2,0,0,0,0|2,0,0]=4 10505 B16R2.1063 Cc1cc(ccc1F)NCc2ccsc2 34a_100000750164_100011261437 [0,2,0,0,0,0|2,0,0]=4 10506 B16R2.1063 Cc1cc(ccc1F)NCc2ccsc2 7a_100000750164_100011261437 [0,2,0,0,0,0|2,0,0]=4 10507 B16R2.1063 Cc1cc(ccc1F)NCc2cn[nH]c2 207a_100000750164_100016992096 [0,2,0,0,0,0|2,0,0]=4 10508 B16R2.1063 Cc1cc(ccc1F)NCc2cn[nH]c2 270302a_100000750164_100016992096 [0,2,0,0,0,0|2,0,0]=4 10509 B16R2.1063 Cc1cc(ccc1F)NCc2cnc[nH]2 207a_100000750164_100000742939 [0,2,0,0,0,0|0,0,2]=4 10510 B16R2.1063 Cc1cc(ccc1F)NCc2cncs2 207a_100000750164_100000749870 [0,2,0,0,0,0|1,0,1]=4 10511 B16R2.1063 Cc1cc(ccc1F)NCc2cncs2 2230a_100000750164_100015185245 [0,2,0,0,0,0|1,0,1]=4 10512 B16R2.1063 Cc1cc(ccc1F)NCc2cncs2 270302a_100000750164_100000749870 [0,2,0,0,0,0|1,0,1]=4 10513 B16R2.1063 Cc1cc(ccc1F)NCc2cncs2 34a_100000750164_100015185245 [0,2,0,0,0,0|1,0,1]=4 10514 B16R2.1063 Cc1cc(ccc1F)NCc2cncs2 7a_100000750164_100015185245 [0,2,0,0,0,0|1,0,1]=4 10515 B16R2.1063 Cc1cc(ccc1F)NCc2cscn2 207a_100000750164_100000743575 [0,2,0,0,0,0|1,0,0]=3 10516 B16R2.1063 Cc1cc(ccc1F)NCc2cscn2 2230a_100000750164_100000205941 [0,2,0,0,0,0|1,0,0]=3 10517 B16R2.1063 Cc1cc(ccc1F)NCc2cscn2 270302a_100000750164_100000743575 [0,2,0,0,0,0|1,0,0]=3 10518 B16R2.1063 Cc1cc(ccc1F)NCc2cscn2 34a_100000750164_100000205941 [0,2,0,0,0,0|1,0,0]=3 10519 B16R2.1063 Cc1cc(ccc1F)NCc2cscn2 7a_100000750164_100000205941 [0,2,0,0,0,0|1,0,0]=3 10520 B16R2.1063 Cc1cc(ccc1F)NCc2ncc[nH]2 207a_100000750164_100000743867 [0,2,0,0,0,0|2,0,0]=4 10521 B16R2.1063 Cc1cc(ccc1F)NCc2ncc[nH]2 2230a_100000750164_100016991755 [0,2,0,0,0,0|2,0,0]=4 10522 B16R2.1063 Cc1cc(ccc1F)NCc2ncc[nH]2 34a_100000750164_100016991755 [0,2,0,0,0,0|2,0,0]=4 10523 B16R2.1063 Cc1cc(ccc1F)NCc2ncc[nH]2 7a_100000750164_100000753453 [0,2,0,0,0,0|2,0,0]=4 10524 B16R2.1063 Cc1cc(ccc1F)NCc2ncco2 2230a_100000750164_103436540062 [0,2,0,0,0,0|2,0,0]=4 10525 B16R2.1063 Cc1cc(ccc1F)NCc2ncco2 34a_100000750164_103436540062 [0,2,0,0,0,0|2,0,0]=4 10526 B16R2.1063 Cc1cc(ccc1F)NCc2ncco2 7a_100000750164_103436540062 [0,2,0,0,0,0|2,0,0]=4 10527 B16R2.1063 Cc1cc(ccc1F)NCc2nccs2 207a_100000750164_100000750902 [0,2,0,0,0,0|2,0,0]=4 10528 B16R2.1063 Cc1cc(ccc1F)NCc2nccs2 2230a_100000750164_100015184050 [0,2,0,0,0,0|2,0,0]=4 10529 B16R2.1063 Cc1cc(ccc1F)NCc2nccs2 270302a_100000750164_100000750902 [0,2,0,0,0,0|2,0,0]=4 10530 B16R2.1063 Cc1cc(ccc1F)NCc2nccs2 34a_100000750164_100015184050 [0,2,0,0,0,0|2,0,0]=4 10531 B16R2.1063 Cc1cc(ccc1F)NCc2nccs2 7a_100000750164_100015184050 [0,2,0,0,0,0|2,0,0]=4 10532 B16R2.1063 Cc1cc(ccc1F)NCc2ncon2 34a_100000750164_100000233494 [0,2,0,0,0,0|2,0,0]=4 10533 B16R2.1063 Cc1cc(ccc1F)NCn2cncn2 2230a_100000750164_200020645497 [0,2,0,0,0,0|1,0,1]=4 10534 B16R2.1063 Cc1cc(ccc1F)NCn2cncn2 34a_100000750164_200020645497 [0,2,0,0,0,0|1,0,1]=4 10535 B16R2.1063 Cc1cc(ccc1F)NCn2cncn2 7a_100000750164_200020645497 [0,2,0,0,0,0|1,0,1]=4 10536 B16R2.1063 Cc1cc(ccc1F)OCc2c[nH]cn2 34a_100000751312_100000707719 [0,2,0,0,0,0|1,0,0]=3 10537 B16R2.1063 Cc1cc(ccc1F)OCc2cscn2 34a_100000751312_100000205941 [0,2,0,0,0,0|2,0,0]=4 10538 B16R2.1063 Cc1cc(ccc1F)OCc2cscn2 7a_100000751312_100000205941 [0,2,0,0,0,0|2,0,0]=4 10539 B16R2.1063 Cc1cc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100011218330 [0,2,0,0,0,0|1,0,0]=3 10540 B16R2.1063 Cc1cc(ccc1F)SCc2c[nH]cn2 62a_100011218330_100000707719 [0,2,0,0,0,0|1,0,0]=3 10541 B16R2.1063 Cc1cc(ccc1F)SCc2cscn2 62a_100000205941_100011218330 [0,2,0,0,0,0|2,0,0]=4 10542 B16R2.1063 Cc1cc(ccc1F)SCc2cscn2 62a_100011218330_100000205941 [0,2,0,0,0,0|2,0,0]=4 10543 B16R2.1063 Cc1cc(ccc1I)NCc2c[nH]cn2 34a_100000198070_100000707719 [0,2,0,0,0,0|0,0,0]=2 10544 B16R2.1063 Cc1cc(ccc1I)NCc2cc[nH]n2 207a_100000198070_100000738523 [0,2,0,0,0,0|2,0,0]=4 10545 B16R2.1063 Cc1cc(ccc1I)NCc2ccco2 207a_100000198070_100000186105 [0,2,0,0,0,0|2,0,0]=4 10546 B16R2.1063 Cc1cc(ccc1I)NCc2ccco2 270302a_100000198070_100000186105 [0,2,0,0,0,0|2,0,0]=4 10547 B16R2.1063 Cc1cc(ccc1I)NCc2cccs2 207a_100000198070_100000209959 [0,2,0,0,0,0|2,0,0]=4 10548 B16R2.1063 Cc1cc(ccc1I)NCc2cccs2 270302a_100000198070_100000209959 [0,2,0,0,0,0|2,0,0]=4 10549 B16R2.1063 Cc1cc(ccc1I)NCc2ccoc2 207a_100000198070_100011215517 [0,2,0,0,0,0|2,0,0]=4 10550 B16R2.1063 Cc1cc(ccc1I)NCc2ccon2 34a_100000198070_100000234950 [0,2,0,0,0,0|2,0,0]=4 10551 B16R2.1063 Cc1cc(ccc1I)NCc2ccon2 7a_100000198070_100000234950 [0,2,0,0,0,0|2,0,0]=4 10552 B16R2.1063 Cc1cc(ccc1I)NCc2ccsc2 207a_100000198070_100000188534 [0,2,0,0,0,0|2,0,0]=4 10553 B16R2.1063 Cc1cc(ccc1I)NCc2ccsc2 270302a_100000198070_100000188534 [0,2,0,0,0,0|2,0,0]=4 10554 B16R2.1063 Cc1cc(ccc1I)NCc2ccsc2 34a_100000198070_100011261437 [0,2,0,0,0,0|2,0,0]=4 10555 B16R2.1063 Cc1cc(ccc1I)NCc2ccsc2 7a_100000198070_100011261437 [0,2,0,0,0,0|2,0,0]=4 10556 B16R2.1063 Cc1cc(ccc1I)NCc2cn[nH]c2 207a_100000198070_100016992096 [0,2,0,0,0,0|2,0,0]=4 10557 B16R2.1063 Cc1cc(ccc1I)NCc2cn[nH]c2 270302a_100000198070_100016992096 [0,2,0,0,0,0|2,0,0]=4 10558 B16R2.1063 Cc1cc(ccc1I)NCc2cnc[nH]2 207a_100000198070_100000742939 [0,2,0,0,0,0|0,0,2]=4 10559 B16R2.1063 Cc1cc(ccc1I)NCc2cncs2 207a_100000198070_100000749870 [0,2,0,0,0,0|1,0,1]=4 10560 B16R2.1063 Cc1cc(ccc1I)NCc2cncs2 270302a_100000198070_100000749870 [0,2,0,0,0,0|1,0,1]=4 10561 B16R2.1063 Cc1cc(ccc1I)NCc2cncs2 34a_100000198070_100015185245 [0,2,0,0,0,0|1,0,1]=4 10562 B16R2.1063 Cc1cc(ccc1I)NCc2cncs2 7a_100000198070_100015185245 [0,2,0,0,0,0|1,0,1]=4 10563 B16R2.1063 Cc1cc(ccc1I)NCc2cscn2 207a_100000198070_100000743575 [0,2,0,0,0,0|1,0,0]=3 10564 B16R2.1063 Cc1cc(ccc1I)NCc2cscn2 270302a_100000198070_100000743575 [0,2,0,0,0,0|1,0,0]=3 10565 B16R2.1063 Cc1cc(ccc1I)NCc2cscn2 34a_100000198070_100000205941 [0,2,0,0,0,0|1,0,0]=3 10566 B16R2.1063 Cc1cc(ccc1I)NCc2cscn2 7a_100000198070_100000205941 [0,2,0,0,0,0|1,0,0]=3 10567 B16R2.1063 Cc1cc(ccc1I)NCc2ncc[nH]2 207a_100000198070_100000743867 [0,2,0,0,0,0|2,0,0]=4 10568 B16R2.1063 Cc1cc(ccc1I)NCc2ncc[nH]2 34a_100000198070_100016991755 [0,2,0,0,0,0|2,0,0]=4 10569 B16R2.1063 Cc1cc(ccc1I)NCc2ncc[nH]2 7a_100000198070_100000753453 [0,2,0,0,0,0|2,0,0]=4 10570 B16R2.1063 Cc1cc(ccc1I)NCc2ncco2 34a_100000198070_103436540062 [0,2,0,0,0,0|2,0,0]=4 10571 B16R2.1063 Cc1cc(ccc1I)NCc2ncco2 7a_100000198070_103436540062 [0,2,0,0,0,0|2,0,0]=4 10572 B16R2.1063 Cc1cc(ccc1I)NCc2nccs2 207a_100000198070_100000750902 [0,2,0,0,0,0|2,0,0]=4 10573 B16R2.1063 Cc1cc(ccc1I)NCc2nccs2 270302a_100000198070_100000750902 [0,2,0,0,0,0|2,0,0]=4 10574 B16R2.1063 Cc1cc(ccc1I)NCc2nccs2 34a_100000198070_100015184050 [0,2,0,0,0,0|2,0,0]=4 10575 B16R2.1063 Cc1cc(ccc1I)NCc2nccs2 7a_100000198070_100015184050 [0,2,0,0,0,0|2,0,0]=4 10576 B16R2.1063 Cc1cc(ccc1I)NCc2ncon2 34a_100000198070_100000233494 [0,2,0,0,0,0|2,0,0]=4 10577 B16R2.1063 Cc1cc(ccc1I)NCn2cncn2 34a_100000198070_200020645497 [0,2,0,0,0,0|1,0,1]=4 10578 B16R2.1063 Cc1cc(ccc1I)NCn2cncn2 7a_100000198070_200020645497 [0,2,0,0,0,0|1,0,1]=4 10579 B16R2.1063 Cc1cc(ccc1I)OCc2c[nH]cn2 34a_100000729255_100000707719 [0,2,0,0,0,0|1,0,0]=3 10580 B16R2.1063 Cc1cc(ccc1I)OCc2cscn2 34a_100000729255_100000205941 [0,2,0,0,0,0|2,0,0]=4 10581 B16R2.1063 Cc1cc(ccc1I)OCc2cscn2 7a_100000729255_100000205941 [0,2,0,0,0,0|2,0,0]=4 10582 B16R2.1063 Cc1cc(ccc1N)OCc2c[nH]cn2 34a_100000756630_100000707719 [0,2,0,0,0,0|1,0,0]=3 10583 B16R2.1063 Cc1cc(ccc1N)OCc2cscn2 34a_100000756630_100000205941 [0,2,0,0,0,0|2,0,0]=4 10584 B16R2.1063 Cc1cc(ccc1N)OCc2cscn2 7a_100000756630_100000205941 [0,2,0,0,0,0|2,0,0]=4 10585 B16R2.1063 Cc1cc(ccc1N)SCc2c[nH]cn2 62a_100000211769_100000707719 [0,2,0,0,0,0|1,0,0]=3 10586 B16R2.1063 Cc1cc(ccc1N)SCc2c[nH]cn2 62a_100000707719_100000211769 [0,2,0,0,0,0|1,0,0]=3 10587 B16R2.1063 Cc1cc(ccc1N)SCc2cscn2 62a_100000205941_100000211769 [0,2,0,0,0,0|2,0,0]=4 10588 B16R2.1063 Cc1cc(ccc1N)SCc2cscn2 62a_100000211769_100000205941 [0,2,0,0,0,0|2,0,0]=4 10589 B16R2.1063 Cc1cc(ccc1O)NCc2c[nH]cn2 34a_100011218179_100000707719 [0,2,0,0,0,0|0,0,0]=2 10590 B16R2.1063 Cc1cc(ccc1O)NCc2ccco2 270302a_100011218179_100000186105 [0,2,0,0,0,0|2,0,0]=4 10591 B16R2.1063 Cc1cc(ccc1O)NCc2cccs2 270302a_100011218179_100000209959 [0,2,0,0,0,0|2,0,0]=4 10592 B16R2.1063 Cc1cc(ccc1O)NCc2ccon2 34a_100011218179_100000234950 [0,2,0,0,0,0|2,0,0]=4 10593 B16R2.1063 Cc1cc(ccc1O)NCc2ccon2 7a_100011218179_100000234950 [0,2,0,0,0,0|2,0,0]=4 10594 B16R2.1063 Cc1cc(ccc1O)NCc2ccsc2 270302a_100011218179_100000188534 [0,2,0,0,0,0|2,0,0]=4 10595 B16R2.1063 Cc1cc(ccc1O)NCc2ccsc2 34a_100011218179_100011261437 [0,2,0,0,0,0|2,0,0]=4 10596 B16R2.1063 Cc1cc(ccc1O)NCc2ccsc2 7a_100011218179_100011261437 [0,2,0,0,0,0|2,0,0]=4 10597 B16R2.1063 Cc1cc(ccc1O)NCc2cn[nH]c2 270302a_100011218179_100016992096 [0,2,0,0,0,0|2,0,0]=4 10598 B16R2.1063 Cc1cc(ccc1O)NCc2cncs2 270302a_100011218179_100000749870 [0,2,0,0,0,0|1,0,1]=4 10599 B16R2.1063 Cc1cc(ccc1O)NCc2cncs2 34a_100011218179_100015185245 [0,2,0,0,0,0|1,0,1]=4 10600 B16R2.1063 Cc1cc(ccc1O)NCc2cncs2 7a_100011218179_100015185245 [0,2,0,0,0,0|1,0,1]=4 10601 B16R2.1063 Cc1cc(ccc1O)NCc2cscn2 270302a_100011218179_100000743575 [0,2,0,0,0,0|1,0,0]=3 10602 B16R2.1063 Cc1cc(ccc1O)NCc2cscn2 34a_100011218179_100000205941 [0,2,0,0,0,0|1,0,0]=3 10603 B16R2.1063 Cc1cc(ccc1O)NCc2cscn2 7a_100011218179_100000205941 [0,2,0,0,0,0|1,0,0]=3 10604 B16R2.1063 Cc1cc(ccc1O)NCc2ncc[nH]2 34a_100011218179_100016991755 [0,2,0,0,0,0|2,0,0]=4 10605 B16R2.1063 Cc1cc(ccc1O)NCc2ncc[nH]2 7a_100011218179_100000753453 [0,2,0,0,0,0|2,0,0]=4 10606 B16R2.1063 Cc1cc(ccc1O)NCc2ncco2 34a_100011218179_103436540062 [0,2,0,0,0,0|2,0,0]=4 10607 B16R2.1063 Cc1cc(ccc1O)NCc2ncco2 7a_100011218179_103436540062 [0,2,0,0,0,0|2,0,0]=4 10608 B16R2.1063 Cc1cc(ccc1O)NCc2nccs2 270302a_100011218179_100000750902 [0,2,0,0,0,0|2,0,0]=4 10609 B16R2.1063 Cc1cc(ccc1O)NCc2nccs2 34a_100011218179_100015184050 [0,2,0,0,0,0|2,0,0]=4 10610 B16R2.1063 Cc1cc(ccc1O)NCc2nccs2 7a_100011218179_100015184050 [0,2,0,0,0,0|2,0,0]=4 10611 B16R2.1063 Cc1cc(ccc1O)NCc2ncon2 34a_100011218179_100000233494 [0,2,0,0,0,0|2,0,0]=4 10612 B16R2.1063 Cc1cc(ccc1O)NCn2cncn2 34a_100011218179_200020645497 [0,2,0,0,0,0|1,0,1]=4 10613 B16R2.1063 Cc1cc(ccc1O)NCn2cncn2 7a_100011218179_200020645497 [0,2,0,0,0,0|1,0,1]=4 10614 B16R2.1063 Cc1cc(ccc1O)SCc2c[nH]cn2 62a_100000707719_100000186361 [0,2,0,0,0,0|1,0,0]=3 10615 B16R2.1063 Cc1cc(ccc1O)SCc2cscn2 62a_100000205941_100000186361 [0,2,0,0,0,0|2,0,0]=4 10616 B16R2.1063 Cc1cc(cnc1Br)OCc2c[nH]cn2 34a_100012000486_100000707719 [0,2,0,0,0,0|2,0,0]=4 10617 B16R2.1063 Cc1cc(cnc1Br)SCc2c[nH]cn2 62a_100000707719_100009816107 [0,2,0,0,0,0|2,0,0]=4 10618 B16R2.1063 Cc1cc(cnc1Br)SCc2c[nH]cn2 62a_100009816107_100000707719 [0,2,0,0,0,0|2,0,0]=4 10619 B16R2.1063 Cc1cc(cnc1C)OCc2c[nH]cn2 34a_100009854398_100000707719 [0,2,0,0,0,0|2,0,0]=4 10620 B16R2.1063 Cc1cc(cnc1C)SCc2c[nH]cn2 62a_100000697892_100000707719 [0,2,0,0,0,0|2,0,0]=4 10621 B16R2.1063 Cc1cc(cnc1C)SCc2c[nH]cn2 62a_100000707719_100000697892 [0,2,0,0,0,0|2,0,0]=4 10622 B16R2.1063 Cc1cc(cnc1Cl)OCc2c[nH]cn2 34a_100012002680_100000707719 [0,2,0,0,0,0|2,0,0]=4 10623 B16R2.1063 Cc1cc(cnc1Cl)SCc2c[nH]cn2 62a_100000707719_100009922867 [0,2,0,0,0,0|2,0,0]=4 10624 B16R2.1063 Cc1cc(cnc1Cl)SCc2c[nH]cn2 62a_100009922867_100000707719 [0,2,0,0,0,0|2,0,0]=4 10625 B16R2.1063 Cc1cc(cnc1F)OCc2c[nH]cn2 34a_100000094615_100000707719 [0,2,0,0,0,0|2,0,0]=4 10626 B16R2.1063 Cc1cc(cnc1F)SCc2c[nH]cn2 62a_100000707719_100000709442 [0,2,0,0,0,0|2,0,0]=4 10627 B16R2.1063 Cc1cc(cnc1F)SCc2c[nH]cn2 62a_100000709442_100000707719 [0,2,0,0,0,0|2,0,0]=4 10628 B16R2.1063 Cc1cc(cnc1N)SCc2c[nH]cn2 62a_100000684428_100000707719 [0,2,0,0,0,0|2,0,0]=4 10629 B16R2.1063 Cc1cc(cnc1N)SCc2c[nH]cn2 62a_100000707719_100000684428 [0,2,0,0,0,0|2,0,0]=4 10630 B16R2.1063 Cc1cc(cnc1O)SCc2c[nH]cn2 62a_100000685391_100000707719 [0,2,0,0,0,0|2,0,0]=4 10631 B16R2.1063 Cc1cc(cnc1O)SCc2c[nH]cn2 62a_100000707719_100000685391 [0,2,0,0,0,0|2,0,0]=4 10632 B16R2.1063 Cc1cc(ncc1Br)OCc2c[nH]cn2 34a_100000766222_100000707719 [0,2,0,0,0,0|2,0,0]=4 10633 B16R2.1063 Cc1cc(ncc1Br)SCc2c[nH]cn2 62a_100000707719_100012356354 [0,2,0,0,0,0|2,0,0]=4 10634 B16R2.1063 Cc1cc(ncc1Br)SCc2c[nH]cn2 62a_100012356354_100000707719 [0,2,0,0,0,0|2,0,0]=4 10635 B16R2.1063 Cc1cc(ncc1Cl)OCc2c[nH]cn2 34a_200000085746_100000707719 [0,2,0,0,0,0|2,0,0]=4 10636 B16R2.1063 Cc1cc(ncc1F)SCc2c[nH]cn2 62a_100000707719_100009818257 [0,2,0,0,0,0|2,0,0]=4 10637 B16R2.1063 Cc1cc(ncc1F)SCc2c[nH]cn2 62a_100009818257_100000707719 [0,2,0,0,0,0|2,0,0]=4 10638 B16R2.1063 Cc1cc(ncc1N)SCc2c[nH]cn2 62a_100000067204_100000707719 [0,2,0,0,0,0|2,0,0]=4 10639 B16R2.1063 Cc1cc(ncc1N)SCc2c[nH]cn2 62a_100000707719_100000067204 [0,2,0,0,0,0|2,0,0]=4 10640 B16R2.1063 Cc1cc(ncc1O)SCc2c[nH]cn2 62a_100000707719_100000692680 [0,2,0,0,0,0|2,0,0]=4 10641 B16R2.1063 Cc1ccc(c[n+]1[O-])SCc2c[nH]cn2 62a_100000707719_100000703231 [0,2,0,0,0,0|2,0,0]=4 10642 B16R2.1063 Cc1ccc(cc1Br)CSc2c[nH]cn2 62a_100000756875_100012232412 [0,2,0,0,0,0|2,0,0]=4 10643 B16R2.1063 Cc1ccc(cc1Br)CSc2c[nH]cn2 62a_100012232412_100000756875 [0,2,0,0,0,0|2,0,0]=4 10644 B16R2.1063 Cc1ccc(cc1Br)NCc2c[nH]cn2 2230a_100000736455_100000707719 [0,2,0,0,0,0|0,0,0]=2 10645 B16R2.1063 Cc1ccc(cc1Br)NCc2c[nH]cn2 34a_100000736455_100000707719 [0,2,0,0,0,0|0,0,0]=2 10646 B16R2.1063 Cc1ccc(cc1Br)NCc2cc[nH]n2 207a_100000736455_100000738523 [0,2,0,0,0,0|2,0,0]=4 10647 B16R2.1063 Cc1ccc(cc1Br)NCc2ccco2 207a_100000736455_100000186105 [0,2,0,0,0,0|2,0,0]=4 10648 B16R2.1063 Cc1ccc(cc1Br)NCc2ccco2 270302a_100000736455_100000186105 [0,2,0,0,0,0|2,0,0]=4 10649 B16R2.1063 Cc1ccc(cc1Br)NCc2cccs2 207a_100000736455_100000209959 [0,2,0,0,0,0|2,0,0]=4 10650 B16R2.1063 Cc1ccc(cc1Br)NCc2cccs2 270302a_100000736455_100000209959 [0,2,0,0,0,0|2,0,0]=4 10651 B16R2.1063 Cc1ccc(cc1Br)NCc2ccoc2 207a_100000736455_100011215517 [0,2,0,0,0,0|2,0,0]=4 10652 B16R2.1063 Cc1ccc(cc1Br)NCc2ccon2 2230a_100000736455_100000234950 [0,2,0,0,0,0|2,0,0]=4 10653 B16R2.1063 Cc1ccc(cc1Br)NCc2ccon2 34a_100000736455_100000234950 [0,2,0,0,0,0|2,0,0]=4 10654 B16R2.1063 Cc1ccc(cc1Br)NCc2ccon2 7a_100000736455_100000234950 [0,2,0,0,0,0|2,0,0]=4 10655 B16R2.1063 Cc1ccc(cc1Br)NCc2ccsc2 207a_100000736455_100000188534 [0,2,0,0,0,0|2,0,0]=4 10656 B16R2.1063 Cc1ccc(cc1Br)NCc2ccsc2 2230a_100000736455_100011261437 [0,2,0,0,0,0|2,0,0]=4 10657 B16R2.1063 Cc1ccc(cc1Br)NCc2ccsc2 270302a_100000736455_100000188534 [0,2,0,0,0,0|2,0,0]=4 10658 B16R2.1063 Cc1ccc(cc1Br)NCc2ccsc2 34a_100000736455_100011261437 [0,2,0,0,0,0|2,0,0]=4 10659 B16R2.1063 Cc1ccc(cc1Br)NCc2ccsc2 7a_100000736455_100011261437 [0,2,0,0,0,0|2,0,0]=4 10660 B16R2.1063 Cc1ccc(cc1Br)NCc2cn[nH]c2 207a_100000736455_100016992096 [0,2,0,0,0,0|2,0,0]=4 10661 B16R2.1063 Cc1ccc(cc1Br)NCc2cn[nH]c2 270302a_100000736455_100016992096 [0,2,0,0,0,0|2,0,0]=4 10662 B16R2.1063 Cc1ccc(cc1Br)NCc2cnc[nH]2 207a_100000736455_100000742939 [0,2,0,0,0,0|0,0,2]=4 10663 B16R2.1063 Cc1ccc(cc1Br)NCc2cncs2 207a_100000736455_100000749870 [0,2,0,0,0,0|1,0,1]=4 10664 B16R2.1063 Cc1ccc(cc1Br)NCc2cncs2 2230a_100000736455_100015185245 [0,2,0,0,0,0|1,0,1]=4 10665 B16R2.1063 Cc1ccc(cc1Br)NCc2cncs2 270302a_100000736455_100000749870 [0,2,0,0,0,0|1,0,1]=4 10666 B16R2.1063 Cc1ccc(cc1Br)NCc2cncs2 34a_100000736455_100015185245 [0,2,0,0,0,0|1,0,1]=4 10667 B16R2.1063 Cc1ccc(cc1Br)NCc2cncs2 7a_100000736455_100015185245 [0,2,0,0,0,0|1,0,1]=4 10668 B16R2.1063 Cc1ccc(cc1Br)NCc2cscn2 207a_100000736455_100000743575 [0,2,0,0,0,0|1,0,0]=3 10669 B16R2.1063 Cc1ccc(cc1Br)NCc2cscn2 2230a_100000736455_100000205941 [0,2,0,0,0,0|1,0,0]=3 10670 B16R2.1063 Cc1ccc(cc1Br)NCc2cscn2 270302a_100000736455_100000743575 [0,2,0,0,0,0|1,0,0]=3 10671 B16R2.1063 Cc1ccc(cc1Br)NCc2cscn2 34a_100000736455_100000205941 [0,2,0,0,0,0|1,0,0]=3 10672 B16R2.1063 Cc1ccc(cc1Br)NCc2cscn2 7a_100000736455_100000205941 [0,2,0,0,0,0|1,0,0]=3 10673 B16R2.1063 Cc1ccc(cc1Br)NCc2ncc[nH]2 207a_100000736455_100000743867 [0,2,0,0,0,0|2,0,0]=4 10674 B16R2.1063 Cc1ccc(cc1Br)NCc2ncc[nH]2 2230a_100000736455_100016991755 [0,2,0,0,0,0|2,0,0]=4 10675 B16R2.1063 Cc1ccc(cc1Br)NCc2ncc[nH]2 34a_100000736455_100016991755 [0,2,0,0,0,0|2,0,0]=4 10676 B16R2.1063 Cc1ccc(cc1Br)NCc2ncc[nH]2 7a_100000736455_100000753453 [0,2,0,0,0,0|2,0,0]=4 10677 B16R2.1063 Cc1ccc(cc1Br)NCc2ncco2 2230a_100000736455_103436540062 [0,2,0,0,0,0|2,0,0]=4 10678 B16R2.1063 Cc1ccc(cc1Br)NCc2ncco2 34a_100000736455_103436540062 [0,2,0,0,0,0|2,0,0]=4 10679 B16R2.1063 Cc1ccc(cc1Br)NCc2ncco2 7a_100000736455_103436540062 [0,2,0,0,0,0|2,0,0]=4 10680 B16R2.1063 Cc1ccc(cc1Br)NCc2nccs2 207a_100000736455_100000750902 [0,2,0,0,0,0|2,0,0]=4 10681 B16R2.1063 Cc1ccc(cc1Br)NCc2nccs2 2230a_100000736455_100015184050 [0,2,0,0,0,0|2,0,0]=4 10682 B16R2.1063 Cc1ccc(cc1Br)NCc2nccs2 270302a_100000736455_100000750902 [0,2,0,0,0,0|2,0,0]=4 10683 B16R2.1063 Cc1ccc(cc1Br)NCc2nccs2 34a_100000736455_100015184050 [0,2,0,0,0,0|2,0,0]=4 10684 B16R2.1063 Cc1ccc(cc1Br)NCc2nccs2 7a_100000736455_100015184050 [0,2,0,0,0,0|2,0,0]=4 10685 B16R2.1063 Cc1ccc(cc1Br)NCc2ncon2 34a_100000736455_100000233494 [0,2,0,0,0,0|2,0,0]=4 10686 B16R2.1063 Cc1ccc(cc1Br)NCn2cncn2 2230a_100000736455_200020645497 [0,2,0,0,0,0|1,0,1]=4 10687 B16R2.1063 Cc1ccc(cc1Br)NCn2cncn2 34a_100000736455_200020645497 [0,2,0,0,0,0|1,0,1]=4 10688 B16R2.1063 Cc1ccc(cc1Br)NCn2cncn2 7a_100000736455_200020645497 [0,2,0,0,0,0|1,0,1]=4 10689 B16R2.1063 Cc1ccc(cc1Br)OCc2c[nH]cn2 34a_100011380479_100000707719 [0,2,0,0,0,0|1,0,0]=3 10690 B16R2.1063 Cc1ccc(cc1Br)OCc2cscn2 34a_100011380479_100000205941 [0,2,0,0,0,0|2,0,0]=4 10691 B16R2.1063 Cc1ccc(cc1Br)OCc2cscn2 7a_100011380479_100000205941 [0,2,0,0,0,0|2,0,0]=4 10692 B16R2.1063 Cc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100011847877 [0,2,0,0,0,0|1,0,0]=3 10693 B16R2.1063 Cc1ccc(cc1Br)SCc2c[nH]cn2 62a_100011847877_100000707719 [0,2,0,0,0,0|1,0,0]=3 10694 B16R2.1063 Cc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100011847877 [0,2,0,0,0,0|2,0,0]=4 10695 B16R2.1063 Cc1ccc(cc1Br)SCc2cscn2 62a_100011847877_100000205941 [0,2,0,0,0,0|2,0,0]=4 10696 B16R2.1063 Cc1ccc(cc1C)CSc2c[nH]cn2 62a_100000742320_100000756875 [0,2,0,0,0,0|2,0,0]=4 10697 B16R2.1063 Cc1ccc(cc1C)CSc2c[nH]cn2 62a_100000756875_100000742320 [0,2,0,0,0,0|2,0,0]=4 10698 B16R2.1063 Cc1ccc(cc1C)NCc2c[nH]cn2 2230a_100000724040_100000707719 [0,2,0,0,0,0|0,0,0]=2 10699 B16R2.1063 Cc1ccc(cc1C)NCc2c[nH]cn2 34a_100000724040_100000707719 [0,2,0,0,0,0|0,0,0]=2 10700 B16R2.1063 Cc1ccc(cc1C)NCc2cc[nH]n2 207a_100000724040_100000738523 [0,2,0,0,0,0|2,0,0]=4 10701 B16R2.1063 Cc1ccc(cc1C)NCc2ccco2 207a_100000724040_100000186105 [0,2,0,0,0,0|2,0,0]=4 10702 B16R2.1063 Cc1ccc(cc1C)NCc2ccco2 270302a_100000724040_100000186105 [0,2,0,0,0,0|2,0,0]=4 10703 B16R2.1063 Cc1ccc(cc1C)NCc2cccs2 207a_100000724040_100000209959 [0,2,0,0,0,0|2,0,0]=4 10704 B16R2.1063 Cc1ccc(cc1C)NCc2cccs2 270302a_100000724040_100000209959 [0,2,0,0,0,0|2,0,0]=4 10705 B16R2.1063 Cc1ccc(cc1C)NCc2ccoc2 207a_100000724040_100011215517 [0,2,0,0,0,0|2,0,0]=4 10706 B16R2.1063 Cc1ccc(cc1C)NCc2ccon2 2230a_100000724040_100000234950 [0,2,0,0,0,0|2,0,0]=4 10707 B16R2.1063 Cc1ccc(cc1C)NCc2ccon2 34a_100000724040_100000234950 [0,2,0,0,0,0|2,0,0]=4 10708 B16R2.1063 Cc1ccc(cc1C)NCc2ccon2 7a_100000724040_100000234950 [0,2,0,0,0,0|2,0,0]=4 10709 B16R2.1063 Cc1ccc(cc1C)NCc2ccsc2 207a_100000724040_100000188534 [0,2,0,0,0,0|2,0,0]=4 10710 B16R2.1063 Cc1ccc(cc1C)NCc2ccsc2 2230a_100000724040_100011261437 [0,2,0,0,0,0|2,0,0]=4 10711 B16R2.1063 Cc1ccc(cc1C)NCc2ccsc2 270302a_100000724040_100000188534 [0,2,0,0,0,0|2,0,0]=4 10712 B16R2.1063 Cc1ccc(cc1C)NCc2ccsc2 34a_100000724040_100011261437 [0,2,0,0,0,0|2,0,0]=4 10713 B16R2.1063 Cc1ccc(cc1C)NCc2ccsc2 7a_100000724040_100011261437 [0,2,0,0,0,0|2,0,0]=4 10714 B16R2.1063 Cc1ccc(cc1C)NCc2cn[nH]c2 207a_100000724040_100016992096 [0,2,0,0,0,0|2,0,0]=4 10715 B16R2.1063 Cc1ccc(cc1C)NCc2cn[nH]c2 270302a_100000724040_100016992096 [0,2,0,0,0,0|2,0,0]=4 10716 B16R2.1063 Cc1ccc(cc1C)NCc2cnc[nH]2 207a_100000724040_100000742939 [0,2,0,0,0,0|0,0,2]=4 10717 B16R2.1063 Cc1ccc(cc1C)NCc2cncs2 207a_100000724040_100000749870 [0,2,0,0,0,0|1,0,1]=4 10718 B16R2.1063 Cc1ccc(cc1C)NCc2cncs2 2230a_100000724040_100015185245 [0,2,0,0,0,0|1,0,1]=4 10719 B16R2.1063 Cc1ccc(cc1C)NCc2cncs2 270302a_100000724040_100000749870 [0,2,0,0,0,0|1,0,1]=4 10720 B16R2.1063 Cc1ccc(cc1C)NCc2cncs2 34a_100000724040_100015185245 [0,2,0,0,0,0|1,0,1]=4 10721 B16R2.1063 Cc1ccc(cc1C)NCc2cncs2 7a_100000724040_100015185245 [0,2,0,0,0,0|1,0,1]=4 10722 B16R2.1063 Cc1ccc(cc1C)NCc2cscn2 207a_100000724040_100000743575 [0,2,0,0,0,0|1,0,0]=3 10723 B16R2.1063 Cc1ccc(cc1C)NCc2cscn2 2230a_100000724040_100000205941 [0,2,0,0,0,0|1,0,0]=3 10724 B16R2.1063 Cc1ccc(cc1C)NCc2cscn2 270302a_100000724040_100000743575 [0,2,0,0,0,0|1,0,0]=3 10725 B16R2.1063 Cc1ccc(cc1C)NCc2cscn2 34a_100000724040_100000205941 [0,2,0,0,0,0|1,0,0]=3 10726 B16R2.1063 Cc1ccc(cc1C)NCc2cscn2 7a_100000724040_100000205941 [0,2,0,0,0,0|1,0,0]=3 10727 B16R2.1063 Cc1ccc(cc1C)NCc2ncc[nH]2 207a_100000724040_100000743867 [0,2,0,0,0,0|2,0,0]=4 10728 B16R2.1063 Cc1ccc(cc1C)NCc2ncc[nH]2 2230a_100000724040_100016991755 [0,2,0,0,0,0|2,0,0]=4 10729 B16R2.1063 Cc1ccc(cc1C)NCc2ncc[nH]2 34a_100000724040_100016991755 [0,2,0,0,0,0|2,0,0]=4 10730 B16R2.1063 Cc1ccc(cc1C)NCc2ncc[nH]2 7a_100000724040_100000753453 [0,2,0,0,0,0|2,0,0]=4 10731 B16R2.1063 Cc1ccc(cc1C)NCc2ncco2 2230a_100000724040_103436540062 [0,2,0,0,0,0|2,0,0]=4 10732 B16R2.1063 Cc1ccc(cc1C)NCc2ncco2 34a_100000724040_103436540062 [0,2,0,0,0,0|2,0,0]=4 10733 B16R2.1063 Cc1ccc(cc1C)NCc2ncco2 7a_100000724040_103436540062 [0,2,0,0,0,0|2,0,0]=4 10734 B16R2.1063 Cc1ccc(cc1C)NCc2nccs2 207a_100000724040_100000750902 [0,2,0,0,0,0|2,0,0]=4 10735 B16R2.1063 Cc1ccc(cc1C)NCc2nccs2 2230a_100000724040_100015184050 [0,2,0,0,0,0|2,0,0]=4 10736 B16R2.1063 Cc1ccc(cc1C)NCc2nccs2 270302a_100000724040_100000750902 [0,2,0,0,0,0|2,0,0]=4 10737 B16R2.1063 Cc1ccc(cc1C)NCc2nccs2 34a_100000724040_100015184050 [0,2,0,0,0,0|2,0,0]=4 10738 B16R2.1063 Cc1ccc(cc1C)NCc2nccs2 7a_100000724040_100015184050 [0,2,0,0,0,0|2,0,0]=4 10739 B16R2.1063 Cc1ccc(cc1C)NCc2ncon2 34a_100000724040_100000233494 [0,2,0,0,0,0|2,0,0]=4 10740 B16R2.1063 Cc1ccc(cc1C)NCn2cncn2 2230a_100000724040_200020645497 [0,2,0,0,0,0|1,0,1]=4 10741 B16R2.1063 Cc1ccc(cc1C)NCn2cncn2 34a_100000724040_200020645497 [0,2,0,0,0,0|1,0,1]=4 10742 B16R2.1063 Cc1ccc(cc1C)NCn2cncn2 7a_100000724040_200020645497 [0,2,0,0,0,0|1,0,1]=4 10743 B16R2.1063 Cc1ccc(cc1C)OCc2c[nH]cn2 34a_100000210932_100000707719 [0,2,0,0,0,0|1,0,0]=3 10744 B16R2.1063 Cc1ccc(cc1C)OCc2cscn2 34a_100000210932_100000205941 [0,2,0,0,0,0|2,0,0]=4 10745 B16R2.1063 Cc1ccc(cc1C)OCc2cscn2 7a_100000210932_100000205941 [0,2,0,0,0,0|2,0,0]=4 10746 B16R2.1063 Cc1ccc(cc1C)SCc2c[nH]cn2 62a_100000707719_100011215607 [0,2,0,0,0,0|1,0,0]=3 10747 B16R2.1063 Cc1ccc(cc1C)SCc2c[nH]cn2 62a_100011215607_100000707719 [0,2,0,0,0,0|1,0,0]=3 10748 B16R2.1063 Cc1ccc(cc1C)SCc2cscn2 62a_100000205941_100011215607 [0,2,0,0,0,0|2,0,0]=4 10749 B16R2.1063 Cc1ccc(cc1C)SCc2cscn2 62a_100011215607_100000205941 [0,2,0,0,0,0|2,0,0]=4 10750 B16R2.1063 Cc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100000756875_100011823929 [0,2,0,0,0,0|2,0,0]=4 10751 B16R2.1063 Cc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100011823929_100000756875 [0,2,0,0,0,0|2,0,0]=4 10752 B16R2.1063 Cc1ccc(cc1Cl)NCc2c[nH]cn2 2230a_100000188892_100000707719 [0,2,0,0,0,0|0,0,0]=2 10753 B16R2.1063 Cc1ccc(cc1Cl)NCc2c[nH]cn2 34a_100000188892_100000707719 [0,2,0,0,0,0|0,0,0]=2 10754 B16R2.1063 Cc1ccc(cc1Cl)NCc2cc[nH]n2 207a_100000188892_100000738523 [0,2,0,0,0,0|2,0,0]=4 10755 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccco2 207a_100000188892_100000186105 [0,2,0,0,0,0|2,0,0]=4 10756 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccco2 270302a_100000188892_100000186105 [0,2,0,0,0,0|2,0,0]=4 10757 B16R2.1063 Cc1ccc(cc1Cl)NCc2cccs2 207a_100000188892_100000209959 [0,2,0,0,0,0|2,0,0]=4 10758 B16R2.1063 Cc1ccc(cc1Cl)NCc2cccs2 270302a_100000188892_100000209959 [0,2,0,0,0,0|2,0,0]=4 10759 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccoc2 207a_100000188892_100011215517 [0,2,0,0,0,0|2,0,0]=4 10760 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccon2 2230a_100000188892_100000234950 [0,2,0,0,0,0|2,0,0]=4 10761 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccon2 34a_100000188892_100000234950 [0,2,0,0,0,0|2,0,0]=4 10762 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccon2 7a_100000188892_100000234950 [0,2,0,0,0,0|2,0,0]=4 10763 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccsc2 207a_100000188892_100000188534 [0,2,0,0,0,0|2,0,0]=4 10764 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccsc2 2230a_100000188892_100011261437 [0,2,0,0,0,0|2,0,0]=4 10765 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccsc2 270302a_100000188892_100000188534 [0,2,0,0,0,0|2,0,0]=4 10766 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccsc2 34a_100000188892_100011261437 [0,2,0,0,0,0|2,0,0]=4 10767 B16R2.1063 Cc1ccc(cc1Cl)NCc2ccsc2 7a_100000188892_100011261437 [0,2,0,0,0,0|2,0,0]=4 10768 B16R2.1063 Cc1ccc(cc1Cl)NCc2cn[nH]c2 207a_100000188892_100016992096 [0,2,0,0,0,0|2,0,0]=4 10769 B16R2.1063 Cc1ccc(cc1Cl)NCc2cn[nH]c2 270302a_100000188892_100016992096 [0,2,0,0,0,0|2,0,0]=4 10770 B16R2.1063 Cc1ccc(cc1Cl)NCc2cnc[nH]2 207a_100000188892_100000742939 [0,2,0,0,0,0|0,0,2]=4 10771 B16R2.1063 Cc1ccc(cc1Cl)NCc2cncs2 207a_100000188892_100000749870 [0,2,0,0,0,0|1,0,1]=4 10772 B16R2.1063 Cc1ccc(cc1Cl)NCc2cncs2 2230a_100000188892_100015185245 [0,2,0,0,0,0|1,0,1]=4 10773 B16R2.1063 Cc1ccc(cc1Cl)NCc2cncs2 270302a_100000188892_100000749870 [0,2,0,0,0,0|1,0,1]=4 10774 B16R2.1063 Cc1ccc(cc1Cl)NCc2cncs2 34a_100000188892_100015185245 [0,2,0,0,0,0|1,0,1]=4 10775 B16R2.1063 Cc1ccc(cc1Cl)NCc2cncs2 7a_100000188892_100015185245 [0,2,0,0,0,0|1,0,1]=4 10776 B16R2.1063 Cc1ccc(cc1Cl)NCc2cscn2 207a_100000188892_100000743575 [0,2,0,0,0,0|1,0,0]=3 10777 B16R2.1063 Cc1ccc(cc1Cl)NCc2cscn2 2230a_100000188892_100000205941 [0,2,0,0,0,0|1,0,0]=3 10778 B16R2.1063 Cc1ccc(cc1Cl)NCc2cscn2 270302a_100000188892_100000743575 [0,2,0,0,0,0|1,0,0]=3 10779 B16R2.1063 Cc1ccc(cc1Cl)NCc2cscn2 34a_100000188892_100000205941 [0,2,0,0,0,0|1,0,0]=3 10780 B16R2.1063 Cc1ccc(cc1Cl)NCc2cscn2 7a_100000188892_100000205941 [0,2,0,0,0,0|1,0,0]=3 10781 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncc[nH]2 207a_100000188892_100000743867 [0,2,0,0,0,0|2,0,0]=4 10782 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncc[nH]2 2230a_100000188892_100016991755 [0,2,0,0,0,0|2,0,0]=4 10783 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncc[nH]2 34a_100000188892_100016991755 [0,2,0,0,0,0|2,0,0]=4 10784 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncc[nH]2 7a_100000188892_100000753453 [0,2,0,0,0,0|2,0,0]=4 10785 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncco2 2230a_100000188892_103436540062 [0,2,0,0,0,0|2,0,0]=4 10786 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncco2 34a_100000188892_103436540062 [0,2,0,0,0,0|2,0,0]=4 10787 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncco2 7a_100000188892_103436540062 [0,2,0,0,0,0|2,0,0]=4 10788 B16R2.1063 Cc1ccc(cc1Cl)NCc2nccs2 207a_100000188892_100000750902 [0,2,0,0,0,0|2,0,0]=4 10789 B16R2.1063 Cc1ccc(cc1Cl)NCc2nccs2 2230a_100000188892_100015184050 [0,2,0,0,0,0|2,0,0]=4 10790 B16R2.1063 Cc1ccc(cc1Cl)NCc2nccs2 270302a_100000188892_100000750902 [0,2,0,0,0,0|2,0,0]=4 10791 B16R2.1063 Cc1ccc(cc1Cl)NCc2nccs2 34a_100000188892_100015184050 [0,2,0,0,0,0|2,0,0]=4 10792 B16R2.1063 Cc1ccc(cc1Cl)NCc2nccs2 7a_100000188892_100015184050 [0,2,0,0,0,0|2,0,0]=4 10793 B16R2.1063 Cc1ccc(cc1Cl)NCc2ncon2 34a_100000188892_100000233494 [0,2,0,0,0,0|2,0,0]=4 10794 B16R2.1063 Cc1ccc(cc1Cl)NCn2cncn2 2230a_100000188892_200020645497 [0,2,0,0,0,0|1,0,1]=4 10795 B16R2.1063 Cc1ccc(cc1Cl)NCn2cncn2 34a_100000188892_200020645497 [0,2,0,0,0,0|1,0,1]=4 10796 B16R2.1063 Cc1ccc(cc1Cl)NCn2cncn2 7a_100000188892_200020645497 [0,2,0,0,0,0|1,0,1]=4 10797 B16R2.1063 Cc1ccc(cc1Cl)OCc2c[nH]cn2 34a_100011265682_100000707719 [0,2,0,0,0,0|1,0,0]=3 10798 B16R2.1063 Cc1ccc(cc1Cl)OCc2cscn2 34a_100011265682_100000205941 [0,2,0,0,0,0|2,0,0]=4 10799 B16R2.1063 Cc1ccc(cc1Cl)OCc2cscn2 7a_100011265682_100000205941 [0,2,0,0,0,0|2,0,0]=4 10800 B16R2.1063 Cc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100011216363 [0,2,0,0,0,0|1,0,0]=3 10801 B16R2.1063 Cc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100011216363_100000707719 [0,2,0,0,0,0|1,0,0]=3 10802 B16R2.1063 Cc1ccc(cc1Cl)SCc2cscn2 62a_100000205941_100011216363 [0,2,0,0,0,0|2,0,0]=4 10803 B16R2.1063 Cc1ccc(cc1Cl)SCc2cscn2 62a_100011216363_100000205941 [0,2,0,0,0,0|2,0,0]=4 10804 B16R2.1063 Cc1ccc(cc1F)CSc2c[nH]cn2 62a_100000756875_100011217369 [0,2,0,0,0,0|2,0,0]=4 10805 B16R2.1063 Cc1ccc(cc1F)CSc2c[nH]cn2 62a_100011217369_100000756875 [0,2,0,0,0,0|2,0,0]=4 10806 B16R2.1063 Cc1ccc(cc1F)NCc2c[nH]cn2 2230a_100000210958_100000707719 [0,2,0,0,0,0|0,0,0]=2 10807 B16R2.1063 Cc1ccc(cc1F)NCc2c[nH]cn2 34a_100000210958_100000707719 [0,2,0,0,0,0|0,0,0]=2 10808 B16R2.1063 Cc1ccc(cc1F)NCc2cc[nH]n2 207a_100000210958_100000738523 [0,2,0,0,0,0|2,0,0]=4 10809 B16R2.1063 Cc1ccc(cc1F)NCc2ccco2 207a_100000210958_100000186105 [0,2,0,0,0,0|2,0,0]=4 10810 B16R2.1063 Cc1ccc(cc1F)NCc2ccco2 270302a_100000210958_100000186105 [0,2,0,0,0,0|2,0,0]=4 10811 B16R2.1063 Cc1ccc(cc1F)NCc2cccs2 207a_100000210958_100000209959 [0,2,0,0,0,0|2,0,0]=4 10812 B16R2.1063 Cc1ccc(cc1F)NCc2cccs2 270302a_100000210958_100000209959 [0,2,0,0,0,0|2,0,0]=4 10813 B16R2.1063 Cc1ccc(cc1F)NCc2ccoc2 207a_100000210958_100011215517 [0,2,0,0,0,0|2,0,0]=4 10814 B16R2.1063 Cc1ccc(cc1F)NCc2ccon2 2230a_100000210958_100000234950 [0,2,0,0,0,0|2,0,0]=4 10815 B16R2.1063 Cc1ccc(cc1F)NCc2ccon2 34a_100000210958_100000234950 [0,2,0,0,0,0|2,0,0]=4 10816 B16R2.1063 Cc1ccc(cc1F)NCc2ccon2 7a_100000210958_100000234950 [0,2,0,0,0,0|2,0,0]=4 10817 B16R2.1063 Cc1ccc(cc1F)NCc2ccsc2 207a_100000210958_100000188534 [0,2,0,0,0,0|2,0,0]=4 10818 B16R2.1063 Cc1ccc(cc1F)NCc2ccsc2 2230a_100000210958_100011261437 [0,2,0,0,0,0|2,0,0]=4 10819 B16R2.1063 Cc1ccc(cc1F)NCc2ccsc2 270302a_100000210958_100000188534 [0,2,0,0,0,0|2,0,0]=4 10820 B16R2.1063 Cc1ccc(cc1F)NCc2ccsc2 34a_100000210958_100011261437 [0,2,0,0,0,0|2,0,0]=4 10821 B16R2.1063 Cc1ccc(cc1F)NCc2ccsc2 7a_100000210958_100011261437 [0,2,0,0,0,0|2,0,0]=4 10822 B16R2.1063 Cc1ccc(cc1F)NCc2cn[nH]c2 207a_100000210958_100016992096 [0,2,0,0,0,0|2,0,0]=4 10823 B16R2.1063 Cc1ccc(cc1F)NCc2cn[nH]c2 270302a_100000210958_100016992096 [0,2,0,0,0,0|2,0,0]=4 10824 B16R2.1063 Cc1ccc(cc1F)NCc2cnc[nH]2 207a_100000210958_100000742939 [0,2,0,0,0,0|0,0,2]=4 10825 B16R2.1063 Cc1ccc(cc1F)NCc2cncs2 207a_100000210958_100000749870 [0,2,0,0,0,0|1,0,1]=4 10826 B16R2.1063 Cc1ccc(cc1F)NCc2cncs2 2230a_100000210958_100015185245 [0,2,0,0,0,0|1,0,1]=4 10827 B16R2.1063 Cc1ccc(cc1F)NCc2cncs2 270302a_100000210958_100000749870 [0,2,0,0,0,0|1,0,1]=4 10828 B16R2.1063 Cc1ccc(cc1F)NCc2cncs2 34a_100000210958_100015185245 [0,2,0,0,0,0|1,0,1]=4 10829 B16R2.1063 Cc1ccc(cc1F)NCc2cncs2 7a_100000210958_100015185245 [0,2,0,0,0,0|1,0,1]=4 10830 B16R2.1063 Cc1ccc(cc1F)NCc2cscn2 207a_100000210958_100000743575 [0,2,0,0,0,0|1,0,0]=3 10831 B16R2.1063 Cc1ccc(cc1F)NCc2cscn2 2230a_100000210958_100000205941 [0,2,0,0,0,0|1,0,0]=3 10832 B16R2.1063 Cc1ccc(cc1F)NCc2cscn2 270302a_100000210958_100000743575 [0,2,0,0,0,0|1,0,0]=3 10833 B16R2.1063 Cc1ccc(cc1F)NCc2cscn2 34a_100000210958_100000205941 [0,2,0,0,0,0|1,0,0]=3 10834 B16R2.1063 Cc1ccc(cc1F)NCc2cscn2 7a_100000210958_100000205941 [0,2,0,0,0,0|1,0,0]=3 10835 B16R2.1063 Cc1ccc(cc1F)NCc2ncc[nH]2 207a_100000210958_100000743867 [0,2,0,0,0,0|2,0,0]=4 10836 B16R2.1063 Cc1ccc(cc1F)NCc2ncc[nH]2 2230a_100000210958_100016991755 [0,2,0,0,0,0|2,0,0]=4 10837 B16R2.1063 Cc1ccc(cc1F)NCc2ncc[nH]2 34a_100000210958_100016991755 [0,2,0,0,0,0|2,0,0]=4 10838 B16R2.1063 Cc1ccc(cc1F)NCc2ncc[nH]2 7a_100000210958_100000753453 [0,2,0,0,0,0|2,0,0]=4 10839 B16R2.1063 Cc1ccc(cc1F)NCc2ncco2 2230a_100000210958_103436540062 [0,2,0,0,0,0|2,0,0]=4 10840 B16R2.1063 Cc1ccc(cc1F)NCc2ncco2 34a_100000210958_103436540062 [0,2,0,0,0,0|2,0,0]=4 10841 B16R2.1063 Cc1ccc(cc1F)NCc2ncco2 7a_100000210958_103436540062 [0,2,0,0,0,0|2,0,0]=4 10842 B16R2.1063 Cc1ccc(cc1F)NCc2nccs2 207a_100000210958_100000750902 [0,2,0,0,0,0|2,0,0]=4 10843 B16R2.1063 Cc1ccc(cc1F)NCc2nccs2 2230a_100000210958_100015184050 [0,2,0,0,0,0|2,0,0]=4 10844 B16R2.1063 Cc1ccc(cc1F)NCc2nccs2 270302a_100000210958_100000750902 [0,2,0,0,0,0|2,0,0]=4 10845 B16R2.1063 Cc1ccc(cc1F)NCc2nccs2 34a_100000210958_100015184050 [0,2,0,0,0,0|2,0,0]=4 10846 B16R2.1063 Cc1ccc(cc1F)NCc2nccs2 7a_100000210958_100015184050 [0,2,0,0,0,0|2,0,0]=4 10847 B16R2.1063 Cc1ccc(cc1F)NCc2ncon2 34a_100000210958_100000233494 [0,2,0,0,0,0|2,0,0]=4 10848 B16R2.1063 Cc1ccc(cc1F)NCn2cncn2 2230a_100000210958_200020645497 [0,2,0,0,0,0|1,0,1]=4 10849 B16R2.1063 Cc1ccc(cc1F)NCn2cncn2 34a_100000210958_200020645497 [0,2,0,0,0,0|1,0,1]=4 10850 B16R2.1063 Cc1ccc(cc1F)NCn2cncn2 7a_100000210958_200020645497 [0,2,0,0,0,0|1,0,1]=4 10851 B16R2.1063 Cc1ccc(cc1F)OCc2c[nH]cn2 34a_100000722560_100000707719 [0,2,0,0,0,0|1,0,0]=3 10852 B16R2.1063 Cc1ccc(cc1F)OCc2cscn2 34a_100000722560_100000205941 [0,2,0,0,0,0|2,0,0]=4 10853 B16R2.1063 Cc1ccc(cc1F)OCc2cscn2 7a_100000722560_100000205941 [0,2,0,0,0,0|2,0,0]=4 10854 B16R2.1063 Cc1ccc(cc1F)SCc2c[nH]cn2 62a_100000707719_100000720648 [0,2,0,0,0,0|1,0,0]=3 10855 B16R2.1063 Cc1ccc(cc1F)SCc2c[nH]cn2 62a_100000720648_100000707719 [0,2,0,0,0,0|1,0,0]=3 10856 B16R2.1063 Cc1ccc(cc1F)SCc2cscn2 62a_100000205941_100000720648 [0,2,0,0,0,0|2,0,0]=4 10857 B16R2.1063 Cc1ccc(cc1F)SCc2cscn2 62a_100000720648_100000205941 [0,2,0,0,0,0|2,0,0]=4 10858 B16R2.1063 Cc1ccc(cc1I)CSc2c[nH]cn2 62a_100000756875_100010206137 [0,2,0,0,0,0|2,0,0]=4 10859 B16R2.1063 Cc1ccc(cc1I)CSc2c[nH]cn2 62a_100010206137_100000756875 [0,2,0,0,0,0|2,0,0]=4 10860 B16R2.1063 Cc1ccc(cc1I)NCc2c[nH]cn2 34a_100000184131_100000707719 [0,2,0,0,0,0|0,0,0]=2 10861 B16R2.1063 Cc1ccc(cc1I)NCc2cc[nH]n2 207a_100000184131_100000738523 [0,2,0,0,0,0|2,0,0]=4 10862 B16R2.1063 Cc1ccc(cc1I)NCc2ccco2 207a_100000184131_100000186105 [0,2,0,0,0,0|2,0,0]=4 10863 B16R2.1063 Cc1ccc(cc1I)NCc2ccco2 270302a_100000184131_100000186105 [0,2,0,0,0,0|2,0,0]=4 10864 B16R2.1063 Cc1ccc(cc1I)NCc2cccs2 207a_100000184131_100000209959 [0,2,0,0,0,0|2,0,0]=4 10865 B16R2.1063 Cc1ccc(cc1I)NCc2cccs2 270302a_100000184131_100000209959 [0,2,0,0,0,0|2,0,0]=4 10866 B16R2.1063 Cc1ccc(cc1I)NCc2ccoc2 207a_100000184131_100011215517 [0,2,0,0,0,0|2,0,0]=4 10867 B16R2.1063 Cc1ccc(cc1I)NCc2ccon2 34a_100000184131_100000234950 [0,2,0,0,0,0|2,0,0]=4 10868 B16R2.1063 Cc1ccc(cc1I)NCc2ccon2 7a_100000184131_100000234950 [0,2,0,0,0,0|2,0,0]=4 10869 B16R2.1063 Cc1ccc(cc1I)NCc2ccsc2 207a_100000184131_100000188534 [0,2,0,0,0,0|2,0,0]=4 10870 B16R2.1063 Cc1ccc(cc1I)NCc2ccsc2 270302a_100000184131_100000188534 [0,2,0,0,0,0|2,0,0]=4 10871 B16R2.1063 Cc1ccc(cc1I)NCc2ccsc2 34a_100000184131_100011261437 [0,2,0,0,0,0|2,0,0]=4 10872 B16R2.1063 Cc1ccc(cc1I)NCc2ccsc2 7a_100000184131_100011261437 [0,2,0,0,0,0|2,0,0]=4 10873 B16R2.1063 Cc1ccc(cc1I)NCc2cn[nH]c2 207a_100000184131_100016992096 [0,2,0,0,0,0|2,0,0]=4 10874 B16R2.1063 Cc1ccc(cc1I)NCc2cn[nH]c2 270302a_100000184131_100016992096 [0,2,0,0,0,0|2,0,0]=4 10875 B16R2.1063 Cc1ccc(cc1I)NCc2cnc[nH]2 207a_100000184131_100000742939 [0,2,0,0,0,0|0,0,2]=4 10876 B16R2.1063 Cc1ccc(cc1I)NCc2cncs2 207a_100000184131_100000749870 [0,2,0,0,0,0|1,0,1]=4 10877 B16R2.1063 Cc1ccc(cc1I)NCc2cncs2 270302a_100000184131_100000749870 [0,2,0,0,0,0|1,0,1]=4 10878 B16R2.1063 Cc1ccc(cc1I)NCc2cncs2 34a_100000184131_100015185245 [0,2,0,0,0,0|1,0,1]=4 10879 B16R2.1063 Cc1ccc(cc1I)NCc2cncs2 7a_100000184131_100015185245 [0,2,0,0,0,0|1,0,1]=4 10880 B16R2.1063 Cc1ccc(cc1I)NCc2cscn2 207a_100000184131_100000743575 [0,2,0,0,0,0|1,0,0]=3 10881 B16R2.1063 Cc1ccc(cc1I)NCc2cscn2 270302a_100000184131_100000743575 [0,2,0,0,0,0|1,0,0]=3 10882 B16R2.1063 Cc1ccc(cc1I)NCc2cscn2 34a_100000184131_100000205941 [0,2,0,0,0,0|1,0,0]=3 10883 B16R2.1063 Cc1ccc(cc1I)NCc2cscn2 7a_100000184131_100000205941 [0,2,0,0,0,0|1,0,0]=3 10884 B16R2.1063 Cc1ccc(cc1I)NCc2ncc[nH]2 207a_100000184131_100000743867 [0,2,0,0,0,0|2,0,0]=4 10885 B16R2.1063 Cc1ccc(cc1I)NCc2ncc[nH]2 34a_100000184131_100016991755 [0,2,0,0,0,0|2,0,0]=4 10886 B16R2.1063 Cc1ccc(cc1I)NCc2ncc[nH]2 7a_100000184131_100000753453 [0,2,0,0,0,0|2,0,0]=4 10887 B16R2.1063 Cc1ccc(cc1I)NCc2ncco2 34a_100000184131_103436540062 [0,2,0,0,0,0|2,0,0]=4 10888 B16R2.1063 Cc1ccc(cc1I)NCc2ncco2 7a_100000184131_103436540062 [0,2,0,0,0,0|2,0,0]=4 10889 B16R2.1063 Cc1ccc(cc1I)NCc2nccs2 207a_100000184131_100000750902 [0,2,0,0,0,0|2,0,0]=4 10890 B16R2.1063 Cc1ccc(cc1I)NCc2nccs2 270302a_100000184131_100000750902 [0,2,0,0,0,0|2,0,0]=4 10891 B16R2.1063 Cc1ccc(cc1I)NCc2nccs2 34a_100000184131_100015184050 [0,2,0,0,0,0|2,0,0]=4 10892 B16R2.1063 Cc1ccc(cc1I)NCc2nccs2 7a_100000184131_100015184050 [0,2,0,0,0,0|2,0,0]=4 10893 B16R2.1063 Cc1ccc(cc1I)NCc2ncon2 34a_100000184131_100000233494 [0,2,0,0,0,0|2,0,0]=4 10894 B16R2.1063 Cc1ccc(cc1I)NCn2cncn2 34a_100000184131_200020645497 [0,2,0,0,0,0|1,0,1]=4 10895 B16R2.1063 Cc1ccc(cc1I)NCn2cncn2 7a_100000184131_200020645497 [0,2,0,0,0,0|1,0,1]=4 10896 B16R2.1063 Cc1ccc(cc1N)OCc2c[nH]cn2 34a_100011216113_100000707719 [0,2,0,0,0,0|1,0,0]=3 10897 B16R2.1063 Cc1ccc(cc1N)OCc2cscn2 34a_100011216113_100000205941 [0,2,0,0,0,0|2,0,0]=4 10898 B16R2.1063 Cc1ccc(cc1N)OCc2cscn2 7a_100011216113_100000205941 [0,2,0,0,0,0|2,0,0]=4 10899 B16R2.1063 Cc1ccc(cc1N)SCc2c[nH]cn2 62a_100000707719_100000761890 [0,2,0,0,0,0|1,0,0]=3 10900 B16R2.1063 Cc1ccc(cc1N)SCc2c[nH]cn2 62a_100000761890_100000707719 [0,2,0,0,0,0|1,0,0]=3 10901 B16R2.1063 Cc1ccc(cc1N)SCc2cscn2 62a_100000205941_100000761890 [0,2,0,0,0,0|2,0,0]=4 10902 B16R2.1063 Cc1ccc(cc1N)SCc2cscn2 62a_100000761890_100000205941 [0,2,0,0,0,0|2,0,0]=4 10903 B16R2.1063 Cc1ccc(cc1O)NCc2c[nH]cn2 34a_100000759471_100000707719 [0,2,0,0,0,0|0,0,0]=2 10904 B16R2.1063 Cc1ccc(cc1O)NCc2ccco2 270302a_100000759471_100000186105 [0,2,0,0,0,0|2,0,0]=4 10905 B16R2.1063 Cc1ccc(cc1O)NCc2cccs2 270302a_100000759471_100000209959 [0,2,0,0,0,0|2,0,0]=4 10906 B16R2.1063 Cc1ccc(cc1O)NCc2ccon2 34a_100000759471_100000234950 [0,2,0,0,0,0|2,0,0]=4 10907 B16R2.1063 Cc1ccc(cc1O)NCc2ccon2 7a_100000759471_100000234950 [0,2,0,0,0,0|2,0,0]=4 10908 B16R2.1063 Cc1ccc(cc1O)NCc2ccsc2 270302a_100000759471_100000188534 [0,2,0,0,0,0|2,0,0]=4 10909 B16R2.1063 Cc1ccc(cc1O)NCc2ccsc2 34a_100000759471_100011261437 [0,2,0,0,0,0|2,0,0]=4 10910 B16R2.1063 Cc1ccc(cc1O)NCc2ccsc2 7a_100000759471_100011261437 [0,2,0,0,0,0|2,0,0]=4 10911 B16R2.1063 Cc1ccc(cc1O)NCc2cn[nH]c2 270302a_100000759471_100016992096 [0,2,0,0,0,0|2,0,0]=4 10912 B16R2.1063 Cc1ccc(cc1O)NCc2cncs2 270302a_100000759471_100000749870 [0,2,0,0,0,0|1,0,1]=4 10913 B16R2.1063 Cc1ccc(cc1O)NCc2cncs2 34a_100000759471_100015185245 [0,2,0,0,0,0|1,0,1]=4 10914 B16R2.1063 Cc1ccc(cc1O)NCc2cncs2 7a_100000759471_100015185245 [0,2,0,0,0,0|1,0,1]=4 10915 B16R2.1063 Cc1ccc(cc1O)NCc2cscn2 270302a_100000759471_100000743575 [0,2,0,0,0,0|1,0,0]=3 10916 B16R2.1063 Cc1ccc(cc1O)NCc2cscn2 34a_100000759471_100000205941 [0,2,0,0,0,0|1,0,0]=3 10917 B16R2.1063 Cc1ccc(cc1O)NCc2cscn2 7a_100000759471_100000205941 [0,2,0,0,0,0|1,0,0]=3 10918 B16R2.1063 Cc1ccc(cc1O)NCc2ncc[nH]2 34a_100000759471_100016991755 [0,2,0,0,0,0|2,0,0]=4 10919 B16R2.1063 Cc1ccc(cc1O)NCc2ncc[nH]2 7a_100000759471_100000753453 [0,2,0,0,0,0|2,0,0]=4 10920 B16R2.1063 Cc1ccc(cc1O)NCc2ncco2 34a_100000759471_103436540062 [0,2,0,0,0,0|2,0,0]=4 10921 B16R2.1063 Cc1ccc(cc1O)NCc2ncco2 7a_100000759471_103436540062 [0,2,0,0,0,0|2,0,0]=4 10922 B16R2.1063 Cc1ccc(cc1O)NCc2nccs2 270302a_100000759471_100000750902 [0,2,0,0,0,0|2,0,0]=4 10923 B16R2.1063 Cc1ccc(cc1O)NCc2nccs2 34a_100000759471_100015184050 [0,2,0,0,0,0|2,0,0]=4 10924 B16R2.1063 Cc1ccc(cc1O)NCc2nccs2 7a_100000759471_100015184050 [0,2,0,0,0,0|2,0,0]=4 10925 B16R2.1063 Cc1ccc(cc1O)NCc2ncon2 34a_100000759471_100000233494 [0,2,0,0,0,0|2,0,0]=4 10926 B16R2.1063 Cc1ccc(cc1O)NCn2cncn2 34a_100000759471_200020645497 [0,2,0,0,0,0|1,0,1]=4 10927 B16R2.1063 Cc1ccc(cc1O)NCn2cncn2 7a_100000759471_200020645497 [0,2,0,0,0,0|1,0,1]=4 10928 B16R2.1063 Cc1ccc(cc1O)SCc2c[nH]cn2 62a_100000685420_100000707719 [0,2,0,0,0,0|1,0,0]=3 10929 B16R2.1063 Cc1ccc(cc1O)SCc2c[nH]cn2 62a_100000707719_100000685420 [0,2,0,0,0,0|1,0,0]=3 10930 B16R2.1063 Cc1ccc(cc1O)SCc2cscn2 62a_100000205941_100000685420 [0,2,0,0,0,0|2,0,0]=4 10931 B16R2.1063 Cc1ccc(cc1O)SCc2cscn2 62a_100000685420_100000205941 [0,2,0,0,0,0|2,0,0]=4 10932 B16R2.1063 Cc1ccc(nc1C)SCc2c[nH]cn2 62a_100000103781_100000707719 [0,2,0,0,0,0|2,0,0]=4 10933 B16R2.1063 Cc1ccc(nc1C)SCc2c[nH]cn2 62a_100000707719_100000103781 [0,2,0,0,0,0|2,0,0]=4 10934 B16R2.1063 Cc1ccc(nc1N)SCc2c[nH]cn2 62a_100000707719_100009857032 [0,2,0,0,0,0|2,0,0]=4 10935 B16R2.1063 Cc1ccc(nc1N)SCc2c[nH]cn2 62a_100009857032_100000707719 [0,2,0,0,0,0|2,0,0]=4 10936 B16R2.1063 Cc1cnc(cc1Br)OCc2c[nH]cn2 34a_100009831917_100000707719 [0,2,0,0,0,0|2,0,0]=4 10937 B16R2.1063 Cc1cnc(cc1C)SCc2c[nH]cn2 62a_100000707719_100009850809 [0,2,0,0,0,0|2,0,0]=4 10938 B16R2.1063 Cc1cnc(cc1C)SCc2c[nH]cn2 62a_100009850809_100000707719 [0,2,0,0,0,0|2,0,0]=4 10939 B16R2.1063 Cc1cnc(cc1F)NCc2c[nH]cn2 27a_100000758547_100009841206 [0,2,0,0,0,0|1,0,0]=3 10940 B16R2.1063 Cc1cnc(cc1F)NCc2c[nH]nn2 27a_100020620823_100009841206 [0,2,0,0,0,0|2,0,0]=4 10941 B16R2.1063 Cc1cnc(cc1F)NCc2cocn2 27a_100015188801_100009841206 [0,2,0,0,0,0|2,0,0]=4 10942 B16R2.1063 Cc1cnc(cc1F)NCc2cscn2 27a_100015185402_100009841206 [0,2,0,0,0,0|2,0,0]=4 10943 B16R2.1063 Cc1cnc(cc1F)SCc2c[nH]cn2 62a_100000707719_100009841206 [0,2,0,0,0,0|2,0,0]=4 10944 B16R2.1063 Cc1cnc(cc1F)SCc2c[nH]cn2 62a_100009841206_100000707719 [0,2,0,0,0,0|2,0,0]=4 10945 B16R2.1063 Cc1cnc(cc1N)SCc2c[nH]cn2 62a_100000126663_100000707719 [0,2,0,0,0,0|2,0,0]=4 10946 B16R2.1063 Cc1cnc(cc1N)SCc2c[nH]cn2 62a_100000707719_100000126663 [0,2,0,0,0,0|2,0,0]=4 10947 B16R2.1063 Cc1cnc(cc1O)SCc2c[nH]cn2 62a_100000704368_100000707719 [0,2,0,0,0,0|2,0,0]=4 10948 B16R2.1063 Cc1cnc(cc1O)SCc2c[nH]cn2 62a_100000707719_100000704368 [0,2,0,0,0,0|2,0,0]=4 10949 B16R2.1063 Cc1cnc(nc1N)NCc2c[nH]cn2 27a_100000758547_100011996698 [0,2,0,0,0,0|2,0,0]=4 10950 B16R2.1063 Cc1nc(ccc1Br)OCc2c[nH]cn2 34a_100000691680_100000707719 [0,2,0,0,0,0|2,0,0]=4 10951 B16R2.1063 Cc1nc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100012360386 [0,2,0,0,0,0|2,0,0]=4 10952 B16R2.1063 Cc1nc(ccc1Br)SCc2c[nH]cn2 62a_100012360386_100000707719 [0,2,0,0,0,0|2,0,0]=4 10953 B16R2.1063 Cc1nc(ccc1Cl)OCc2c[nH]cn2 34a_200009863735_100000707719 [0,2,0,0,0,0|2,0,0]=4 10954 B16R2.1063 Cc1nc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100009814307 [0,2,0,0,0,0|2,0,0]=4 10955 B16R2.1063 Cc1nc(ccc1F)SCc2c[nH]cn2 62a_100009814307_100000707719 [0,2,0,0,0,0|2,0,0]=4 10956 B16R2.1063 Cc1nc(ccc1N)SCc2c[nH]cn2 62a_100000707719_100000720120 [0,2,0,0,0,0|2,0,0]=4 10957 B16R2.1063 Cc1nc(ccc1N)SCc2c[nH]cn2 62a_100000720120_100000707719 [0,2,0,0,0,0|2,0,0]=4 10958 B16R2.1063 Cc1nc(ccc1O)SCc2c[nH]cn2 62a_100000707719_100010233687 [0,2,0,0,0,0|2,0,0]=4 10959 B16R2.1063 Cc1nc(ccc1O)SCc2c[nH]cn2 62a_100010233687_100000707719 [0,2,0,0,0,0|2,0,0]=4 10960 B16R2.1063 Cc1nc(ncc1Cl)NCc2c[nH]cn2 27a_100000758547_100010174973 [0,2,0,0,0,0|2,0,0]=4 10961 B16R2.1063 Cc1nc(ncc1F)NCc2c[nH]cn2 27a_100000758547_100015641512 [0,2,0,0,0,0|2,0,0]=4 10962 B16R2.1063 Cc1nc(ncc1N)NCc2c[nH]cn2 27a_100000758547_100000123670 [0,2,0,0,0,0|2,0,0]=4 10963 B16R2.1063 Cc1ncc(cc1Br)OCc2c[nH]cn2 34a_100009819603_100000707719 [0,2,0,0,0,0|2,0,0]=4 10964 B16R2.1063 Cc1ncc(cc1F)SCc2c[nH]cn2 62a_100000707719_100009845756 [0,2,0,0,0,0|2,0,0]=4 10965 B16R2.1063 Cc1ncc(cc1F)SCc2c[nH]cn2 62a_100009845756_100000707719 [0,2,0,0,0,0|2,0,0]=4 10966 B16R2.1063 Cc1ncc(cc1N)SCc2c[nH]cn2 62a_100000707719_100011999542 [0,2,0,0,0,0|2,0,0]=4 10967 B16R2.1063 Cc1ncc(cc1N)SCc2c[nH]cn2 62a_100011999542_100000707719 [0,2,0,0,0,0|2,0,0]=4 10968 B16R2.1063 Cc1ncc(cc1O)SCc2c[nH]cn2 62a_100000707719_100009864810 [0,2,0,0,0,0|2,0,0]=4 10969 B16R2.1063 Cc1ncc(cc1O)SCc2c[nH]cn2 62a_100009864810_100000707719 [0,2,0,0,0,0|2,0,0]=4 10970 B16R2.1063 Cc1ncc(nc1C)NCc2c[nH]cn2 27a_100000758547_100009878948 [0,2,0,0,0,0|2,0,0]=4 10971 B16R2.1063 Clc1cc(ccc1Br)CSc2c[nH]cn2 62a_100000756875_100012353895 [0,2,0,0,0,0|2,0,0]=4 10972 B16R2.1063 Clc1cc(ccc1Br)CSc2c[nH]cn2 62a_100012353895_100000756875 [0,2,0,0,0,0|2,0,0]=4 10973 B16R2.1063 Clc1cc(ccc1Br)NCc2c[nH]cn2 2230a_100000687081_100000707719 [0,2,0,0,0,0|0,0,0]=2 10974 B16R2.1063 Clc1cc(ccc1Br)NCc2c[nH]cn2 34a_100000687081_100000707719 [0,2,0,0,0,0|0,0,0]=2 10975 B16R2.1063 Clc1cc(ccc1Br)NCc2cc[nH]n2 207a_100000687081_100000738523 [0,2,0,0,0,0|2,0,0]=4 10976 B16R2.1063 Clc1cc(ccc1Br)NCc2ccco2 207a_100000687081_100000186105 [0,2,0,0,0,0|2,0,0]=4 10977 B16R2.1063 Clc1cc(ccc1Br)NCc2ccco2 270302a_100000687081_100000186105 [0,2,0,0,0,0|2,0,0]=4 10978 B16R2.1063 Clc1cc(ccc1Br)NCc2cccs2 207a_100000687081_100000209959 [0,2,0,0,0,0|2,0,0]=4 10979 B16R2.1063 Clc1cc(ccc1Br)NCc2cccs2 270302a_100000687081_100000209959 [0,2,0,0,0,0|2,0,0]=4 10980 B16R2.1063 Clc1cc(ccc1Br)NCc2ccoc2 207a_100000687081_100011215517 [0,2,0,0,0,0|2,0,0]=4 10981 B16R2.1063 Clc1cc(ccc1Br)NCc2ccon2 2230a_100000687081_100000234950 [0,2,0,0,0,0|2,0,0]=4 10982 B16R2.1063 Clc1cc(ccc1Br)NCc2ccon2 34a_100000687081_100000234950 [0,2,0,0,0,0|2,0,0]=4 10983 B16R2.1063 Clc1cc(ccc1Br)NCc2ccon2 7a_100000687081_100000234950 [0,2,0,0,0,0|2,0,0]=4 10984 B16R2.1063 Clc1cc(ccc1Br)NCc2ccsc2 207a_100000687081_100000188534 [0,2,0,0,0,0|2,0,0]=4 10985 B16R2.1063 Clc1cc(ccc1Br)NCc2ccsc2 2230a_100000687081_100011261437 [0,2,0,0,0,0|2,0,0]=4 10986 B16R2.1063 Clc1cc(ccc1Br)NCc2ccsc2 270302a_100000687081_100000188534 [0,2,0,0,0,0|2,0,0]=4 10987 B16R2.1063 Clc1cc(ccc1Br)NCc2ccsc2 34a_100000687081_100011261437 [0,2,0,0,0,0|2,0,0]=4 10988 B16R2.1063 Clc1cc(ccc1Br)NCc2ccsc2 7a_100000687081_100011261437 [0,2,0,0,0,0|2,0,0]=4 10989 B16R2.1063 Clc1cc(ccc1Br)NCc2cn[nH]c2 207a_100000687081_100016992096 [0,2,0,0,0,0|2,0,0]=4 10990 B16R2.1063 Clc1cc(ccc1Br)NCc2cn[nH]c2 270302a_100000687081_100016992096 [0,2,0,0,0,0|2,0,0]=4 10991 B16R2.1063 Clc1cc(ccc1Br)NCc2cnc[nH]2 207a_100000687081_100000742939 [0,2,0,0,0,0|0,0,2]=4 10992 B16R2.1063 Clc1cc(ccc1Br)NCc2cncs2 207a_100000687081_100000749870 [0,2,0,0,0,0|1,0,1]=4 10993 B16R2.1063 Clc1cc(ccc1Br)NCc2cncs2 2230a_100000687081_100015185245 [0,2,0,0,0,0|1,0,1]=4 10994 B16R2.1063 Clc1cc(ccc1Br)NCc2cncs2 270302a_100000687081_100000749870 [0,2,0,0,0,0|1,0,1]=4 10995 B16R2.1063 Clc1cc(ccc1Br)NCc2cncs2 34a_100000687081_100015185245 [0,2,0,0,0,0|1,0,1]=4 10996 B16R2.1063 Clc1cc(ccc1Br)NCc2cncs2 7a_100000687081_100015185245 [0,2,0,0,0,0|1,0,1]=4 10997 B16R2.1063 Clc1cc(ccc1Br)NCc2cscn2 207a_100000687081_100000743575 [0,2,0,0,0,0|1,0,0]=3 10998 B16R2.1063 Clc1cc(ccc1Br)NCc2cscn2 2230a_100000687081_100000205941 [0,2,0,0,0,0|1,0,0]=3 10999 B16R2.1063 Clc1cc(ccc1Br)NCc2cscn2 270302a_100000687081_100000743575 [0,2,0,0,0,0|1,0,0]=3 11000 B16R2.1063 Clc1cc(ccc1Br)NCc2cscn2 34a_100000687081_100000205941 [0,2,0,0,0,0|1,0,0]=3 11001 B16R2.1063 Clc1cc(ccc1Br)NCc2cscn2 7a_100000687081_100000205941 [0,2,0,0,0,0|1,0,0]=3 11002 B16R2.1063 Clc1cc(ccc1Br)NCc2ncc[nH]2 207a_100000687081_100000743867 [0,2,0,0,0,0|2,0,0]=4 11003 B16R2.1063 Clc1cc(ccc1Br)NCc2ncc[nH]2 2230a_100000687081_100016991755 [0,2,0,0,0,0|2,0,0]=4 11004 B16R2.1063 Clc1cc(ccc1Br)NCc2ncc[nH]2 34a_100000687081_100016991755 [0,2,0,0,0,0|2,0,0]=4 11005 B16R2.1063 Clc1cc(ccc1Br)NCc2ncc[nH]2 7a_100000687081_100000753453 [0,2,0,0,0,0|2,0,0]=4 11006 B16R2.1063 Clc1cc(ccc1Br)NCc2ncco2 2230a_100000687081_103436540062 [0,2,0,0,0,0|2,0,0]=4 11007 B16R2.1063 Clc1cc(ccc1Br)NCc2ncco2 34a_100000687081_103436540062 [0,2,0,0,0,0|2,0,0]=4 11008 B16R2.1063 Clc1cc(ccc1Br)NCc2ncco2 7a_100000687081_103436540062 [0,2,0,0,0,0|2,0,0]=4 11009 B16R2.1063 Clc1cc(ccc1Br)NCc2nccs2 207a_100000687081_100000750902 [0,2,0,0,0,0|2,0,0]=4 11010 B16R2.1063 Clc1cc(ccc1Br)NCc2nccs2 2230a_100000687081_100015184050 [0,2,0,0,0,0|2,0,0]=4 11011 B16R2.1063 Clc1cc(ccc1Br)NCc2nccs2 270302a_100000687081_100000750902 [0,2,0,0,0,0|2,0,0]=4 11012 B16R2.1063 Clc1cc(ccc1Br)NCc2nccs2 34a_100000687081_100015184050 [0,2,0,0,0,0|2,0,0]=4 11013 B16R2.1063 Clc1cc(ccc1Br)NCc2nccs2 7a_100000687081_100015184050 [0,2,0,0,0,0|2,0,0]=4 11014 B16R2.1063 Clc1cc(ccc1Br)NCc2ncon2 34a_100000687081_100000233494 [0,2,0,0,0,0|2,0,0]=4 11015 B16R2.1063 Clc1cc(ccc1Br)NCn2cncn2 2230a_100000687081_200020645497 [0,2,0,0,0,0|1,0,1]=4 11016 B16R2.1063 Clc1cc(ccc1Br)NCn2cncn2 34a_100000687081_200020645497 [0,2,0,0,0,0|1,0,1]=4 11017 B16R2.1063 Clc1cc(ccc1Br)NCn2cncn2 7a_100000687081_200020645497 [0,2,0,0,0,0|1,0,1]=4 11018 B16R2.1063 Clc1cc(ccc1Br)OCc2c[nH]cn2 34a_100011215161_100000707719 [0,2,0,0,0,0|1,0,0]=3 11019 B16R2.1063 Clc1cc(ccc1Br)OCc2cscn2 34a_100011215161_100000205941 [0,2,0,0,0,0|2,0,0]=4 11020 B16R2.1063 Clc1cc(ccc1Br)OCc2cscn2 7a_100011215161_100000205941 [0,2,0,0,0,0|2,0,0]=4 11021 B16R2.1063 Clc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100012047281 [0,2,0,0,0,0|1,0,0]=3 11022 B16R2.1063 Clc1cc(ccc1Br)SCc2c[nH]cn2 62a_100012047281_100000707719 [0,2,0,0,0,0|1,0,0]=3 11023 B16R2.1063 Clc1cc(ccc1Br)SCc2cscn2 62a_100000205941_100012047281 [0,2,0,0,0,0|2,0,0]=4 11024 B16R2.1063 Clc1cc(ccc1Br)SCc2cscn2 62a_100012047281_100000205941 [0,2,0,0,0,0|2,0,0]=4 11025 B16R2.1063 Clc1cc(ccc1I)CSc2c[nH]cn2 62a_100000756875_100012349665 [0,2,0,0,0,0|2,0,0]=4 11026 B16R2.1063 Clc1cc(ccc1I)CSc2c[nH]cn2 62a_100012349665_100000756875 [0,2,0,0,0,0|2,0,0]=4 11027 B16R2.1063 Clc1cc(ccc1I)NCc2c[nH]cn2 34a_100000761885_100000707719 [0,2,0,0,0,0|0,0,0]=2 11028 B16R2.1063 Clc1cc(ccc1I)NCc2cc[nH]n2 207a_100000761885_100000738523 [0,2,0,0,0,0|2,0,0]=4 11029 B16R2.1063 Clc1cc(ccc1I)NCc2ccco2 207a_100000761885_100000186105 [0,2,0,0,0,0|2,0,0]=4 11030 B16R2.1063 Clc1cc(ccc1I)NCc2ccco2 270302a_100000761885_100000186105 [0,2,0,0,0,0|2,0,0]=4 11031 B16R2.1063 Clc1cc(ccc1I)NCc2cccs2 207a_100000761885_100000209959 [0,2,0,0,0,0|2,0,0]=4 11032 B16R2.1063 Clc1cc(ccc1I)NCc2cccs2 270302a_100000761885_100000209959 [0,2,0,0,0,0|2,0,0]=4 11033 B16R2.1063 Clc1cc(ccc1I)NCc2ccoc2 207a_100000761885_100011215517 [0,2,0,0,0,0|2,0,0]=4 11034 B16R2.1063 Clc1cc(ccc1I)NCc2ccon2 34a_100000761885_100000234950 [0,2,0,0,0,0|2,0,0]=4 11035 B16R2.1063 Clc1cc(ccc1I)NCc2ccsc2 207a_100000761885_100000188534 [0,2,0,0,0,0|2,0,0]=4 11036 B16R2.1063 Clc1cc(ccc1I)NCc2ccsc2 270302a_100000761885_100000188534 [0,2,0,0,0,0|2,0,0]=4 11037 B16R2.1063 Clc1cc(ccc1I)NCc2ccsc2 34a_100000761885_100011261437 [0,2,0,0,0,0|2,0,0]=4 11038 B16R2.1063 Clc1cc(ccc1I)NCc2cn[nH]c2 207a_100000761885_100016992096 [0,2,0,0,0,0|2,0,0]=4 11039 B16R2.1063 Clc1cc(ccc1I)NCc2cn[nH]c2 270302a_100000761885_100016992096 [0,2,0,0,0,0|2,0,0]=4 11040 B16R2.1063 Clc1cc(ccc1I)NCc2cnc[nH]2 207a_100000761885_100000742939 [0,2,0,0,0,0|0,0,2]=4 11041 B16R2.1063 Clc1cc(ccc1I)NCc2cncs2 207a_100000761885_100000749870 [0,2,0,0,0,0|1,0,1]=4 11042 B16R2.1063 Clc1cc(ccc1I)NCc2cncs2 270302a_100000761885_100000749870 [0,2,0,0,0,0|1,0,1]=4 11043 B16R2.1063 Clc1cc(ccc1I)NCc2cncs2 34a_100000761885_100015185245 [0,2,0,0,0,0|1,0,1]=4 11044 B16R2.1063 Clc1cc(ccc1I)NCc2cscn2 207a_100000761885_100000743575 [0,2,0,0,0,0|1,0,0]=3 11045 B16R2.1063 Clc1cc(ccc1I)NCc2cscn2 270302a_100000761885_100000743575 [0,2,0,0,0,0|1,0,0]=3 11046 B16R2.1063 Clc1cc(ccc1I)NCc2cscn2 34a_100000761885_100000205941 [0,2,0,0,0,0|1,0,0]=3 11047 B16R2.1063 Clc1cc(ccc1I)NCc2ncc[nH]2 207a_100000761885_100000743867 [0,2,0,0,0,0|2,0,0]=4 11048 B16R2.1063 Clc1cc(ccc1I)NCc2ncc[nH]2 34a_100000761885_100016991755 [0,2,0,0,0,0|2,0,0]=4 11049 B16R2.1063 Clc1cc(ccc1I)NCc2ncco2 34a_100000761885_103436540062 [0,2,0,0,0,0|2,0,0]=4 11050 B16R2.1063 Clc1cc(ccc1I)NCc2nccs2 207a_100000761885_100000750902 [0,2,0,0,0,0|2,0,0]=4 11051 B16R2.1063 Clc1cc(ccc1I)NCc2nccs2 270302a_100000761885_100000750902 [0,2,0,0,0,0|2,0,0]=4 11052 B16R2.1063 Clc1cc(ccc1I)NCc2nccs2 34a_100000761885_100015184050 [0,2,0,0,0,0|2,0,0]=4 11053 B16R2.1063 Clc1cc(ccc1I)NCc2ncon2 34a_100000761885_100000233494 [0,2,0,0,0,0|2,0,0]=4 11054 B16R2.1063 Clc1cc(ccc1I)NCn2cncn2 34a_100000761885_200020645497 [0,2,0,0,0,0|1,0,1]=4 11055 B16R2.1063 Clc1cc(ccc1I)OCc2c[nH]cn2 34a_100000047559_100000707719 [0,2,0,0,0,0|1,0,0]=3 11056 B16R2.1063 Clc1cc(ccc1I)OCc2cscn2 34a_100000047559_100000205941 [0,2,0,0,0,0|2,0,0]=4 11057 B16R2.1063 Clc1cc(ccc1I)OCc2cscn2 7a_100000047559_100000205941 [0,2,0,0,0,0|2,0,0]=4 11058 B16R2.1063 Clc1cc(cnc1Br)OCc2c[nH]cn2 34a_100010209684_100000707719 [0,2,0,0,0,0|2,0,0]=4 11059 B16R2.1063 Clc1cc(cnc1Cl)OCc2c[nH]cn2 34a_100000094354_100000707719 [0,2,0,0,0,0|2,0,0]=4 11060 B16R2.1063 Clc1cc(ncc1Br)OCc2c[nH]cn2 34a_100010369989_100000707719 [0,2,0,0,0,0|2,0,0]=4 11061 B16R2.1063 Clc1ccc(cc1Br)CSc2c[nH]cn2 62a_100000756875_100012353894 [0,2,0,0,0,0|2,0,0]=4 11062 B16R2.1063 Clc1ccc(cc1Br)CSc2c[nH]cn2 62a_100012353894_100000756875 [0,2,0,0,0,0|2,0,0]=4 11063 B16R2.1063 Clc1ccc(cc1Br)NCc2c[nH]cn2 2230a_100000686031_100000707719 [0,2,0,0,0,0|0,0,0]=2 11064 B16R2.1063 Clc1ccc(cc1Br)NCc2c[nH]cn2 34a_100000686031_100000707719 [0,2,0,0,0,0|0,0,0]=2 11065 B16R2.1063 Clc1ccc(cc1Br)NCc2cc[nH]n2 207a_100000686031_100000738523 [0,2,0,0,0,0|2,0,0]=4 11066 B16R2.1063 Clc1ccc(cc1Br)NCc2ccco2 207a_100000686031_100000186105 [0,2,0,0,0,0|2,0,0]=4 11067 B16R2.1063 Clc1ccc(cc1Br)NCc2ccco2 270302a_100000686031_100000186105 [0,2,0,0,0,0|2,0,0]=4 11068 B16R2.1063 Clc1ccc(cc1Br)NCc2cccs2 207a_100000686031_100000209959 [0,2,0,0,0,0|2,0,0]=4 11069 B16R2.1063 Clc1ccc(cc1Br)NCc2cccs2 270302a_100000686031_100000209959 [0,2,0,0,0,0|2,0,0]=4 11070 B16R2.1063 Clc1ccc(cc1Br)NCc2ccoc2 207a_100000686031_100011215517 [0,2,0,0,0,0|2,0,0]=4 11071 B16R2.1063 Clc1ccc(cc1Br)NCc2ccon2 2230a_100000686031_100000234950 [0,2,0,0,0,0|2,0,0]=4 11072 B16R2.1063 Clc1ccc(cc1Br)NCc2ccon2 34a_100000686031_100000234950 [0,2,0,0,0,0|2,0,0]=4 11073 B16R2.1063 Clc1ccc(cc1Br)NCc2ccsc2 207a_100000686031_100000188534 [0,2,0,0,0,0|2,0,0]=4 11074 B16R2.1063 Clc1ccc(cc1Br)NCc2ccsc2 2230a_100000686031_100011261437 [0,2,0,0,0,0|2,0,0]=4 11075 B16R2.1063 Clc1ccc(cc1Br)NCc2ccsc2 270302a_100000686031_100000188534 [0,2,0,0,0,0|2,0,0]=4 11076 B16R2.1063 Clc1ccc(cc1Br)NCc2ccsc2 34a_100000686031_100011261437 [0,2,0,0,0,0|2,0,0]=4 11077 B16R2.1063 Clc1ccc(cc1Br)NCc2cn[nH]c2 207a_100000686031_100016992096 [0,2,0,0,0,0|2,0,0]=4 11078 B16R2.1063 Clc1ccc(cc1Br)NCc2cn[nH]c2 270302a_100000686031_100016992096 [0,2,0,0,0,0|2,0,0]=4 11079 B16R2.1063 Clc1ccc(cc1Br)NCc2cnc[nH]2 207a_100000686031_100000742939 [0,2,0,0,0,0|0,0,2]=4 11080 B16R2.1063 Clc1ccc(cc1Br)NCc2cncs2 207a_100000686031_100000749870 [0,2,0,0,0,0|1,0,1]=4 11081 B16R2.1063 Clc1ccc(cc1Br)NCc2cncs2 2230a_100000686031_100015185245 [0,2,0,0,0,0|1,0,1]=4 11082 B16R2.1063 Clc1ccc(cc1Br)NCc2cncs2 270302a_100000686031_100000749870 [0,2,0,0,0,0|1,0,1]=4 11083 B16R2.1063 Clc1ccc(cc1Br)NCc2cncs2 34a_100000686031_100015185245 [0,2,0,0,0,0|1,0,1]=4 11084 B16R2.1063 Clc1ccc(cc1Br)NCc2cscn2 207a_100000686031_100000743575 [0,2,0,0,0,0|1,0,0]=3 11085 B16R2.1063 Clc1ccc(cc1Br)NCc2cscn2 2230a_100000686031_100000205941 [0,2,0,0,0,0|1,0,0]=3 11086 B16R2.1063 Clc1ccc(cc1Br)NCc2cscn2 270302a_100000686031_100000743575 [0,2,0,0,0,0|1,0,0]=3 11087 B16R2.1063 Clc1ccc(cc1Br)NCc2cscn2 34a_100000686031_100000205941 [0,2,0,0,0,0|1,0,0]=3 11088 B16R2.1063 Clc1ccc(cc1Br)NCc2ncc[nH]2 207a_100000686031_100000743867 [0,2,0,0,0,0|2,0,0]=4 11089 B16R2.1063 Clc1ccc(cc1Br)NCc2ncc[nH]2 2230a_100000686031_100016991755 [0,2,0,0,0,0|2,0,0]=4 11090 B16R2.1063 Clc1ccc(cc1Br)NCc2ncc[nH]2 34a_100000686031_100016991755 [0,2,0,0,0,0|2,0,0]=4 11091 B16R2.1063 Clc1ccc(cc1Br)NCc2ncco2 2230a_100000686031_103436540062 [0,2,0,0,0,0|2,0,0]=4 11092 B16R2.1063 Clc1ccc(cc1Br)NCc2ncco2 34a_100000686031_103436540062 [0,2,0,0,0,0|2,0,0]=4 11093 B16R2.1063 Clc1ccc(cc1Br)NCc2nccs2 207a_100000686031_100000750902 [0,2,0,0,0,0|2,0,0]=4 11094 B16R2.1063 Clc1ccc(cc1Br)NCc2nccs2 2230a_100000686031_100015184050 [0,2,0,0,0,0|2,0,0]=4 11095 B16R2.1063 Clc1ccc(cc1Br)NCc2nccs2 270302a_100000686031_100000750902 [0,2,0,0,0,0|2,0,0]=4 11096 B16R2.1063 Clc1ccc(cc1Br)NCc2nccs2 34a_100000686031_100015184050 [0,2,0,0,0,0|2,0,0]=4 11097 B16R2.1063 Clc1ccc(cc1Br)NCc2ncon2 34a_100000686031_100000233494 [0,2,0,0,0,0|2,0,0]=4 11098 B16R2.1063 Clc1ccc(cc1Br)NCn2cncn2 2230a_100000686031_200020645497 [0,2,0,0,0,0|1,0,1]=4 11099 B16R2.1063 Clc1ccc(cc1Br)NCn2cncn2 34a_100000686031_200020645497 [0,2,0,0,0,0|1,0,1]=4 11100 B16R2.1063 Clc1ccc(cc1Br)OCc2c[nH]cn2 34a_100011933957_100000707719 [0,2,0,0,0,0|1,0,0]=3 11101 B16R2.1063 Clc1ccc(cc1Br)OCc2cscn2 34a_100011933957_100000205941 [0,2,0,0,0,0|2,0,0]=4 11102 B16R2.1063 Clc1ccc(cc1Br)OCc2cscn2 7a_100011933957_100000205941 [0,2,0,0,0,0|2,0,0]=4 11103 B16R2.1063 Clc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100012353702 [0,2,0,0,0,0|1,0,0]=3 11104 B16R2.1063 Clc1ccc(cc1Br)SCc2c[nH]cn2 62a_100012353702_100000707719 [0,2,0,0,0,0|1,0,0]=3 11105 B16R2.1063 Clc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100012353702 [0,2,0,0,0,0|2,0,0]=4 11106 B16R2.1063 Clc1ccc(cc1Br)SCc2cscn2 62a_100012353702_100000205941 [0,2,0,0,0,0|2,0,0]=4 11107 B16R2.1063 Clc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100000184707_100000756875 [0,2,0,0,0,0|2,0,0]=4 11108 B16R2.1063 Clc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100000756875_100000184707 [0,2,0,0,0,0|2,0,0]=4 11109 B16R2.1063 Clc1ccc(cc1Cl)NCc2c[nH]cn2 2230a_100000184108_100000707719 [0,2,0,0,0,0|0,0,0]=2 11110 B16R2.1063 Clc1ccc(cc1Cl)NCc2c[nH]cn2 34a_100000184108_100000707719 [0,2,0,0,0,0|0,0,0]=2 11111 B16R2.1063 Clc1ccc(cc1Cl)NCc2cc[nH]n2 207a_100000184108_100000738523 [0,2,0,0,0,0|2,0,0]=4 11112 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccco2 207a_100000184108_100000186105 [0,2,0,0,0,0|2,0,0]=4 11113 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccco2 270302a_100000184108_100000186105 [0,2,0,0,0,0|2,0,0]=4 11114 B16R2.1063 Clc1ccc(cc1Cl)NCc2cccs2 207a_100000184108_100000209959 [0,2,0,0,0,0|2,0,0]=4 11115 B16R2.1063 Clc1ccc(cc1Cl)NCc2cccs2 270302a_100000184108_100000209959 [0,2,0,0,0,0|2,0,0]=4 11116 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccoc2 207a_100000184108_100011215517 [0,2,0,0,0,0|2,0,0]=4 11117 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccon2 2230a_100000184108_100000234950 [0,2,0,0,0,0|2,0,0]=4 11118 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccon2 34a_100000184108_100000234950 [0,2,0,0,0,0|2,0,0]=4 11119 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccsc2 207a_100000184108_100000188534 [0,2,0,0,0,0|2,0,0]=4 11120 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccsc2 2230a_100000184108_100011261437 [0,2,0,0,0,0|2,0,0]=4 11121 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccsc2 270302a_100000184108_100000188534 [0,2,0,0,0,0|2,0,0]=4 11122 B16R2.1063 Clc1ccc(cc1Cl)NCc2ccsc2 34a_100000184108_100011261437 [0,2,0,0,0,0|2,0,0]=4 11123 B16R2.1063 Clc1ccc(cc1Cl)NCc2cn[nH]c2 207a_100000184108_100016992096 [0,2,0,0,0,0|2,0,0]=4 11124 B16R2.1063 Clc1ccc(cc1Cl)NCc2cn[nH]c2 270302a_100000184108_100016992096 [0,2,0,0,0,0|2,0,0]=4 11125 B16R2.1063 Clc1ccc(cc1Cl)NCc2cnc[nH]2 207a_100000184108_100000742939 [0,2,0,0,0,0|0,0,2]=4 11126 B16R2.1063 Clc1ccc(cc1Cl)NCc2cncs2 207a_100000184108_100000749870 [0,2,0,0,0,0|1,0,1]=4 11127 B16R2.1063 Clc1ccc(cc1Cl)NCc2cncs2 2230a_100000184108_100015185245 [0,2,0,0,0,0|1,0,1]=4 11128 B16R2.1063 Clc1ccc(cc1Cl)NCc2cncs2 270302a_100000184108_100000749870 [0,2,0,0,0,0|1,0,1]=4 11129 B16R2.1063 Clc1ccc(cc1Cl)NCc2cncs2 34a_100000184108_100015185245 [0,2,0,0,0,0|1,0,1]=4 11130 B16R2.1063 Clc1ccc(cc1Cl)NCc2cscn2 207a_100000184108_100000743575 [0,2,0,0,0,0|1,0,0]=3 11131 B16R2.1063 Clc1ccc(cc1Cl)NCc2cscn2 2230a_100000184108_100000205941 [0,2,0,0,0,0|1,0,0]=3 11132 B16R2.1063 Clc1ccc(cc1Cl)NCc2cscn2 270302a_100000184108_100000743575 [0,2,0,0,0,0|1,0,0]=3 11133 B16R2.1063 Clc1ccc(cc1Cl)NCc2cscn2 34a_100000184108_100000205941 [0,2,0,0,0,0|1,0,0]=3 11134 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncc[nH]2 207a_100000184108_100000743867 [0,2,0,0,0,0|2,0,0]=4 11135 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncc[nH]2 2230a_100000184108_100016991755 [0,2,0,0,0,0|2,0,0]=4 11136 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncc[nH]2 34a_100000184108_100016991755 [0,2,0,0,0,0|2,0,0]=4 11137 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncco2 2230a_100000184108_103436540062 [0,2,0,0,0,0|2,0,0]=4 11138 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncco2 34a_100000184108_103436540062 [0,2,0,0,0,0|2,0,0]=4 11139 B16R2.1063 Clc1ccc(cc1Cl)NCc2nccs2 207a_100000184108_100000750902 [0,2,0,0,0,0|2,0,0]=4 11140 B16R2.1063 Clc1ccc(cc1Cl)NCc2nccs2 2230a_100000184108_100015184050 [0,2,0,0,0,0|2,0,0]=4 11141 B16R2.1063 Clc1ccc(cc1Cl)NCc2nccs2 270302a_100000184108_100000750902 [0,2,0,0,0,0|2,0,0]=4 11142 B16R2.1063 Clc1ccc(cc1Cl)NCc2nccs2 34a_100000184108_100015184050 [0,2,0,0,0,0|2,0,0]=4 11143 B16R2.1063 Clc1ccc(cc1Cl)NCc2ncon2 34a_100000184108_100000233494 [0,2,0,0,0,0|2,0,0]=4 11144 B16R2.1063 Clc1ccc(cc1Cl)NCn2cncn2 2230a_100000184108_200020645497 [0,2,0,0,0,0|1,0,1]=4 11145 B16R2.1063 Clc1ccc(cc1Cl)NCn2cncn2 34a_100000184108_200020645497 [0,2,0,0,0,0|1,0,1]=4 11146 B16R2.1063 Clc1ccc(cc1Cl)OCc2c[nH]cn2 34a_100000211054_100000707719 [0,2,0,0,0,0|1,0,0]=3 11147 B16R2.1063 Clc1ccc(cc1Cl)OCc2cscn2 34a_100000211054_100000205941 [0,2,0,0,0,0|2,0,0]=4 11148 B16R2.1063 Clc1ccc(cc1Cl)OCc2cscn2 7a_100000211054_100000205941 [0,2,0,0,0,0|2,0,0]=4 11149 B16R2.1063 Clc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100011214914 [0,2,0,0,0,0|1,0,0]=3 11150 B16R2.1063 Clc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100011214914_100000707719 [0,2,0,0,0,0|1,0,0]=3 11151 B16R2.1063 Clc1ccc(cc1Cl)SCc2cscn2 62a_100000205941_100011214914 [0,2,0,0,0,0|2,0,0]=4 11152 B16R2.1063 Clc1ccc(cc1Cl)SCc2cscn2 62a_100011214914_100000205941 [0,2,0,0,0,0|2,0,0]=4 11153 B16R2.1063 Clc1ccc(cc1I)NCc2c[nH]cn2 34a_100012360549_100000707719 [0,2,0,0,0,0|0,0,0]=2 11154 B16R2.1063 Clc1ccc(cc1I)NCc2cc[nH]n2 207a_100012360549_100000738523 [0,2,0,0,0,0|2,0,0]=4 11155 B16R2.1063 Clc1ccc(cc1I)NCc2ccco2 207a_100012360549_100000186105 [0,2,0,0,0,0|2,0,0]=4 11156 B16R2.1063 Clc1ccc(cc1I)NCc2ccco2 270302a_100012360549_100000186105 [0,2,0,0,0,0|2,0,0]=4 11157 B16R2.1063 Clc1ccc(cc1I)NCc2cccs2 207a_100012360549_100000209959 [0,2,0,0,0,0|2,0,0]=4 11158 B16R2.1063 Clc1ccc(cc1I)NCc2cccs2 270302a_100012360549_100000209959 [0,2,0,0,0,0|2,0,0]=4 11159 B16R2.1063 Clc1ccc(cc1I)NCc2ccoc2 207a_100012360549_100011215517 [0,2,0,0,0,0|2,0,0]=4 11160 B16R2.1063 Clc1ccc(cc1I)NCc2ccon2 34a_100012360549_100000234950 [0,2,0,0,0,0|2,0,0]=4 11161 B16R2.1063 Clc1ccc(cc1I)NCc2ccsc2 207a_100012360549_100000188534 [0,2,0,0,0,0|2,0,0]=4 11162 B16R2.1063 Clc1ccc(cc1I)NCc2ccsc2 270302a_100012360549_100000188534 [0,2,0,0,0,0|2,0,0]=4 11163 B16R2.1063 Clc1ccc(cc1I)NCc2ccsc2 34a_100012360549_100011261437 [0,2,0,0,0,0|2,0,0]=4 11164 B16R2.1063 Clc1ccc(cc1I)NCc2cn[nH]c2 207a_100012360549_100016992096 [0,2,0,0,0,0|2,0,0]=4 11165 B16R2.1063 Clc1ccc(cc1I)NCc2cn[nH]c2 270302a_100012360549_100016992096 [0,2,0,0,0,0|2,0,0]=4 11166 B16R2.1063 Clc1ccc(cc1I)NCc2cnc[nH]2 207a_100012360549_100000742939 [0,2,0,0,0,0|0,0,2]=4 11167 B16R2.1063 Clc1ccc(cc1I)NCc2cncs2 207a_100012360549_100000749870 [0,2,0,0,0,0|1,0,1]=4 11168 B16R2.1063 Clc1ccc(cc1I)NCc2cncs2 270302a_100012360549_100000749870 [0,2,0,0,0,0|1,0,1]=4 11169 B16R2.1063 Clc1ccc(cc1I)NCc2cncs2 34a_100012360549_100015185245 [0,2,0,0,0,0|1,0,1]=4 11170 B16R2.1063 Clc1ccc(cc1I)NCc2cscn2 207a_100012360549_100000743575 [0,2,0,0,0,0|1,0,0]=3 11171 B16R2.1063 Clc1ccc(cc1I)NCc2cscn2 270302a_100012360549_100000743575 [0,2,0,0,0,0|1,0,0]=3 11172 B16R2.1063 Clc1ccc(cc1I)NCc2cscn2 34a_100012360549_100000205941 [0,2,0,0,0,0|1,0,0]=3 11173 B16R2.1063 Clc1ccc(cc1I)NCc2ncc[nH]2 207a_100012360549_100000743867 [0,2,0,0,0,0|2,0,0]=4 11174 B16R2.1063 Clc1ccc(cc1I)NCc2ncc[nH]2 34a_100012360549_100016991755 [0,2,0,0,0,0|2,0,0]=4 11175 B16R2.1063 Clc1ccc(cc1I)NCc2ncco2 34a_100012360549_103436540062 [0,2,0,0,0,0|2,0,0]=4 11176 B16R2.1063 Clc1ccc(cc1I)NCc2nccs2 207a_100012360549_100000750902 [0,2,0,0,0,0|2,0,0]=4 11177 B16R2.1063 Clc1ccc(cc1I)NCc2nccs2 270302a_100012360549_100000750902 [0,2,0,0,0,0|2,0,0]=4 11178 B16R2.1063 Clc1ccc(cc1I)NCc2nccs2 34a_100012360549_100015184050 [0,2,0,0,0,0|2,0,0]=4 11179 B16R2.1063 Clc1ccc(cc1I)NCc2ncon2 34a_100012360549_100000233494 [0,2,0,0,0,0|2,0,0]=4 11180 B16R2.1063 Clc1ccc(cc1I)NCn2cncn2 34a_100012360549_200020645497 [0,2,0,0,0,0|1,0,1]=4 11181 B16R2.1063 Clc1ccc(cc1I)OCc2c[nH]cn2 34a_100000049588_100000707719 [0,2,0,0,0,0|1,0,0]=3 11182 B16R2.1063 Clc1ccc(cc1I)OCc2cscn2 34a_100000049588_100000205941 [0,2,0,0,0,0|2,0,0]=4 11183 B16R2.1063 Clc1ccc(cc1I)OCc2cscn2 7a_100000049588_100000205941 [0,2,0,0,0,0|2,0,0]=4 11184 B16R2.1063 Clc1cnc(cc1Cl)OCc2c[nH]cn2 34a_200000099200_100000707719 [0,2,0,0,0,0|2,0,0]=4 11185 B16R2.1063 Clc1ncc(cc1Br)OCc2c[nH]cn2 34a_100012356455_100000707719 [0,2,0,0,0,0|2,0,0]=4 11186 B16R2.1063 Clc1ncc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100010172733 [0,2,0,0,0,0|2,0,0]=4 11187 B16R2.1063 Clc1ncc(cc1Br)SCc2c[nH]cn2 62a_100010172733_100000707719 [0,2,0,0,0,0|2,0,0]=4 11188 B16R2.1063 Cn1cc(ccc1=O)SCc2c[nH]cn2 62a_100000707719_100011245003 [0,2,0,0,0,0|2,0,0]=4 11189 B16R2.1063 Cn1cc(ccc1=O)SCc2c[nH]cn2 62a_100011245003_100000707719 [0,2,0,0,0,0|2,0,0]=4 11190 B16R2.1063 Cn1ccc(cc1=O)NCc2c[nH]cn2 27a_100000758547_100009820031 [0,2,0,0,0,0|1,0,0]=3 11191 B16R2.1063 Cn1ccc(cc1=O)NCc2c[nH]nn2 27a_100020620823_100009820031 [0,2,0,0,0,0|2,0,0]=4 11192 B16R2.1063 Cn1ccc(cc1=O)NCc2cocn2 27a_100015188801_100009820031 [0,2,0,0,0,0|2,0,0]=4 11193 B16R2.1063 Cn1ccc(cc1=O)NCc2cscn2 27a_100015185402_100009820031 [0,2,0,0,0,0|2,0,0]=4 11194 B16R2.1063 Cn1ccc(cc1=O)SCc2c[nH]cn2 62a_100000707719_100009820031 [0,2,0,0,0,0|2,0,0]=4 11195 B16R2.1063 Cn1ccc(cc1=O)SCc2c[nH]cn2 62a_100009820031_100000707719 [0,2,0,0,0,0|2,0,0]=4 11196 B16R2.1063 Cn1cnc(cc1=O)NCc2c[nH]cn2 27a_100000758547_100012179353 [0,2,0,0,0,0|2,0,0]=4 11197 B16R2.1063 Fc1cc(ccc1Br)CSc2c[nH]cn2 62a_100000756875_100000767054 [0,2,0,0,0,0|2,0,0]=4 11198 B16R2.1063 Fc1cc(ccc1Br)CSc2c[nH]cn2 62a_100000767054_100000756875 [0,2,0,0,0,0|2,0,0]=4 11199 B16R2.1063 Fc1cc(ccc1Br)NCc2c[nH]cn2 2230a_100000759894_100000707719 [0,2,0,0,0,0|0,0,0]=2 11200 B16R2.1063 Fc1cc(ccc1Br)NCc2c[nH]cn2 34a_100000759894_100000707719 [0,2,0,0,0,0|0,0,0]=2 11201 B16R2.1063 Fc1cc(ccc1Br)NCc2cc[nH]n2 207a_100000759894_100000738523 [0,2,0,0,0,0|2,0,0]=4 11202 B16R2.1063 Fc1cc(ccc1Br)NCc2ccco2 207a_100000759894_100000186105 [0,2,0,0,0,0|2,0,0]=4 11203 B16R2.1063 Fc1cc(ccc1Br)NCc2ccco2 270302a_100000759894_100000186105 [0,2,0,0,0,0|2,0,0]=4 11204 B16R2.1063 Fc1cc(ccc1Br)NCc2cccs2 207a_100000759894_100000209959 [0,2,0,0,0,0|2,0,0]=4 11205 B16R2.1063 Fc1cc(ccc1Br)NCc2cccs2 270302a_100000759894_100000209959 [0,2,0,0,0,0|2,0,0]=4 11206 B16R2.1063 Fc1cc(ccc1Br)NCc2ccoc2 207a_100000759894_100011215517 [0,2,0,0,0,0|2,0,0]=4 11207 B16R2.1063 Fc1cc(ccc1Br)NCc2ccon2 2230a_100000759894_100000234950 [0,2,0,0,0,0|2,0,0]=4 11208 B16R2.1063 Fc1cc(ccc1Br)NCc2ccon2 34a_100000759894_100000234950 [0,2,0,0,0,0|2,0,0]=4 11209 B16R2.1063 Fc1cc(ccc1Br)NCc2ccon2 7a_100000759894_100000234950 [0,2,0,0,0,0|2,0,0]=4 11210 B16R2.1063 Fc1cc(ccc1Br)NCc2ccsc2 207a_100000759894_100000188534 [0,2,0,0,0,0|2,0,0]=4 11211 B16R2.1063 Fc1cc(ccc1Br)NCc2ccsc2 2230a_100000759894_100011261437 [0,2,0,0,0,0|2,0,0]=4 11212 B16R2.1063 Fc1cc(ccc1Br)NCc2ccsc2 270302a_100000759894_100000188534 [0,2,0,0,0,0|2,0,0]=4 11213 B16R2.1063 Fc1cc(ccc1Br)NCc2ccsc2 34a_100000759894_100011261437 [0,2,0,0,0,0|2,0,0]=4 11214 B16R2.1063 Fc1cc(ccc1Br)NCc2ccsc2 7a_100000759894_100011261437 [0,2,0,0,0,0|2,0,0]=4 11215 B16R2.1063 Fc1cc(ccc1Br)NCc2cn[nH]c2 207a_100000759894_100016992096 [0,2,0,0,0,0|2,0,0]=4 11216 B16R2.1063 Fc1cc(ccc1Br)NCc2cn[nH]c2 270302a_100000759894_100016992096 [0,2,0,0,0,0|2,0,0]=4 11217 B16R2.1063 Fc1cc(ccc1Br)NCc2cnc[nH]2 207a_100000759894_100000742939 [0,2,0,0,0,0|0,0,2]=4 11218 B16R2.1063 Fc1cc(ccc1Br)NCc2cncs2 207a_100000759894_100000749870 [0,2,0,0,0,0|1,0,1]=4 11219 B16R2.1063 Fc1cc(ccc1Br)NCc2cncs2 2230a_100000759894_100015185245 [0,2,0,0,0,0|1,0,1]=4 11220 B16R2.1063 Fc1cc(ccc1Br)NCc2cncs2 270302a_100000759894_100000749870 [0,2,0,0,0,0|1,0,1]=4 11221 B16R2.1063 Fc1cc(ccc1Br)NCc2cncs2 34a_100000759894_100015185245 [0,2,0,0,0,0|1,0,1]=4 11222 B16R2.1063 Fc1cc(ccc1Br)NCc2cncs2 7a_100000759894_100015185245 [0,2,0,0,0,0|1,0,1]=4 11223 B16R2.1063 Fc1cc(ccc1Br)NCc2cscn2 207a_100000759894_100000743575 [0,2,0,0,0,0|1,0,0]=3 11224 B16R2.1063 Fc1cc(ccc1Br)NCc2cscn2 2230a_100000759894_100000205941 [0,2,0,0,0,0|1,0,0]=3 11225 B16R2.1063 Fc1cc(ccc1Br)NCc2cscn2 270302a_100000759894_100000743575 [0,2,0,0,0,0|1,0,0]=3 11226 B16R2.1063 Fc1cc(ccc1Br)NCc2cscn2 34a_100000759894_100000205941 [0,2,0,0,0,0|1,0,0]=3 11227 B16R2.1063 Fc1cc(ccc1Br)NCc2cscn2 7a_100000759894_100000205941 [0,2,0,0,0,0|1,0,0]=3 11228 B16R2.1063 Fc1cc(ccc1Br)NCc2ncc[nH]2 207a_100000759894_100000743867 [0,2,0,0,0,0|2,0,0]=4 11229 B16R2.1063 Fc1cc(ccc1Br)NCc2ncc[nH]2 2230a_100000759894_100016991755 [0,2,0,0,0,0|2,0,0]=4 11230 B16R2.1063 Fc1cc(ccc1Br)NCc2ncc[nH]2 34a_100000759894_100016991755 [0,2,0,0,0,0|2,0,0]=4 11231 B16R2.1063 Fc1cc(ccc1Br)NCc2ncc[nH]2 7a_100000759894_100000753453 [0,2,0,0,0,0|2,0,0]=4 11232 B16R2.1063 Fc1cc(ccc1Br)NCc2ncco2 2230a_100000759894_103436540062 [0,2,0,0,0,0|2,0,0]=4 11233 B16R2.1063 Fc1cc(ccc1Br)NCc2ncco2 34a_100000759894_103436540062 [0,2,0,0,0,0|2,0,0]=4 11234 B16R2.1063 Fc1cc(ccc1Br)NCc2ncco2 7a_100000759894_103436540062 [0,2,0,0,0,0|2,0,0]=4 11235 B16R2.1063 Fc1cc(ccc1Br)NCc2nccs2 207a_100000759894_100000750902 [0,2,0,0,0,0|2,0,0]=4 11236 B16R2.1063 Fc1cc(ccc1Br)NCc2nccs2 2230a_100000759894_100015184050 [0,2,0,0,0,0|2,0,0]=4 11237 B16R2.1063 Fc1cc(ccc1Br)NCc2nccs2 270302a_100000759894_100000750902 [0,2,0,0,0,0|2,0,0]=4 11238 B16R2.1063 Fc1cc(ccc1Br)NCc2nccs2 34a_100000759894_100015184050 [0,2,0,0,0,0|2,0,0]=4 11239 B16R2.1063 Fc1cc(ccc1Br)NCc2nccs2 7a_100000759894_100015184050 [0,2,0,0,0,0|2,0,0]=4 11240 B16R2.1063 Fc1cc(ccc1Br)NCc2ncon2 34a_100000759894_100000233494 [0,2,0,0,0,0|2,0,0]=4 11241 B16R2.1063 Fc1cc(ccc1Br)NCn2cncn2 2230a_100000759894_200020645497 [0,2,0,0,0,0|1,0,1]=4 11242 B16R2.1063 Fc1cc(ccc1Br)NCn2cncn2 34a_100000759894_200020645497 [0,2,0,0,0,0|1,0,1]=4 11243 B16R2.1063 Fc1cc(ccc1Br)NCn2cncn2 7a_100000759894_200020645497 [0,2,0,0,0,0|1,0,1]=4 11244 B16R2.1063 Fc1cc(ccc1Br)OCc2c[nH]cn2 34a_100000755031_100000707719 [0,2,0,0,0,0|1,0,0]=3 11245 B16R2.1063 Fc1cc(ccc1Br)OCc2cscn2 34a_100000755031_100000205941 [0,2,0,0,0,0|2,0,0]=4 11246 B16R2.1063 Fc1cc(ccc1Br)OCc2cscn2 7a_100000755031_100000205941 [0,2,0,0,0,0|2,0,0]=4 11247 B16R2.1063 Fc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000685389_100000707719 [0,2,0,0,0,0|1,0,0]=3 11248 B16R2.1063 Fc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100000685389 [0,2,0,0,0,0|1,0,0]=3 11249 B16R2.1063 Fc1cc(ccc1Br)SCc2cscn2 62a_100000205941_100000685389 [0,2,0,0,0,0|2,0,0]=4 11250 B16R2.1063 Fc1cc(ccc1Br)SCc2cscn2 62a_100000685389_100000205941 [0,2,0,0,0,0|2,0,0]=4 11251 B16R2.1063 Fc1cc(ccc1Cl)CSc2c[nH]cn2 62a_100000716492_100000756875 [0,2,0,0,0,0|2,0,0]=4 11252 B16R2.1063 Fc1cc(ccc1Cl)CSc2c[nH]cn2 62a_100000756875_100000716492 [0,2,0,0,0,0|2,0,0]=4 11253 B16R2.1063 Fc1cc(ccc1Cl)NCc2c[nH]cn2 2230a_100000739366_100000707719 [0,2,0,0,0,0|0,0,0]=2 11254 B16R2.1063 Fc1cc(ccc1Cl)NCc2c[nH]cn2 34a_100000739366_100000707719 [0,2,0,0,0,0|0,0,0]=2 11255 B16R2.1063 Fc1cc(ccc1Cl)NCc2cc[nH]n2 207a_100000739366_100000738523 [0,2,0,0,0,0|2,0,0]=4 11256 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccco2 207a_100000739366_100000186105 [0,2,0,0,0,0|2,0,0]=4 11257 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccco2 270302a_100000739366_100000186105 [0,2,0,0,0,0|2,0,0]=4 11258 B16R2.1063 Fc1cc(ccc1Cl)NCc2cccs2 207a_100000739366_100000209959 [0,2,0,0,0,0|2,0,0]=4 11259 B16R2.1063 Fc1cc(ccc1Cl)NCc2cccs2 270302a_100000739366_100000209959 [0,2,0,0,0,0|2,0,0]=4 11260 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccoc2 207a_100000739366_100011215517 [0,2,0,0,0,0|2,0,0]=4 11261 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccon2 2230a_100000739366_100000234950 [0,2,0,0,0,0|2,0,0]=4 11262 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccon2 34a_100000739366_100000234950 [0,2,0,0,0,0|2,0,0]=4 11263 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccon2 7a_100000739366_100000234950 [0,2,0,0,0,0|2,0,0]=4 11264 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccsc2 207a_100000739366_100000188534 [0,2,0,0,0,0|2,0,0]=4 11265 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccsc2 2230a_100000739366_100011261437 [0,2,0,0,0,0|2,0,0]=4 11266 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccsc2 270302a_100000739366_100000188534 [0,2,0,0,0,0|2,0,0]=4 11267 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccsc2 34a_100000739366_100011261437 [0,2,0,0,0,0|2,0,0]=4 11268 B16R2.1063 Fc1cc(ccc1Cl)NCc2ccsc2 7a_100000739366_100011261437 [0,2,0,0,0,0|2,0,0]=4 11269 B16R2.1063 Fc1cc(ccc1Cl)NCc2cn[nH]c2 207a_100000739366_100016992096 [0,2,0,0,0,0|2,0,0]=4 11270 B16R2.1063 Fc1cc(ccc1Cl)NCc2cn[nH]c2 270302a_100000739366_100016992096 [0,2,0,0,0,0|2,0,0]=4 11271 B16R2.1063 Fc1cc(ccc1Cl)NCc2cnc[nH]2 207a_100000739366_100000742939 [0,2,0,0,0,0|0,0,2]=4 11272 B16R2.1063 Fc1cc(ccc1Cl)NCc2cncs2 207a_100000739366_100000749870 [0,2,0,0,0,0|1,0,1]=4 11273 B16R2.1063 Fc1cc(ccc1Cl)NCc2cncs2 2230a_100000739366_100015185245 [0,2,0,0,0,0|1,0,1]=4 11274 B16R2.1063 Fc1cc(ccc1Cl)NCc2cncs2 270302a_100000739366_100000749870 [0,2,0,0,0,0|1,0,1]=4 11275 B16R2.1063 Fc1cc(ccc1Cl)NCc2cncs2 34a_100000739366_100015185245 [0,2,0,0,0,0|1,0,1]=4 11276 B16R2.1063 Fc1cc(ccc1Cl)NCc2cncs2 7a_100000739366_100015185245 [0,2,0,0,0,0|1,0,1]=4 11277 B16R2.1063 Fc1cc(ccc1Cl)NCc2cscn2 207a_100000739366_100000743575 [0,2,0,0,0,0|1,0,0]=3 11278 B16R2.1063 Fc1cc(ccc1Cl)NCc2cscn2 2230a_100000739366_100000205941 [0,2,0,0,0,0|1,0,0]=3 11279 B16R2.1063 Fc1cc(ccc1Cl)NCc2cscn2 270302a_100000739366_100000743575 [0,2,0,0,0,0|1,0,0]=3 11280 B16R2.1063 Fc1cc(ccc1Cl)NCc2cscn2 34a_100000739366_100000205941 [0,2,0,0,0,0|1,0,0]=3 11281 B16R2.1063 Fc1cc(ccc1Cl)NCc2cscn2 7a_100000739366_100000205941 [0,2,0,0,0,0|1,0,0]=3 11282 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncc[nH]2 207a_100000739366_100000743867 [0,2,0,0,0,0|2,0,0]=4 11283 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncc[nH]2 2230a_100000739366_100016991755 [0,2,0,0,0,0|2,0,0]=4 11284 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncc[nH]2 34a_100000739366_100016991755 [0,2,0,0,0,0|2,0,0]=4 11285 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncc[nH]2 7a_100000739366_100000753453 [0,2,0,0,0,0|2,0,0]=4 11286 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncco2 2230a_100000739366_103436540062 [0,2,0,0,0,0|2,0,0]=4 11287 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncco2 34a_100000739366_103436540062 [0,2,0,0,0,0|2,0,0]=4 11288 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncco2 7a_100000739366_103436540062 [0,2,0,0,0,0|2,0,0]=4 11289 B16R2.1063 Fc1cc(ccc1Cl)NCc2nccs2 207a_100000739366_100000750902 [0,2,0,0,0,0|2,0,0]=4 11290 B16R2.1063 Fc1cc(ccc1Cl)NCc2nccs2 2230a_100000739366_100015184050 [0,2,0,0,0,0|2,0,0]=4 11291 B16R2.1063 Fc1cc(ccc1Cl)NCc2nccs2 270302a_100000739366_100000750902 [0,2,0,0,0,0|2,0,0]=4 11292 B16R2.1063 Fc1cc(ccc1Cl)NCc2nccs2 34a_100000739366_100015184050 [0,2,0,0,0,0|2,0,0]=4 11293 B16R2.1063 Fc1cc(ccc1Cl)NCc2nccs2 7a_100000739366_100015184050 [0,2,0,0,0,0|2,0,0]=4 11294 B16R2.1063 Fc1cc(ccc1Cl)NCc2ncon2 34a_100000739366_100000233494 [0,2,0,0,0,0|2,0,0]=4 11295 B16R2.1063 Fc1cc(ccc1Cl)NCn2cncn2 2230a_100000739366_200020645497 [0,2,0,0,0,0|1,0,1]=4 11296 B16R2.1063 Fc1cc(ccc1Cl)NCn2cncn2 34a_100000739366_200020645497 [0,2,0,0,0,0|1,0,1]=4 11297 B16R2.1063 Fc1cc(ccc1Cl)NCn2cncn2 7a_100000739366_200020645497 [0,2,0,0,0,0|1,0,1]=4 11298 B16R2.1063 Fc1cc(ccc1Cl)OCc2c[nH]cn2 34a_100000691581_100000707719 [0,2,0,0,0,0|1,0,0]=3 11299 B16R2.1063 Fc1cc(ccc1Cl)OCc2cscn2 34a_100000691581_100000205941 [0,2,0,0,0,0|2,0,0]=4 11300 B16R2.1063 Fc1cc(ccc1Cl)OCc2cscn2 7a_100000691581_100000205941 [0,2,0,0,0,0|2,0,0]=4 11301 B16R2.1063 Fc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100000707719_100011216805 [0,2,0,0,0,0|1,0,0]=3 11302 B16R2.1063 Fc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100011216805_100000707719 [0,2,0,0,0,0|1,0,0]=3 11303 B16R2.1063 Fc1cc(ccc1Cl)SCc2cscn2 62a_100000205941_100011216805 [0,2,0,0,0,0|2,0,0]=4 11304 B16R2.1063 Fc1cc(ccc1Cl)SCc2cscn2 62a_100011216805_100000205941 [0,2,0,0,0,0|2,0,0]=4 11305 B16R2.1063 Fc1cc(ccc1I)CSc2c[nH]cn2 62a_100000756875_100010149604 [0,2,0,0,0,0|2,0,0]=4 11306 B16R2.1063 Fc1cc(ccc1I)CSc2c[nH]cn2 62a_100010149604_100000756875 [0,2,0,0,0,0|2,0,0]=4 11307 B16R2.1063 Fc1cc(ccc1I)NCc2c[nH]cn2 34a_100011356925_100000707719 [0,2,0,0,0,0|0,0,0]=2 11308 B16R2.1063 Fc1cc(ccc1I)NCc2cc[nH]n2 207a_100011356925_100000738523 [0,2,0,0,0,0|2,0,0]=4 11309 B16R2.1063 Fc1cc(ccc1I)NCc2ccco2 207a_100011356925_100000186105 [0,2,0,0,0,0|2,0,0]=4 11310 B16R2.1063 Fc1cc(ccc1I)NCc2ccco2 270302a_100011356925_100000186105 [0,2,0,0,0,0|2,0,0]=4 11311 B16R2.1063 Fc1cc(ccc1I)NCc2cccs2 207a_100011356925_100000209959 [0,2,0,0,0,0|2,0,0]=4 11312 B16R2.1063 Fc1cc(ccc1I)NCc2cccs2 270302a_100011356925_100000209959 [0,2,0,0,0,0|2,0,0]=4 11313 B16R2.1063 Fc1cc(ccc1I)NCc2ccoc2 207a_100011356925_100011215517 [0,2,0,0,0,0|2,0,0]=4 11314 B16R2.1063 Fc1cc(ccc1I)NCc2ccon2 34a_100011356925_100000234950 [0,2,0,0,0,0|2,0,0]=4 11315 B16R2.1063 Fc1cc(ccc1I)NCc2ccon2 7a_100011356925_100000234950 [0,2,0,0,0,0|2,0,0]=4 11316 B16R2.1063 Fc1cc(ccc1I)NCc2ccsc2 207a_100011356925_100000188534 [0,2,0,0,0,0|2,0,0]=4 11317 B16R2.1063 Fc1cc(ccc1I)NCc2ccsc2 270302a_100011356925_100000188534 [0,2,0,0,0,0|2,0,0]=4 11318 B16R2.1063 Fc1cc(ccc1I)NCc2ccsc2 34a_100011356925_100011261437 [0,2,0,0,0,0|2,0,0]=4 11319 B16R2.1063 Fc1cc(ccc1I)NCc2ccsc2 7a_100011356925_100011261437 [0,2,0,0,0,0|2,0,0]=4 11320 B16R2.1063 Fc1cc(ccc1I)NCc2cn[nH]c2 207a_100011356925_100016992096 [0,2,0,0,0,0|2,0,0]=4 11321 B16R2.1063 Fc1cc(ccc1I)NCc2cn[nH]c2 270302a_100011356925_100016992096 [0,2,0,0,0,0|2,0,0]=4 11322 B16R2.1063 Fc1cc(ccc1I)NCc2cnc[nH]2 207a_100011356925_100000742939 [0,2,0,0,0,0|0,0,2]=4 11323 B16R2.1063 Fc1cc(ccc1I)NCc2cncs2 207a_100011356925_100000749870 [0,2,0,0,0,0|1,0,1]=4 11324 B16R2.1063 Fc1cc(ccc1I)NCc2cncs2 270302a_100011356925_100000749870 [0,2,0,0,0,0|1,0,1]=4 11325 B16R2.1063 Fc1cc(ccc1I)NCc2cncs2 34a_100011356925_100015185245 [0,2,0,0,0,0|1,0,1]=4 11326 B16R2.1063 Fc1cc(ccc1I)NCc2cncs2 7a_100011356925_100015185245 [0,2,0,0,0,0|1,0,1]=4 11327 B16R2.1063 Fc1cc(ccc1I)NCc2cscn2 207a_100011356925_100000743575 [0,2,0,0,0,0|1,0,0]=3 11328 B16R2.1063 Fc1cc(ccc1I)NCc2cscn2 270302a_100011356925_100000743575 [0,2,0,0,0,0|1,0,0]=3 11329 B16R2.1063 Fc1cc(ccc1I)NCc2cscn2 34a_100011356925_100000205941 [0,2,0,0,0,0|1,0,0]=3 11330 B16R2.1063 Fc1cc(ccc1I)NCc2cscn2 7a_100011356925_100000205941 [0,2,0,0,0,0|1,0,0]=3 11331 B16R2.1063 Fc1cc(ccc1I)NCc2ncc[nH]2 207a_100011356925_100000743867 [0,2,0,0,0,0|2,0,0]=4 11332 B16R2.1063 Fc1cc(ccc1I)NCc2ncc[nH]2 34a_100011356925_100016991755 [0,2,0,0,0,0|2,0,0]=4 11333 B16R2.1063 Fc1cc(ccc1I)NCc2ncc[nH]2 7a_100011356925_100000753453 [0,2,0,0,0,0|2,0,0]=4 11334 B16R2.1063 Fc1cc(ccc1I)NCc2ncco2 34a_100011356925_103436540062 [0,2,0,0,0,0|2,0,0]=4 11335 B16R2.1063 Fc1cc(ccc1I)NCc2ncco2 7a_100011356925_103436540062 [0,2,0,0,0,0|2,0,0]=4 11336 B16R2.1063 Fc1cc(ccc1I)NCc2nccs2 207a_100011356925_100000750902 [0,2,0,0,0,0|2,0,0]=4 11337 B16R2.1063 Fc1cc(ccc1I)NCc2nccs2 270302a_100011356925_100000750902 [0,2,0,0,0,0|2,0,0]=4 11338 B16R2.1063 Fc1cc(ccc1I)NCc2nccs2 34a_100011356925_100015184050 [0,2,0,0,0,0|2,0,0]=4 11339 B16R2.1063 Fc1cc(ccc1I)NCc2nccs2 7a_100011356925_100015184050 [0,2,0,0,0,0|2,0,0]=4 11340 B16R2.1063 Fc1cc(ccc1I)NCc2ncon2 34a_100011356925_100000233494 [0,2,0,0,0,0|2,0,0]=4 11341 B16R2.1063 Fc1cc(ccc1I)NCn2cncn2 34a_100011356925_200020645497 [0,2,0,0,0,0|1,0,1]=4 11342 B16R2.1063 Fc1cc(ccc1I)NCn2cncn2 7a_100011356925_200020645497 [0,2,0,0,0,0|1,0,1]=4 11343 B16R2.1063 Fc1cc(ccc1I)OCc2c[nH]cn2 34a_100009990212_100000707719 [0,2,0,0,0,0|1,0,0]=3 11344 B16R2.1063 Fc1cc(ccc1I)OCc2cscn2 34a_100009990212_100000205941 [0,2,0,0,0,0|2,0,0]=4 11345 B16R2.1063 Fc1cc(ccc1I)OCc2cscn2 7a_100009990212_100000205941 [0,2,0,0,0,0|2,0,0]=4 11346 B16R2.1063 Fc1cc(cnc1Cl)OCc2c[nH]cn2 34a_100000063512_100000707719 [0,2,0,0,0,0|2,0,0]=4 11347 B16R2.1063 Fc1cc(cnc1F)SCc2c[nH]cn2 62a_100000707719_100009817721 [0,2,0,0,0,0|2,0,0]=4 11348 B16R2.1063 Fc1cc(cnc1F)SCc2c[nH]cn2 62a_100009817721_100000707719 [0,2,0,0,0,0|2,0,0]=4 11349 B16R2.1063 Fc1ccc(cc1Br)CSc2c[nH]cn2 62a_100000756875_100011206884 [0,2,0,0,0,0|2,0,0]=4 11350 B16R2.1063 Fc1ccc(cc1Br)CSc2c[nH]cn2 62a_100011206884_100000756875 [0,2,0,0,0,0|2,0,0]=4 11351 B16R2.1063 Fc1ccc(cc1Br)NCc2c[nH]cn2 2230a_100000760356_100000707719 [0,2,0,0,0,0|0,0,0]=2 11352 B16R2.1063 Fc1ccc(cc1Br)NCc2c[nH]cn2 34a_100000760356_100000707719 [0,2,0,0,0,0|0,0,0]=2 11353 B16R2.1063 Fc1ccc(cc1Br)NCc2cc[nH]n2 207a_100000760356_100000738523 [0,2,0,0,0,0|2,0,0]=4 11354 B16R2.1063 Fc1ccc(cc1Br)NCc2ccco2 207a_100000760356_100000186105 [0,2,0,0,0,0|2,0,0]=4 11355 B16R2.1063 Fc1ccc(cc1Br)NCc2ccco2 270302a_100000760356_100000186105 [0,2,0,0,0,0|2,0,0]=4 11356 B16R2.1063 Fc1ccc(cc1Br)NCc2cccs2 207a_100000760356_100000209959 [0,2,0,0,0,0|2,0,0]=4 11357 B16R2.1063 Fc1ccc(cc1Br)NCc2cccs2 270302a_100000760356_100000209959 [0,2,0,0,0,0|2,0,0]=4 11358 B16R2.1063 Fc1ccc(cc1Br)NCc2ccoc2 207a_100000760356_100011215517 [0,2,0,0,0,0|2,0,0]=4 11359 B16R2.1063 Fc1ccc(cc1Br)NCc2ccon2 2230a_100000760356_100000234950 [0,2,0,0,0,0|2,0,0]=4 11360 B16R2.1063 Fc1ccc(cc1Br)NCc2ccon2 34a_100000760356_100000234950 [0,2,0,0,0,0|2,0,0]=4 11361 B16R2.1063 Fc1ccc(cc1Br)NCc2ccon2 7a_100000760356_100000234950 [0,2,0,0,0,0|2,0,0]=4 11362 B16R2.1063 Fc1ccc(cc1Br)NCc2ccsc2 207a_100000760356_100000188534 [0,2,0,0,0,0|2,0,0]=4 11363 B16R2.1063 Fc1ccc(cc1Br)NCc2ccsc2 2230a_100000760356_100011261437 [0,2,0,0,0,0|2,0,0]=4 11364 B16R2.1063 Fc1ccc(cc1Br)NCc2ccsc2 270302a_100000760356_100000188534 [0,2,0,0,0,0|2,0,0]=4 11365 B16R2.1063 Fc1ccc(cc1Br)NCc2ccsc2 34a_100000760356_100011261437 [0,2,0,0,0,0|2,0,0]=4 11366 B16R2.1063 Fc1ccc(cc1Br)NCc2ccsc2 7a_100000760356_100011261437 [0,2,0,0,0,0|2,0,0]=4 11367 B16R2.1063 Fc1ccc(cc1Br)NCc2cn[nH]c2 207a_100000760356_100016992096 [0,2,0,0,0,0|2,0,0]=4 11368 B16R2.1063 Fc1ccc(cc1Br)NCc2cn[nH]c2 270302a_100000760356_100016992096 [0,2,0,0,0,0|2,0,0]=4 11369 B16R2.1063 Fc1ccc(cc1Br)NCc2cnc[nH]2 207a_100000760356_100000742939 [0,2,0,0,0,0|0,0,2]=4 11370 B16R2.1063 Fc1ccc(cc1Br)NCc2cncs2 207a_100000760356_100000749870 [0,2,0,0,0,0|1,0,1]=4 11371 B16R2.1063 Fc1ccc(cc1Br)NCc2cncs2 2230a_100000760356_100015185245 [0,2,0,0,0,0|1,0,1]=4 11372 B16R2.1063 Fc1ccc(cc1Br)NCc2cncs2 270302a_100000760356_100000749870 [0,2,0,0,0,0|1,0,1]=4 11373 B16R2.1063 Fc1ccc(cc1Br)NCc2cncs2 34a_100000760356_100015185245 [0,2,0,0,0,0|1,0,1]=4 11374 B16R2.1063 Fc1ccc(cc1Br)NCc2cncs2 7a_100000760356_100015185245 [0,2,0,0,0,0|1,0,1]=4 11375 B16R2.1063 Fc1ccc(cc1Br)NCc2cscn2 207a_100000760356_100000743575 [0,2,0,0,0,0|1,0,0]=3 11376 B16R2.1063 Fc1ccc(cc1Br)NCc2cscn2 2230a_100000760356_100000205941 [0,2,0,0,0,0|1,0,0]=3 11377 B16R2.1063 Fc1ccc(cc1Br)NCc2cscn2 270302a_100000760356_100000743575 [0,2,0,0,0,0|1,0,0]=3 11378 B16R2.1063 Fc1ccc(cc1Br)NCc2cscn2 34a_100000760356_100000205941 [0,2,0,0,0,0|1,0,0]=3 11379 B16R2.1063 Fc1ccc(cc1Br)NCc2cscn2 7a_100000760356_100000205941 [0,2,0,0,0,0|1,0,0]=3 11380 B16R2.1063 Fc1ccc(cc1Br)NCc2ncc[nH]2 207a_100000760356_100000743867 [0,2,0,0,0,0|2,0,0]=4 11381 B16R2.1063 Fc1ccc(cc1Br)NCc2ncc[nH]2 2230a_100000760356_100016991755 [0,2,0,0,0,0|2,0,0]=4 11382 B16R2.1063 Fc1ccc(cc1Br)NCc2ncc[nH]2 34a_100000760356_100016991755 [0,2,0,0,0,0|2,0,0]=4 11383 B16R2.1063 Fc1ccc(cc1Br)NCc2ncc[nH]2 7a_100000760356_100000753453 [0,2,0,0,0,0|2,0,0]=4 11384 B16R2.1063 Fc1ccc(cc1Br)NCc2ncco2 2230a_100000760356_103436540062 [0,2,0,0,0,0|2,0,0]=4 11385 B16R2.1063 Fc1ccc(cc1Br)NCc2ncco2 34a_100000760356_103436540062 [0,2,0,0,0,0|2,0,0]=4 11386 B16R2.1063 Fc1ccc(cc1Br)NCc2ncco2 7a_100000760356_103436540062 [0,2,0,0,0,0|2,0,0]=4 11387 B16R2.1063 Fc1ccc(cc1Br)NCc2nccs2 207a_100000760356_100000750902 [0,2,0,0,0,0|2,0,0]=4 11388 B16R2.1063 Fc1ccc(cc1Br)NCc2nccs2 2230a_100000760356_100015184050 [0,2,0,0,0,0|2,0,0]=4 11389 B16R2.1063 Fc1ccc(cc1Br)NCc2nccs2 270302a_100000760356_100000750902 [0,2,0,0,0,0|2,0,0]=4 11390 B16R2.1063 Fc1ccc(cc1Br)NCc2nccs2 34a_100000760356_100015184050 [0,2,0,0,0,0|2,0,0]=4 11391 B16R2.1063 Fc1ccc(cc1Br)NCc2nccs2 7a_100000760356_100015184050 [0,2,0,0,0,0|2,0,0]=4 11392 B16R2.1063 Fc1ccc(cc1Br)NCc2ncon2 34a_100000760356_100000233494 [0,2,0,0,0,0|2,0,0]=4 11393 B16R2.1063 Fc1ccc(cc1Br)NCn2cncn2 2230a_100000760356_200020645497 [0,2,0,0,0,0|1,0,1]=4 11394 B16R2.1063 Fc1ccc(cc1Br)NCn2cncn2 34a_100000760356_200020645497 [0,2,0,0,0,0|1,0,1]=4 11395 B16R2.1063 Fc1ccc(cc1Br)NCn2cncn2 7a_100000760356_200020645497 [0,2,0,0,0,0|1,0,1]=4 11396 B16R2.1063 Fc1ccc(cc1Br)OCc2c[nH]cn2 34a_100000693481_100000707719 [0,2,0,0,0,0|1,0,0]=3 11397 B16R2.1063 Fc1ccc(cc1Br)OCc2cscn2 34a_100000693481_100000205941 [0,2,0,0,0,0|2,0,0]=4 11398 B16R2.1063 Fc1ccc(cc1Br)OCc2cscn2 7a_100000693481_100000205941 [0,2,0,0,0,0|2,0,0]=4 11399 B16R2.1063 Fc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100012047266 [0,2,0,0,0,0|1,0,0]=3 11400 B16R2.1063 Fc1ccc(cc1Br)SCc2c[nH]cn2 62a_100012047266_100000707719 [0,2,0,0,0,0|1,0,0]=3 11401 B16R2.1063 Fc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100012047266 [0,2,0,0,0,0|2,0,0]=4 11402 B16R2.1063 Fc1ccc(cc1Br)SCc2cscn2 62a_100012047266_100000205941 [0,2,0,0,0,0|2,0,0]=4 11403 B16R2.1063 Fc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100000717365_100000756875 [0,2,0,0,0,0|2,0,0]=4 11404 B16R2.1063 Fc1ccc(cc1Cl)CSc2c[nH]cn2 62a_100000756875_100011934319 [0,2,0,0,0,0|2,0,0]=4 11405 B16R2.1063 Fc1ccc(cc1Cl)NCc2c[nH]cn2 2230a_100000211060_100000707719 [0,2,0,0,0,0|0,0,0]=2 11406 B16R2.1063 Fc1ccc(cc1Cl)NCc2c[nH]cn2 34a_100000211060_100000707719 [0,2,0,0,0,0|0,0,0]=2 11407 B16R2.1063 Fc1ccc(cc1Cl)NCc2cc[nH]n2 207a_100000211060_100000738523 [0,2,0,0,0,0|2,0,0]=4 11408 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccco2 207a_100000211060_100000186105 [0,2,0,0,0,0|2,0,0]=4 11409 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccco2 270302a_100000211060_100000186105 [0,2,0,0,0,0|2,0,0]=4 11410 B16R2.1063 Fc1ccc(cc1Cl)NCc2cccs2 207a_100000211060_100000209959 [0,2,0,0,0,0|2,0,0]=4 11411 B16R2.1063 Fc1ccc(cc1Cl)NCc2cccs2 270302a_100000211060_100000209959 [0,2,0,0,0,0|2,0,0]=4 11412 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccoc2 207a_100000211060_100011215517 [0,2,0,0,0,0|2,0,0]=4 11413 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccon2 2230a_100000211060_100000234950 [0,2,0,0,0,0|2,0,0]=4 11414 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccon2 34a_100000211060_100000234950 [0,2,0,0,0,0|2,0,0]=4 11415 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccon2 7a_100000211060_100000234950 [0,2,0,0,0,0|2,0,0]=4 11416 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccsc2 207a_100000211060_100000188534 [0,2,0,0,0,0|2,0,0]=4 11417 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccsc2 2230a_100000211060_100011261437 [0,2,0,0,0,0|2,0,0]=4 11418 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccsc2 270302a_100000211060_100000188534 [0,2,0,0,0,0|2,0,0]=4 11419 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccsc2 34a_100000211060_100011261437 [0,2,0,0,0,0|2,0,0]=4 11420 B16R2.1063 Fc1ccc(cc1Cl)NCc2ccsc2 7a_100000211060_100011261437 [0,2,0,0,0,0|2,0,0]=4 11421 B16R2.1063 Fc1ccc(cc1Cl)NCc2cn[nH]c2 207a_100000211060_100016992096 [0,2,0,0,0,0|2,0,0]=4 11422 B16R2.1063 Fc1ccc(cc1Cl)NCc2cn[nH]c2 270302a_100000211060_100016992096 [0,2,0,0,0,0|2,0,0]=4 11423 B16R2.1063 Fc1ccc(cc1Cl)NCc2cnc[nH]2 207a_100000211060_100000742939 [0,2,0,0,0,0|0,0,2]=4 11424 B16R2.1063 Fc1ccc(cc1Cl)NCc2cncs2 207a_100000211060_100000749870 [0,2,0,0,0,0|1,0,1]=4 11425 B16R2.1063 Fc1ccc(cc1Cl)NCc2cncs2 2230a_100000211060_100015185245 [0,2,0,0,0,0|1,0,1]=4 11426 B16R2.1063 Fc1ccc(cc1Cl)NCc2cncs2 270302a_100000211060_100000749870 [0,2,0,0,0,0|1,0,1]=4 11427 B16R2.1063 Fc1ccc(cc1Cl)NCc2cncs2 34a_100000211060_100015185245 [0,2,0,0,0,0|1,0,1]=4 11428 B16R2.1063 Fc1ccc(cc1Cl)NCc2cncs2 7a_100000211060_100015185245 [0,2,0,0,0,0|1,0,1]=4 11429 B16R2.1063 Fc1ccc(cc1Cl)NCc2cscn2 207a_100000211060_100000743575 [0,2,0,0,0,0|1,0,0]=3 11430 B16R2.1063 Fc1ccc(cc1Cl)NCc2cscn2 2230a_100000211060_100000205941 [0,2,0,0,0,0|1,0,0]=3 11431 B16R2.1063 Fc1ccc(cc1Cl)NCc2cscn2 270302a_100000211060_100000743575 [0,2,0,0,0,0|1,0,0]=3 11432 B16R2.1063 Fc1ccc(cc1Cl)NCc2cscn2 34a_100000211060_100000205941 [0,2,0,0,0,0|1,0,0]=3 11433 B16R2.1063 Fc1ccc(cc1Cl)NCc2cscn2 7a_100000211060_100000205941 [0,2,0,0,0,0|1,0,0]=3 11434 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncc[nH]2 207a_100000211060_100000743867 [0,2,0,0,0,0|2,0,0]=4 11435 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncc[nH]2 2230a_100000211060_100016991755 [0,2,0,0,0,0|2,0,0]=4 11436 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncc[nH]2 34a_100000211060_100016991755 [0,2,0,0,0,0|2,0,0]=4 11437 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncc[nH]2 7a_100000211060_100000753453 [0,2,0,0,0,0|2,0,0]=4 11438 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncco2 2230a_100000211060_103436540062 [0,2,0,0,0,0|2,0,0]=4 11439 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncco2 34a_100000211060_103436540062 [0,2,0,0,0,0|2,0,0]=4 11440 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncco2 7a_100000211060_103436540062 [0,2,0,0,0,0|2,0,0]=4 11441 B16R2.1063 Fc1ccc(cc1Cl)NCc2nccs2 207a_100000211060_100000750902 [0,2,0,0,0,0|2,0,0]=4 11442 B16R2.1063 Fc1ccc(cc1Cl)NCc2nccs2 2230a_100000211060_100015184050 [0,2,0,0,0,0|2,0,0]=4 11443 B16R2.1063 Fc1ccc(cc1Cl)NCc2nccs2 270302a_100000211060_100000750902 [0,2,0,0,0,0|2,0,0]=4 11444 B16R2.1063 Fc1ccc(cc1Cl)NCc2nccs2 34a_100000211060_100015184050 [0,2,0,0,0,0|2,0,0]=4 11445 B16R2.1063 Fc1ccc(cc1Cl)NCc2nccs2 7a_100000211060_100015184050 [0,2,0,0,0,0|2,0,0]=4 11446 B16R2.1063 Fc1ccc(cc1Cl)NCc2ncon2 34a_100000211060_100000233494 [0,2,0,0,0,0|2,0,0]=4 11447 B16R2.1063 Fc1ccc(cc1Cl)NCn2cncn2 2230a_100000211060_200020645497 [0,2,0,0,0,0|1,0,1]=4 11448 B16R2.1063 Fc1ccc(cc1Cl)NCn2cncn2 34a_100000211060_200020645497 [0,2,0,0,0,0|1,0,1]=4 11449 B16R2.1063 Fc1ccc(cc1Cl)NCn2cncn2 7a_100000211060_200020645497 [0,2,0,0,0,0|1,0,1]=4 11450 B16R2.1063 Fc1ccc(cc1Cl)OCc2c[nH]cn2 34a_100000211030_100000707719 [0,2,0,0,0,0|1,0,0]=3 11451 B16R2.1063 Fc1ccc(cc1Cl)OCc2cscn2 34a_100000211030_100000205941 [0,2,0,0,0,0|2,0,0]=4 11452 B16R2.1063 Fc1ccc(cc1Cl)OCc2cscn2 7a_100000211030_100000205941 [0,2,0,0,0,0|2,0,0]=4 11453 B16R2.1063 Fc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100011215976 [0,2,0,0,0,0|1,0,0]=3 11454 B16R2.1063 Fc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100011215976_100000707719 [0,2,0,0,0,0|1,0,0]=3 11455 B16R2.1063 Fc1ccc(cc1Cl)SCc2cscn2 62a_100000205941_100011215976 [0,2,0,0,0,0|2,0,0]=4 11456 B16R2.1063 Fc1ccc(cc1Cl)SCc2cscn2 62a_100011215976_100000205941 [0,2,0,0,0,0|2,0,0]=4 11457 B16R2.1063 Fc1ccc(cc1F)CSc2c[nH]cn2 62a_100000756875_100000757363 [0,2,0,0,0,0|2,0,0]=4 11458 B16R2.1063 Fc1ccc(cc1F)CSc2c[nH]cn2 62a_100000757363_100000756875 [0,2,0,0,0,0|2,0,0]=4 11459 B16R2.1063 Fc1ccc(cc1F)NCc2c[nH]cn2 2230a_100000210724_100000707719 [0,2,0,0,0,0|0,0,0]=2 11460 B16R2.1063 Fc1ccc(cc1F)NCc2c[nH]cn2 34a_100000210724_100000707719 [0,2,0,0,0,0|0,0,0]=2 11461 B16R2.1063 Fc1ccc(cc1F)NCc2cc[nH]n2 207a_100000210724_100000738523 [0,2,0,0,0,0|2,0,0]=4 11462 B16R2.1063 Fc1ccc(cc1F)NCc2ccco2 207a_100000210724_100000186105 [0,2,0,0,0,0|2,0,0]=4 11463 B16R2.1063 Fc1ccc(cc1F)NCc2ccco2 270302a_100000210724_100000186105 [0,2,0,0,0,0|2,0,0]=4 11464 B16R2.1063 Fc1ccc(cc1F)NCc2cccs2 207a_100000210724_100000209959 [0,2,0,0,0,0|2,0,0]=4 11465 B16R2.1063 Fc1ccc(cc1F)NCc2cccs2 270302a_100000210724_100000209959 [0,2,0,0,0,0|2,0,0]=4 11466 B16R2.1063 Fc1ccc(cc1F)NCc2ccoc2 207a_100000210724_100011215517 [0,2,0,0,0,0|2,0,0]=4 11467 B16R2.1063 Fc1ccc(cc1F)NCc2ccon2 2230a_100000210724_100000234950 [0,2,0,0,0,0|2,0,0]=4 11468 B16R2.1063 Fc1ccc(cc1F)NCc2ccon2 34a_100000210724_100000234950 [0,2,0,0,0,0|2,0,0]=4 11469 B16R2.1063 Fc1ccc(cc1F)NCc2ccon2 7a_100000210724_100000234950 [0,2,0,0,0,0|2,0,0]=4 11470 B16R2.1063 Fc1ccc(cc1F)NCc2ccsc2 207a_100000210724_100000188534 [0,2,0,0,0,0|2,0,0]=4 11471 B16R2.1063 Fc1ccc(cc1F)NCc2ccsc2 2230a_100000210724_100011261437 [0,2,0,0,0,0|2,0,0]=4 11472 B16R2.1063 Fc1ccc(cc1F)NCc2ccsc2 270302a_100000210724_100000188534 [0,2,0,0,0,0|2,0,0]=4 11473 B16R2.1063 Fc1ccc(cc1F)NCc2ccsc2 34a_100000210724_100011261437 [0,2,0,0,0,0|2,0,0]=4 11474 B16R2.1063 Fc1ccc(cc1F)NCc2ccsc2 7a_100000210724_100011261437 [0,2,0,0,0,0|2,0,0]=4 11475 B16R2.1063 Fc1ccc(cc1F)NCc2cn[nH]c2 207a_100000210724_100016992096 [0,2,0,0,0,0|2,0,0]=4 11476 B16R2.1063 Fc1ccc(cc1F)NCc2cn[nH]c2 270302a_100000210724_100016992096 [0,2,0,0,0,0|2,0,0]=4 11477 B16R2.1063 Fc1ccc(cc1F)NCc2cnc[nH]2 207a_100000210724_100000742939 [0,2,0,0,0,0|0,0,2]=4 11478 B16R2.1063 Fc1ccc(cc1F)NCc2cncs2 207a_100000210724_100000749870 [0,2,0,0,0,0|1,0,1]=4 11479 B16R2.1063 Fc1ccc(cc1F)NCc2cncs2 2230a_100000210724_100015185245 [0,2,0,0,0,0|1,0,1]=4 11480 B16R2.1063 Fc1ccc(cc1F)NCc2cncs2 270302a_100000210724_100000749870 [0,2,0,0,0,0|1,0,1]=4 11481 B16R2.1063 Fc1ccc(cc1F)NCc2cncs2 34a_100000210724_100015185245 [0,2,0,0,0,0|1,0,1]=4 11482 B16R2.1063 Fc1ccc(cc1F)NCc2cncs2 7a_100000210724_100015185245 [0,2,0,0,0,0|1,0,1]=4 11483 B16R2.1063 Fc1ccc(cc1F)NCc2cscn2 207a_100000210724_100000743575 [0,2,0,0,0,0|1,0,0]=3 11484 B16R2.1063 Fc1ccc(cc1F)NCc2cscn2 2230a_100000210724_100000205941 [0,2,0,0,0,0|1,0,0]=3 11485 B16R2.1063 Fc1ccc(cc1F)NCc2cscn2 270302a_100000210724_100000743575 [0,2,0,0,0,0|1,0,0]=3 11486 B16R2.1063 Fc1ccc(cc1F)NCc2cscn2 34a_100000210724_100000205941 [0,2,0,0,0,0|1,0,0]=3 11487 B16R2.1063 Fc1ccc(cc1F)NCc2cscn2 7a_100000210724_100000205941 [0,2,0,0,0,0|1,0,0]=3 11488 B16R2.1063 Fc1ccc(cc1F)NCc2ncc[nH]2 207a_100000210724_100000743867 [0,2,0,0,0,0|2,0,0]=4 11489 B16R2.1063 Fc1ccc(cc1F)NCc2ncc[nH]2 2230a_100000210724_100016991755 [0,2,0,0,0,0|2,0,0]=4 11490 B16R2.1063 Fc1ccc(cc1F)NCc2ncc[nH]2 34a_100000210724_100016991755 [0,2,0,0,0,0|2,0,0]=4 11491 B16R2.1063 Fc1ccc(cc1F)NCc2ncc[nH]2 7a_100000210724_100000753453 [0,2,0,0,0,0|2,0,0]=4 11492 B16R2.1063 Fc1ccc(cc1F)NCc2ncco2 2230a_100000210724_103436540062 [0,2,0,0,0,0|2,0,0]=4 11493 B16R2.1063 Fc1ccc(cc1F)NCc2ncco2 34a_100000210724_103436540062 [0,2,0,0,0,0|2,0,0]=4 11494 B16R2.1063 Fc1ccc(cc1F)NCc2ncco2 7a_100000210724_103436540062 [0,2,0,0,0,0|2,0,0]=4 11495 B16R2.1063 Fc1ccc(cc1F)NCc2nccs2 207a_100000210724_100000750902 [0,2,0,0,0,0|2,0,0]=4 11496 B16R2.1063 Fc1ccc(cc1F)NCc2nccs2 2230a_100000210724_100015184050 [0,2,0,0,0,0|2,0,0]=4 11497 B16R2.1063 Fc1ccc(cc1F)NCc2nccs2 270302a_100000210724_100000750902 [0,2,0,0,0,0|2,0,0]=4 11498 B16R2.1063 Fc1ccc(cc1F)NCc2nccs2 34a_100000210724_100015184050 [0,2,0,0,0,0|2,0,0]=4 11499 B16R2.1063 Fc1ccc(cc1F)NCc2nccs2 7a_100000210724_100015184050 [0,2,0,0,0,0|2,0,0]=4 11500 B16R2.1063 Fc1ccc(cc1F)NCc2ncon2 34a_100000210724_100000233494 [0,2,0,0,0,0|2,0,0]=4 11501 B16R2.1063 Fc1ccc(cc1F)NCn2cncn2 2230a_100000210724_200020645497 [0,2,0,0,0,0|1,0,1]=4 11502 B16R2.1063 Fc1ccc(cc1F)NCn2cncn2 34a_100000210724_200020645497 [0,2,0,0,0,0|1,0,1]=4 11503 B16R2.1063 Fc1ccc(cc1F)NCn2cncn2 7a_100000210724_200020645497 [0,2,0,0,0,0|1,0,1]=4 11504 B16R2.1063 Fc1ccc(cc1F)OCc2c[nH]cn2 34a_100000181275_100000707719 [0,2,0,0,0,0|1,0,0]=3 11505 B16R2.1063 Fc1ccc(cc1F)OCc2cscn2 34a_100000181275_100000205941 [0,2,0,0,0,0|2,0,0]=4 11506 B16R2.1063 Fc1ccc(cc1F)OCc2cscn2 7a_100000181275_100000205941 [0,2,0,0,0,0|2,0,0]=4 11507 B16R2.1063 Fc1ccc(cc1F)SCc2c[nH]cn2 62a_100000703953_100000707719 [0,2,0,0,0,0|1,0,0]=3 11508 B16R2.1063 Fc1ccc(cc1F)SCc2c[nH]cn2 62a_100000707719_100000703953 [0,2,0,0,0,0|1,0,0]=3 11509 B16R2.1063 Fc1ccc(cc1F)SCc2cscn2 62a_100000205941_100000703953 [0,2,0,0,0,0|2,0,0]=4 11510 B16R2.1063 Fc1ccc(cc1F)SCc2cscn2 62a_100000703953_100000205941 [0,2,0,0,0,0|2,0,0]=4 11511 B16R2.1063 Fc1ccc(cc1I)CSc2c[nH]cn2 62a_100000756875_100010188208 [0,2,0,0,0,0|2,0,0]=4 11512 B16R2.1063 Fc1ccc(cc1I)CSc2c[nH]cn2 62a_100010188208_100000756875 [0,2,0,0,0,0|2,0,0]=4 11513 B16R2.1063 Fc1ccc(cc1I)NCc2c[nH]cn2 34a_114828291077_100000707719 [0,2,0,0,0,0|0,0,0]=2 11514 B16R2.1063 Fc1ccc(cc1I)NCc2cc[nH]n2 207a_114828291077_100000738523 [0,2,0,0,0,0|2,0,0]=4 11515 B16R2.1063 Fc1ccc(cc1I)NCc2ccco2 207a_114828291077_100000186105 [0,2,0,0,0,0|2,0,0]=4 11516 B16R2.1063 Fc1ccc(cc1I)NCc2ccco2 270302a_114828291077_100000186105 [0,2,0,0,0,0|2,0,0]=4 11517 B16R2.1063 Fc1ccc(cc1I)NCc2cccs2 207a_114828291077_100000209959 [0,2,0,0,0,0|2,0,0]=4 11518 B16R2.1063 Fc1ccc(cc1I)NCc2cccs2 270302a_114828291077_100000209959 [0,2,0,0,0,0|2,0,0]=4 11519 B16R2.1063 Fc1ccc(cc1I)NCc2ccoc2 207a_114828291077_100011215517 [0,2,0,0,0,0|2,0,0]=4 11520 B16R2.1063 Fc1ccc(cc1I)NCc2ccon2 34a_114828291077_100000234950 [0,2,0,0,0,0|2,0,0]=4 11521 B16R2.1063 Fc1ccc(cc1I)NCc2ccon2 7a_114828291077_100000234950 [0,2,0,0,0,0|2,0,0]=4 11522 B16R2.1063 Fc1ccc(cc1I)NCc2ccsc2 207a_114828291077_100000188534 [0,2,0,0,0,0|2,0,0]=4 11523 B16R2.1063 Fc1ccc(cc1I)NCc2ccsc2 270302a_114828291077_100000188534 [0,2,0,0,0,0|2,0,0]=4 11524 B16R2.1063 Fc1ccc(cc1I)NCc2ccsc2 34a_114828291077_100011261437 [0,2,0,0,0,0|2,0,0]=4 11525 B16R2.1063 Fc1ccc(cc1I)NCc2ccsc2 7a_114828291077_100011261437 [0,2,0,0,0,0|2,0,0]=4 11526 B16R2.1063 Fc1ccc(cc1I)NCc2cn[nH]c2 207a_114828291077_100016992096 [0,2,0,0,0,0|2,0,0]=4 11527 B16R2.1063 Fc1ccc(cc1I)NCc2cn[nH]c2 270302a_114828291077_100016992096 [0,2,0,0,0,0|2,0,0]=4 11528 B16R2.1063 Fc1ccc(cc1I)NCc2cnc[nH]2 207a_114828291077_100000742939 [0,2,0,0,0,0|0,0,2]=4 11529 B16R2.1063 Fc1ccc(cc1I)NCc2cncs2 207a_114828291077_100000749870 [0,2,0,0,0,0|1,0,1]=4 11530 B16R2.1063 Fc1ccc(cc1I)NCc2cncs2 270302a_114828291077_100000749870 [0,2,0,0,0,0|1,0,1]=4 11531 B16R2.1063 Fc1ccc(cc1I)NCc2cncs2 34a_114828291077_100015185245 [0,2,0,0,0,0|1,0,1]=4 11532 B16R2.1063 Fc1ccc(cc1I)NCc2cncs2 7a_114828291077_100015185245 [0,2,0,0,0,0|1,0,1]=4 11533 B16R2.1063 Fc1ccc(cc1I)NCc2cscn2 207a_114828291077_100000743575 [0,2,0,0,0,0|1,0,0]=3 11534 B16R2.1063 Fc1ccc(cc1I)NCc2cscn2 270302a_114828291077_100000743575 [0,2,0,0,0,0|1,0,0]=3 11535 B16R2.1063 Fc1ccc(cc1I)NCc2cscn2 34a_114828291077_100000205941 [0,2,0,0,0,0|1,0,0]=3 11536 B16R2.1063 Fc1ccc(cc1I)NCc2cscn2 7a_114828291077_100000205941 [0,2,0,0,0,0|1,0,0]=3 11537 B16R2.1063 Fc1ccc(cc1I)NCc2ncc[nH]2 207a_114828291077_100000743867 [0,2,0,0,0,0|2,0,0]=4 11538 B16R2.1063 Fc1ccc(cc1I)NCc2ncc[nH]2 34a_114828291077_100016991755 [0,2,0,0,0,0|2,0,0]=4 11539 B16R2.1063 Fc1ccc(cc1I)NCc2ncc[nH]2 7a_114828291077_100000753453 [0,2,0,0,0,0|2,0,0]=4 11540 B16R2.1063 Fc1ccc(cc1I)NCc2ncco2 34a_114828291077_103436540062 [0,2,0,0,0,0|2,0,0]=4 11541 B16R2.1063 Fc1ccc(cc1I)NCc2ncco2 7a_114828291077_103436540062 [0,2,0,0,0,0|2,0,0]=4 11542 B16R2.1063 Fc1ccc(cc1I)NCc2nccs2 207a_114828291077_100000750902 [0,2,0,0,0,0|2,0,0]=4 11543 B16R2.1063 Fc1ccc(cc1I)NCc2nccs2 270302a_114828291077_100000750902 [0,2,0,0,0,0|2,0,0]=4 11544 B16R2.1063 Fc1ccc(cc1I)NCc2nccs2 34a_114828291077_100015184050 [0,2,0,0,0,0|2,0,0]=4 11545 B16R2.1063 Fc1ccc(cc1I)NCc2nccs2 7a_114828291077_100015184050 [0,2,0,0,0,0|2,0,0]=4 11546 B16R2.1063 Fc1ccc(cc1I)NCc2ncon2 34a_114828291077_100000233494 [0,2,0,0,0,0|2,0,0]=4 11547 B16R2.1063 Fc1ccc(cc1I)NCn2cncn2 34a_114828291077_200020645497 [0,2,0,0,0,0|1,0,1]=4 11548 B16R2.1063 Fc1ccc(cc1I)NCn2cncn2 7a_114828291077_200020645497 [0,2,0,0,0,0|1,0,1]=4 11549 B16R2.1063 Fc1nc(ccc1Br)NCc2c[nH]cn2 27a_100000758547_100010134343 [0,2,0,0,0,0|1,0,0]=3 11550 B16R2.1063 Fc1nc(ccc1Br)NCc2c[nH]nn2 27a_100020620823_100010134343 [0,2,0,0,0,0|2,0,0]=4 11551 B16R2.1063 Fc1nc(ccc1Br)NCc2cocn2 27a_100015188801_100010134343 [0,2,0,0,0,0|2,0,0]=4 11552 B16R2.1063 Fc1nc(ccc1Br)NCc2cscn2 27a_100015185402_100010134343 [0,2,0,0,0,0|2,0,0]=4 11553 B16R2.1063 Fc1nc(ccc1Br)OCc2c[nH]cn2 34a_100009879308_100000707719 [0,2,0,0,0,0|2,0,0]=4 11554 B16R2.1063 Fc1nc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100010134343 [0,2,0,0,0,0|2,0,0]=4 11555 B16R2.1063 Fc1nc(ccc1Br)SCc2c[nH]cn2 62a_100010134343_100000707719 [0,2,0,0,0,0|2,0,0]=4 11556 B16R2.1063 Fc1ncc(cc1Br)OCc2c[nH]cn2 34a_100009817267_100000707719 [0,2,0,0,0,0|2,0,0]=4 11557 B16R2.1063 Fc1ncc(cc1Cl)OCc2c[nH]cn2 34a_100000087088_100000707719 [0,2,0,0,0,0|2,0,0]=4 11558 B16R2.1063 Nc1cc(ccc1Br)OCc2c[nH]cn2 34a_100011999798_100000707719 [0,2,0,0,0,0|1,0,0]=3 11559 B16R2.1063 Nc1cc(ccc1Br)OCc2cscn2 34a_100011999798_100000205941 [0,2,0,0,0,0|2,0,0]=4 11560 B16R2.1063 Nc1cc(ccc1Br)OCc2cscn2 7a_100011999798_100000205941 [0,2,0,0,0,0|2,0,0]=4 11561 B16R2.1063 Nc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100000750456 [0,2,0,0,0,0|1,0,0]=3 11562 B16R2.1063 Nc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000750456_100000707719 [0,2,0,0,0,0|1,0,0]=3 11563 B16R2.1063 Nc1cc(ccc1Br)SCc2cscn2 62a_100000205941_100000750456 [0,2,0,0,0,0|2,0,0]=4 11564 B16R2.1063 Nc1cc(ccc1Br)SCc2cscn2 62a_100000750456_100000205941 [0,2,0,0,0,0|2,0,0]=4 11565 B16R2.1063 Nc1cc(ccc1Cl)OCc2c[nH]cn2 34a_100011934297_100000707719 [0,2,0,0,0,0|1,0,0]=3 11566 B16R2.1063 Nc1cc(ccc1Cl)OCc2cscn2 34a_100011934297_100000205941 [0,2,0,0,0,0|2,0,0]=4 11567 B16R2.1063 Nc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100000707719_200000761891 [0,2,0,0,0,0|1,0,0]=3 11568 B16R2.1063 Nc1cc(ccc1Cl)SCc2c[nH]cn2 62a_200000761891_100000707719 [0,2,0,0,0,0|1,0,0]=3 11569 B16R2.1063 Nc1cc(ccc1Cl)SCc2cscn2 62a_100000205941_200000761891 [0,2,0,0,0,0|2,0,0]=4 11570 B16R2.1063 Nc1cc(ccc1Cl)SCc2cscn2 62a_200000761891_100000205941 [0,2,0,0,0,0|2,0,0]=4 11571 B16R2.1063 Nc1cc(ccc1F)OCc2c[nH]cn2 34a_100012017239_100000707719 [0,2,0,0,0,0|1,0,0]=3 11572 B16R2.1063 Nc1cc(ccc1F)OCc2cscn2 34a_100012017239_100000205941 [0,2,0,0,0,0|2,0,0]=4 11573 B16R2.1063 Nc1cc(ccc1F)OCc2cscn2 7a_100012017239_100000205941 [0,2,0,0,0,0|2,0,0]=4 11574 B16R2.1063 Nc1cc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100000740924 [0,2,0,0,0,0|1,0,0]=3 11575 B16R2.1063 Nc1cc(ccc1F)SCc2c[nH]cn2 62a_100000740924_100000707719 [0,2,0,0,0,0|1,0,0]=3 11576 B16R2.1063 Nc1cc(ccc1F)SCc2cscn2 62a_100000205941_100000740924 [0,2,0,0,0,0|2,0,0]=4 11577 B16R2.1063 Nc1cc(ccc1F)SCc2cscn2 62a_100000740924_100000205941 [0,2,0,0,0,0|2,0,0]=4 11578 B16R2.1063 Nc1cc(ccc1O)SCc2c[nH]cn2 62a_100000707719_100000752626 [0,2,0,0,0,0|1,0,0]=3 11579 B16R2.1063 Nc1cc(ccc1O)SCc2c[nH]cn2 62a_100000752626_100000707719 [0,2,0,0,0,0|1,0,0]=3 11580 B16R2.1063 Nc1cc(ccc1O)SCc2cscn2 62a_100000205941_100000752626 [0,2,0,0,0,0|2,0,0]=4 11581 B16R2.1063 Nc1cc(ccc1O)SCc2cscn2 62a_100000752626_100000205941 [0,2,0,0,0,0|2,0,0]=4 11582 B16R2.1063 Nc1cc(cnc1Cl)SCc2c[nH]cn2 62a_100000707719_100009828400 [0,2,0,0,0,0|2,0,0]=4 11583 B16R2.1063 Nc1cc(cnc1Cl)SCc2c[nH]cn2 62a_100009828400_100000707719 [0,2,0,0,0,0|2,0,0]=4 11584 B16R2.1063 Nc1cc(cnc1F)SCc2c[nH]cn2 62a_100000707719_100009816798 [0,2,0,0,0,0|2,0,0]=4 11585 B16R2.1063 Nc1cc(cnc1F)SCc2c[nH]cn2 62a_100009816798_100000707719 [0,2,0,0,0,0|2,0,0]=4 11586 B16R2.1063 Nc1cc(cnc1N)SCc2c[nH]cn2 62a_100000184470_100000707719 [0,2,0,0,0,0|2,0,0]=4 11587 B16R2.1063 Nc1cc(cnc1N)SCc2c[nH]cn2 62a_100000707719_100000184470 [0,2,0,0,0,0|2,0,0]=4 11588 B16R2.1063 Nc1cc(cnc1O)SCc2c[nH]cn2 62a_100000707719_100000743729 [0,2,0,0,0,0|2,0,0]=4 11589 B16R2.1063 Nc1cc(cnc1O)SCc2c[nH]cn2 62a_100000743729_100000707719 [0,2,0,0,0,0|2,0,0]=4 11590 B16R2.1063 Nc1cc(ncc1F)SCc2c[nH]cn2 62a_100000126464_100000707719 [0,2,0,0,0,0|2,0,0]=4 11591 B16R2.1063 Nc1cc(ncc1F)SCc2c[nH]cn2 62a_100000707719_100000126464 [0,2,0,0,0,0|2,0,0]=4 11592 B16R2.1063 Nc1cc(ncc1O)SCc2c[nH]cn2 62a_100000707719_100009819941 [0,2,0,0,0,0|2,0,0]=4 11593 B16R2.1063 Nc1cc(ncc1O)SCc2c[nH]cn2 62a_100009819941_100000707719 [0,2,0,0,0,0|2,0,0]=4 11594 B16R2.1063 Nc1ccc(cc1Br)OCc2c[nH]cn2 34a_100012001276_100000707719 [0,2,0,0,0,0|1,0,0]=3 11595 B16R2.1063 Nc1ccc(cc1Br)OCc2cscn2 34a_100012001276_100000205941 [0,2,0,0,0,0|2,0,0]=4 11596 B16R2.1063 Nc1ccc(cc1Br)OCc2cscn2 7a_100012001276_100000205941 [0,2,0,0,0,0|2,0,0]=4 11597 B16R2.1063 Nc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100000750455 [0,2,0,0,0,0|1,0,0]=3 11598 B16R2.1063 Nc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000750455_100000707719 [0,2,0,0,0,0|1,0,0]=3 11599 B16R2.1063 Nc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100000750455 [0,2,0,0,0,0|2,0,0]=4 11600 B16R2.1063 Nc1ccc(cc1Br)SCc2cscn2 62a_100000750455_100000205941 [0,2,0,0,0,0|2,0,0]=4 11601 B16R2.1063 Nc1ccc(cc1Cl)OCc2c[nH]cn2 34a_100011215599_100000707719 [0,2,0,0,0,0|1,0,0]=3 11602 B16R2.1063 Nc1ccc(cc1Cl)OCc2cscn2 34a_100011215599_100000205941 [0,2,0,0,0,0|2,0,0]=4 11603 B16R2.1063 Nc1ccc(cc1Cl)OCc2cscn2 7a_100011215599_100000205941 [0,2,0,0,0,0|2,0,0]=4 11604 B16R2.1063 Nc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100011218065 [0,2,0,0,0,0|1,0,0]=3 11605 B16R2.1063 Nc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100011218065_100000707719 [0,2,0,0,0,0|1,0,0]=3 11606 B16R2.1063 Nc1ccc(cc1Cl)SCc2cscn2 62a_100000205941_100011218065 [0,2,0,0,0,0|2,0,0]=4 11607 B16R2.1063 Nc1ccc(cc1Cl)SCc2cscn2 62a_100011218065_100000205941 [0,2,0,0,0,0|2,0,0]=4 11608 B16R2.1063 Nc1ccc(cc1F)OCc2c[nH]cn2 34a_100000759473_100000707719 [0,2,0,0,0,0|1,0,0]=3 11609 B16R2.1063 Nc1ccc(cc1F)OCc2cscn2 34a_100000759473_100000205941 [0,2,0,0,0,0|2,0,0]=4 11610 B16R2.1063 Nc1ccc(cc1F)OCc2cscn2 7a_100000759473_100000205941 [0,2,0,0,0,0|2,0,0]=4 11611 B16R2.1063 Nc1ccc(cc1F)SCc2c[nH]cn2 62a_100000707719_100011215594 [0,2,0,0,0,0|1,0,0]=3 11612 B16R2.1063 Nc1ccc(cc1F)SCc2c[nH]cn2 62a_100011215594_100000707719 [0,2,0,0,0,0|1,0,0]=3 11613 B16R2.1063 Nc1ccc(cc1F)SCc2cscn2 62a_100000205941_100011215594 [0,2,0,0,0,0|2,0,0]=4 11614 B16R2.1063 Nc1ccc(cc1F)SCc2cscn2 62a_100011215594_100000205941 [0,2,0,0,0,0|2,0,0]=4 11615 B16R2.1063 Nc1ccc(cc1I)OCc2c[nH]cn2 34a_100010084370_100000707719 [0,2,0,0,0,0|1,0,0]=3 11616 B16R2.1063 Nc1ccc(cc1I)OCc2cscn2 34a_100010084370_100000205941 [0,2,0,0,0,0|2,0,0]=4 11617 B16R2.1063 Nc1ccc(cc1I)OCc2cscn2 7a_100010084370_100000205941 [0,2,0,0,0,0|2,0,0]=4 11618 B16R2.1063 Nc1ccc(cc1N)OCc2c[nH]cn2 34a_100025771000_100000707719 [0,2,0,0,0,0|1,0,0]=3 11619 B16R2.1063 Nc1ccc(cc1N)OCc2cscn2 34a_100025771000_100000205941 [0,2,0,0,0,0|2,0,0]=4 11620 B16R2.1063 Nc1ccc(cc1N)SCc2c[nH]cn2 62a_100000707719_100011534411 [0,2,0,0,0,0|1,0,0]=3 11621 B16R2.1063 Nc1ccc(cc1N)SCc2c[nH]cn2 62a_100000741789_100000707719 [0,2,0,0,0,0|1,0,0]=3 11622 B16R2.1063 Nc1ccc(cc1N)SCc2cscn2 62a_100000205941_100011534411 [0,2,0,0,0,0|2,0,0]=4 11623 B16R2.1063 Nc1ccc(cc1N)SCc2cscn2 62a_100000741789_100000205941 [0,2,0,0,0,0|2,0,0]=4 11624 B16R2.1063 Nc1ccc(cc1O)SCc2c[nH]cn2 62a_100000707719_100000739049 [0,2,0,0,0,0|1,0,0]=3 11625 B16R2.1063 Nc1ccc(cc1O)SCc2c[nH]cn2 62a_100000739049_100000707719 [0,2,0,0,0,0|1,0,0]=3 11626 B16R2.1063 Nc1ccc(cc1O)SCc2cscn2 62a_100000205941_100000739049 [0,2,0,0,0,0|2,0,0]=4 11627 B16R2.1063 Nc1ccc(cc1O)SCc2cscn2 62a_100000739049_100000205941 [0,2,0,0,0,0|2,0,0]=4 11628 B16R2.1063 Nc1ccc(nc1Cl)SCc2c[nH]cn2 62a_100000707719_200010233646 [0,2,0,0,0,0|2,0,0]=4 11629 B16R2.1063 Nc1ccc(nc1Cl)SCc2c[nH]cn2 62a_200010233646_100000707719 [0,2,0,0,0,0|2,0,0]=4 11630 B16R2.1063 Nc1ccc(nc1F)SCc2c[nH]cn2 62a_100000707719_100009856439 [0,2,0,0,0,0|2,0,0]=4 11631 B16R2.1063 Nc1ccc(nc1F)SCc2c[nH]cn2 62a_100009856439_100000707719 [0,2,0,0,0,0|2,0,0]=4 11632 B16R2.1063 Nc1ccc(nc1N)SCc2c[nH]cn2 62a_100000747239_100000707719 [0,2,0,0,0,0|2,0,0]=4 11633 B16R2.1063 Nc1ccc(nc1O)SCc2c[nH]cn2 62a_100000718904_100000707719 [0,2,0,0,0,0|2,0,0]=4 11634 B16R2.1063 Nc1cnc(cc1N)SCc2c[nH]cn2 62a_100000067514_100000707719 [0,2,0,0,0,0|2,0,0]=4 11635 B16R2.1063 Nc1cnc(cc1N)SCc2c[nH]cn2 62a_100000707719_100000067514 [0,2,0,0,0,0|2,0,0]=4 11636 B16R2.1063 Nc1nc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100016091773 [0,2,0,0,0,0|2,0,0]=4 11637 B16R2.1063 Nc1nc(ccc1F)SCc2c[nH]cn2 62a_100016091773_100000707719 [0,2,0,0,0,0|2,0,0]=4 11638 B16R2.1063 Nc1nc(ccc1O)SCc2c[nH]cn2 62a_100000685527_100000707719 [0,2,0,0,0,0|2,0,0]=4 11639 B16R2.1063 Nc1nc(ccc1O)SCc2c[nH]cn2 62a_100000707719_100000685527 [0,2,0,0,0,0|2,0,0]=4 11640 B16R2.1063 Nc1nc(ncc1F)NCc2c[nH]cn2 27a_100000758547_100000185498 [0,2,0,0,0,0|2,0,0]=4 11641 B16R2.1063 Nc1ncc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100012353989 [0,2,0,0,0,0|2,0,0]=4 11642 B16R2.1063 Nc1ncc(cc1Br)SCc2c[nH]cn2 62a_100012353989_100000707719 [0,2,0,0,0,0|2,0,0]=4 11643 B16R2.1063 Nc1ncc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100012356299 [0,2,0,0,0,0|2,0,0]=4 11644 B16R2.1063 Nc1ncc(cc1Cl)SCc2c[nH]cn2 62a_100012356299_100000707719 [0,2,0,0,0,0|2,0,0]=4 11645 B16R2.1063 Nc1ncc(cc1F)SCc2c[nH]cn2 62a_100000693161_100000707719 [0,2,0,0,0,0|2,0,0]=4 11646 B16R2.1063 Nc1ncc(cc1F)SCc2c[nH]cn2 62a_100000707719_100000693161 [0,2,0,0,0,0|2,0,0]=4 11647 B16R2.1063 Nc1ncc(cc1O)SCc2c[nH]cn2 62a_100000707719_100009819042 [0,2,0,0,0,0|2,0,0]=4 11648 B16R2.1063 Nc1ncc(cc1O)SCc2c[nH]cn2 62a_100009819042_100000707719 [0,2,0,0,0,0|2,0,0]=4 11649 B16R2.1063 O=c1[nH]cc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100010125443 [0,2,0,0,0,0|2,0,0]=4 11650 B16R2.1063 O=c1[nH]cc(cc1Br)SCc2c[nH]cn2 62a_100010125443_100000707719 [0,2,0,0,0,0|2,0,0]=4 11651 B16R2.1063 O=c1[nH]cc(cc1F)SCc2c[nH]cn2 62a_100000707719_100000723523 [0,2,0,0,0,0|2,0,0]=4 11652 B16R2.1063 O=c1[nH]cc(cc1F)SCc2c[nH]cn2 62a_100000723523_100000707719 [0,2,0,0,0,0|2,0,0]=4 11653 B16R2.1063 O=c1[nH]cc(cc1O)SCc2c[nH]cn2 62a_100000707719_100009814561 [0,2,0,0,0,0|2,0,0]=4 11654 B16R2.1063 Oc1cc(ccc1Br)SCc2c[nH]cn2 62a_100000707719_100012356990 [0,2,0,0,0,0|1,0,0]=3 11655 B16R2.1063 Oc1cc(ccc1Br)SCc2c[nH]cn2 62a_100012356990_100000707719 [0,2,0,0,0,0|1,0,0]=3 11656 B16R2.1063 Oc1cc(ccc1Br)SCc2cscn2 62a_100000205941_100012356990 [0,2,0,0,0,0|2,0,0]=4 11657 B16R2.1063 Oc1cc(ccc1Br)SCc2cscn2 62a_100012356990_100000205941 [0,2,0,0,0,0|2,0,0]=4 11658 B16R2.1063 Oc1cc(ccc1Cl)NCc2c[nH]cn2 34a_100011934209_100000707719 [0,2,0,0,0,0|0,0,0]=2 11659 B16R2.1063 Oc1cc(ccc1Cl)NCc2ccco2 270302a_100011934209_100000186105 [0,2,0,0,0,0|2,0,0]=4 11660 B16R2.1063 Oc1cc(ccc1Cl)NCc2cccs2 270302a_100011934209_100000209959 [0,2,0,0,0,0|2,0,0]=4 11661 B16R2.1063 Oc1cc(ccc1Cl)NCc2ccon2 34a_100011934209_100000234950 [0,2,0,0,0,0|2,0,0]=4 11662 B16R2.1063 Oc1cc(ccc1Cl)NCc2ccsc2 270302a_100011934209_100000188534 [0,2,0,0,0,0|2,0,0]=4 11663 B16R2.1063 Oc1cc(ccc1Cl)NCc2ccsc2 34a_100011934209_100011261437 [0,2,0,0,0,0|2,0,0]=4 11664 B16R2.1063 Oc1cc(ccc1Cl)NCc2cn[nH]c2 270302a_100011934209_100016992096 [0,2,0,0,0,0|2,0,0]=4 11665 B16R2.1063 Oc1cc(ccc1Cl)NCc2cncs2 270302a_100011934209_100000749870 [0,2,0,0,0,0|1,0,1]=4 11666 B16R2.1063 Oc1cc(ccc1Cl)NCc2cncs2 34a_100011934209_100015185245 [0,2,0,0,0,0|1,0,1]=4 11667 B16R2.1063 Oc1cc(ccc1Cl)NCc2cscn2 270302a_100011934209_100000743575 [0,2,0,0,0,0|1,0,0]=3 11668 B16R2.1063 Oc1cc(ccc1Cl)NCc2cscn2 34a_100011934209_100000205941 [0,2,0,0,0,0|1,0,0]=3 11669 B16R2.1063 Oc1cc(ccc1Cl)NCc2ncc[nH]2 34a_100011934209_100016991755 [0,2,0,0,0,0|2,0,0]=4 11670 B16R2.1063 Oc1cc(ccc1Cl)NCc2ncco2 34a_100011934209_103436540062 [0,2,0,0,0,0|2,0,0]=4 11671 B16R2.1063 Oc1cc(ccc1Cl)NCc2nccs2 270302a_100011934209_100000750902 [0,2,0,0,0,0|2,0,0]=4 11672 B16R2.1063 Oc1cc(ccc1Cl)NCc2nccs2 34a_100011934209_100015184050 [0,2,0,0,0,0|2,0,0]=4 11673 B16R2.1063 Oc1cc(ccc1Cl)NCc2ncon2 34a_100011934209_100000233494 [0,2,0,0,0,0|2,0,0]=4 11674 B16R2.1063 Oc1cc(ccc1Cl)NCn2cncn2 34a_100011934209_200020645497 [0,2,0,0,0,0|1,0,1]=4 11675 B16R2.1063 Oc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100000707719_100011356854 [0,2,0,0,0,0|1,0,0]=3 11676 B16R2.1063 Oc1cc(ccc1Cl)SCc2c[nH]cn2 62a_100011356854_100000707719 [0,2,0,0,0,0|1,0,0]=3 11677 B16R2.1063 Oc1cc(ccc1Cl)SCc2cscn2 62a_100000205941_100011356854 [0,2,0,0,0,0|2,0,0]=4 11678 B16R2.1063 Oc1cc(ccc1Cl)SCc2cscn2 62a_100011356854_100000205941 [0,2,0,0,0,0|2,0,0]=4 11679 B16R2.1063 Oc1cc(ccc1F)NCc2c[nH]cn2 34a_100012017398_100000707719 [0,2,0,0,0,0|0,0,0]=2 11680 B16R2.1063 Oc1cc(ccc1F)NCc2ccco2 270302a_100012017398_100000186105 [0,2,0,0,0,0|2,0,0]=4 11681 B16R2.1063 Oc1cc(ccc1F)NCc2cccs2 270302a_100012017398_100000209959 [0,2,0,0,0,0|2,0,0]=4 11682 B16R2.1063 Oc1cc(ccc1F)NCc2ccon2 34a_100012017398_100000234950 [0,2,0,0,0,0|2,0,0]=4 11683 B16R2.1063 Oc1cc(ccc1F)NCc2ccon2 7a_100012017398_100000234950 [0,2,0,0,0,0|2,0,0]=4 11684 B16R2.1063 Oc1cc(ccc1F)NCc2ccsc2 270302a_100012017398_100000188534 [0,2,0,0,0,0|2,0,0]=4 11685 B16R2.1063 Oc1cc(ccc1F)NCc2ccsc2 34a_100012017398_100011261437 [0,2,0,0,0,0|2,0,0]=4 11686 B16R2.1063 Oc1cc(ccc1F)NCc2ccsc2 7a_100012017398_100011261437 [0,2,0,0,0,0|2,0,0]=4 11687 B16R2.1063 Oc1cc(ccc1F)NCc2cn[nH]c2 270302a_100012017398_100016992096 [0,2,0,0,0,0|2,0,0]=4 11688 B16R2.1063 Oc1cc(ccc1F)NCc2cncs2 270302a_100012017398_100000749870 [0,2,0,0,0,0|1,0,1]=4 11689 B16R2.1063 Oc1cc(ccc1F)NCc2cncs2 34a_100012017398_100015185245 [0,2,0,0,0,0|1,0,1]=4 11690 B16R2.1063 Oc1cc(ccc1F)NCc2cncs2 7a_100012017398_100015185245 [0,2,0,0,0,0|1,0,1]=4 11691 B16R2.1063 Oc1cc(ccc1F)NCc2cscn2 270302a_100012017398_100000743575 [0,2,0,0,0,0|1,0,0]=3 11692 B16R2.1063 Oc1cc(ccc1F)NCc2cscn2 34a_100012017398_100000205941 [0,2,0,0,0,0|1,0,0]=3 11693 B16R2.1063 Oc1cc(ccc1F)NCc2cscn2 7a_100012017398_100000205941 [0,2,0,0,0,0|1,0,0]=3 11694 B16R2.1063 Oc1cc(ccc1F)NCc2ncc[nH]2 34a_100012017398_100016991755 [0,2,0,0,0,0|2,0,0]=4 11695 B16R2.1063 Oc1cc(ccc1F)NCc2ncc[nH]2 7a_100012017398_100000753453 [0,2,0,0,0,0|2,0,0]=4 11696 B16R2.1063 Oc1cc(ccc1F)NCc2ncco2 34a_100012017398_103436540062 [0,2,0,0,0,0|2,0,0]=4 11697 B16R2.1063 Oc1cc(ccc1F)NCc2ncco2 7a_100012017398_103436540062 [0,2,0,0,0,0|2,0,0]=4 11698 B16R2.1063 Oc1cc(ccc1F)NCc2nccs2 270302a_100012017398_100000750902 [0,2,0,0,0,0|2,0,0]=4 11699 B16R2.1063 Oc1cc(ccc1F)NCc2nccs2 34a_100012017398_100015184050 [0,2,0,0,0,0|2,0,0]=4 11700 B16R2.1063 Oc1cc(ccc1F)NCc2nccs2 7a_100012017398_100015184050 [0,2,0,0,0,0|2,0,0]=4 11701 B16R2.1063 Oc1cc(ccc1F)NCc2ncon2 34a_100012017398_100000233494 [0,2,0,0,0,0|2,0,0]=4 11702 B16R2.1063 Oc1cc(ccc1F)NCn2cncn2 34a_100012017398_200020645497 [0,2,0,0,0,0|1,0,1]=4 11703 B16R2.1063 Oc1cc(ccc1F)NCn2cncn2 7a_100012017398_200020645497 [0,2,0,0,0,0|1,0,1]=4 11704 B16R2.1063 Oc1cc(ccc1F)SCc2c[nH]cn2 62a_100000686035_100000707719 [0,2,0,0,0,0|1,0,0]=3 11705 B16R2.1063 Oc1cc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100000686035 [0,2,0,0,0,0|1,0,0]=3 11706 B16R2.1063 Oc1cc(ccc1F)SCc2cscn2 62a_100000205941_100000686035 [0,2,0,0,0,0|2,0,0]=4 11707 B16R2.1063 Oc1cc(ccc1F)SCc2cscn2 62a_100000686035_100000205941 [0,2,0,0,0,0|2,0,0]=4 11708 B16R2.1063 Oc1cc(cnc1F)SCc2c[nH]cn2 62a_100000707719_100009819871 [0,2,0,0,0,0|2,0,0]=4 11709 B16R2.1063 Oc1cc(cnc1F)SCc2c[nH]cn2 62a_100009819871_100000707719 [0,2,0,0,0,0|2,0,0]=4 11710 B16R2.1063 Oc1cc(ncc1F)SCc2c[nH]cn2 62a_100000707719_100009854642 [0,2,0,0,0,0|2,0,0]=4 11711 B16R2.1063 Oc1cc(ncc1F)SCc2c[nH]cn2 62a_100009854642_100000707719 [0,2,0,0,0,0|2,0,0]=4 11712 B16R2.1063 Oc1ccc(cc1Br)NCc2c[nH]cn2 34a_100011534360_100000707719 [0,2,0,0,0,0|0,0,0]=2 11713 B16R2.1063 Oc1ccc(cc1Br)NCc2ccco2 270302a_100011534360_100000186105 [0,2,0,0,0,0|2,0,0]=4 11714 B16R2.1063 Oc1ccc(cc1Br)NCc2cccs2 270302a_100011534360_100000209959 [0,2,0,0,0,0|2,0,0]=4 11715 B16R2.1063 Oc1ccc(cc1Br)NCc2ccon2 34a_100011534360_100000234950 [0,2,0,0,0,0|2,0,0]=4 11716 B16R2.1063 Oc1ccc(cc1Br)NCc2ccsc2 270302a_100011534360_100000188534 [0,2,0,0,0,0|2,0,0]=4 11717 B16R2.1063 Oc1ccc(cc1Br)NCc2ccsc2 34a_100011534360_100011261437 [0,2,0,0,0,0|2,0,0]=4 11718 B16R2.1063 Oc1ccc(cc1Br)NCc2cn[nH]c2 270302a_100011534360_100016992096 [0,2,0,0,0,0|2,0,0]=4 11719 B16R2.1063 Oc1ccc(cc1Br)NCc2cncs2 270302a_100011534360_100000749870 [0,2,0,0,0,0|1,0,1]=4 11720 B16R2.1063 Oc1ccc(cc1Br)NCc2cncs2 34a_100011534360_100015185245 [0,2,0,0,0,0|1,0,1]=4 11721 B16R2.1063 Oc1ccc(cc1Br)NCc2cscn2 270302a_100011534360_100000743575 [0,2,0,0,0,0|1,0,0]=3 11722 B16R2.1063 Oc1ccc(cc1Br)NCc2cscn2 34a_100011534360_100000205941 [0,2,0,0,0,0|1,0,0]=3 11723 B16R2.1063 Oc1ccc(cc1Br)NCc2ncc[nH]2 34a_100011534360_100016991755 [0,2,0,0,0,0|2,0,0]=4 11724 B16R2.1063 Oc1ccc(cc1Br)NCc2ncco2 34a_100011534360_103436540062 [0,2,0,0,0,0|2,0,0]=4 11725 B16R2.1063 Oc1ccc(cc1Br)NCc2nccs2 270302a_100011534360_100000750902 [0,2,0,0,0,0|2,0,0]=4 11726 B16R2.1063 Oc1ccc(cc1Br)NCc2nccs2 34a_100011534360_100015184050 [0,2,0,0,0,0|2,0,0]=4 11727 B16R2.1063 Oc1ccc(cc1Br)NCc2ncon2 34a_100011534360_100000233494 [0,2,0,0,0,0|2,0,0]=4 11728 B16R2.1063 Oc1ccc(cc1Br)NCn2cncn2 34a_100011534360_200020645497 [0,2,0,0,0,0|1,0,1]=4 11729 B16R2.1063 Oc1ccc(cc1Br)SCc2c[nH]cn2 62a_100000707719_100012361655 [0,2,0,0,0,0|1,0,0]=3 11730 B16R2.1063 Oc1ccc(cc1Br)SCc2c[nH]cn2 62a_100012361655_100000707719 [0,2,0,0,0,0|1,0,0]=3 11731 B16R2.1063 Oc1ccc(cc1Br)SCc2cscn2 62a_100000205941_100012361655 [0,2,0,0,0,0|2,0,0]=4 11732 B16R2.1063 Oc1ccc(cc1Br)SCc2cscn2 62a_100012361655_100000205941 [0,2,0,0,0,0|2,0,0]=4 11733 B16R2.1063 Oc1ccc(cc1Cl)NCc2c[nH]cn2 34a_100000744943_100000707719 [0,2,0,0,0,0|0,0,0]=2 11734 B16R2.1063 Oc1ccc(cc1Cl)NCc2ccco2 270302a_100000744943_100000186105 [0,2,0,0,0,0|2,0,0]=4 11735 B16R2.1063 Oc1ccc(cc1Cl)NCc2cccs2 270302a_100000744943_100000209959 [0,2,0,0,0,0|2,0,0]=4 11736 B16R2.1063 Oc1ccc(cc1Cl)NCc2ccon2 34a_100000744943_100000234950 [0,2,0,0,0,0|2,0,0]=4 11737 B16R2.1063 Oc1ccc(cc1Cl)NCc2ccsc2 270302a_100000744943_100000188534 [0,2,0,0,0,0|2,0,0]=4 11738 B16R2.1063 Oc1ccc(cc1Cl)NCc2ccsc2 34a_100000744943_100011261437 [0,2,0,0,0,0|2,0,0]=4 11739 B16R2.1063 Oc1ccc(cc1Cl)NCc2cn[nH]c2 270302a_100000744943_100016992096 [0,2,0,0,0,0|2,0,0]=4 11740 B16R2.1063 Oc1ccc(cc1Cl)NCc2cncs2 270302a_100000744943_100000749870 [0,2,0,0,0,0|1,0,1]=4 11741 B16R2.1063 Oc1ccc(cc1Cl)NCc2cncs2 34a_100000744943_100015185245 [0,2,0,0,0,0|1,0,1]=4 11742 B16R2.1063 Oc1ccc(cc1Cl)NCc2cscn2 270302a_100000744943_100000743575 [0,2,0,0,0,0|1,0,0]=3 11743 B16R2.1063 Oc1ccc(cc1Cl)NCc2cscn2 34a_100000744943_100000205941 [0,2,0,0,0,0|1,0,0]=3 11744 B16R2.1063 Oc1ccc(cc1Cl)NCc2ncc[nH]2 34a_100000744943_100016991755 [0,2,0,0,0,0|2,0,0]=4 11745 B16R2.1063 Oc1ccc(cc1Cl)NCc2ncco2 34a_100000744943_103436540062 [0,2,0,0,0,0|2,0,0]=4 11746 B16R2.1063 Oc1ccc(cc1Cl)NCc2nccs2 270302a_100000744943_100000750902 [0,2,0,0,0,0|2,0,0]=4 11747 B16R2.1063 Oc1ccc(cc1Cl)NCc2nccs2 34a_100000744943_100015184050 [0,2,0,0,0,0|2,0,0]=4 11748 B16R2.1063 Oc1ccc(cc1Cl)NCc2ncon2 34a_100000744943_100000233494 [0,2,0,0,0,0|2,0,0]=4 11749 B16R2.1063 Oc1ccc(cc1Cl)NCn2cncn2 34a_100000744943_200020645497 [0,2,0,0,0,0|1,0,1]=4 11750 B16R2.1063 Oc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100012360047 [0,2,0,0,0,0|1,0,0]=3 11751 B16R2.1063 Oc1ccc(cc1Cl)SCc2c[nH]cn2 62a_100012360047_100000707719 [0,2,0,0,0,0|1,0,0]=3 11752 B16R2.1063 Oc1ccc(cc1Cl)SCc2cscn2 62a_100000205941_100012360047 [0,2,0,0,0,0|2,0,0]=4 11753 B16R2.1063 Oc1ccc(cc1Cl)SCc2cscn2 62a_100012360047_100000205941 [0,2,0,0,0,0|2,0,0]=4 11754 B16R2.1063 Oc1ccc(cc1F)NCc2c[nH]cn2 34a_100011220035_100000707719 [0,2,0,0,0,0|0,0,0]=2 11755 B16R2.1063 Oc1ccc(cc1F)NCc2ccco2 270302a_100011220035_100000186105 [0,2,0,0,0,0|2,0,0]=4 11756 B16R2.1063 Oc1ccc(cc1F)NCc2cccs2 270302a_100011220035_100000209959 [0,2,0,0,0,0|2,0,0]=4 11757 B16R2.1063 Oc1ccc(cc1F)NCc2cccs2 271570a_203496583355_200000711367 [0,2,0,0,0,0|2,0,0]=4 11758 B16R2.1063 Oc1ccc(cc1F)NCc2ccon2 34a_100011220035_100000234950 [0,2,0,0,0,0|2,0,0]=4 11759 B16R2.1063 Oc1ccc(cc1F)NCc2ccon2 7a_100011220035_100000234950 [0,2,0,0,0,0|2,0,0]=4 11760 B16R2.1063 Oc1ccc(cc1F)NCc2ccsc2 270302a_100011220035_100000188534 [0,2,0,0,0,0|2,0,0]=4 11761 B16R2.1063 Oc1ccc(cc1F)NCc2ccsc2 34a_100011220035_100011261437 [0,2,0,0,0,0|2,0,0]=4 11762 B16R2.1063 Oc1ccc(cc1F)NCc2ccsc2 7a_100011220035_100011261437 [0,2,0,0,0,0|2,0,0]=4 11763 B16R2.1063 Oc1ccc(cc1F)NCc2cn[nH]c2 270302a_100011220035_100016992096 [0,2,0,0,0,0|2,0,0]=4 11764 B16R2.1063 Oc1ccc(cc1F)NCc2cncs2 270302a_100011220035_100000749870 [0,2,0,0,0,0|1,0,1]=4 11765 B16R2.1063 Oc1ccc(cc1F)NCc2cncs2 34a_100011220035_100015185245 [0,2,0,0,0,0|1,0,1]=4 11766 B16R2.1063 Oc1ccc(cc1F)NCc2cncs2 7a_100011220035_100015185245 [0,2,0,0,0,0|1,0,1]=4 11767 B16R2.1063 Oc1ccc(cc1F)NCc2cscn2 270302a_100011220035_100000743575 [0,2,0,0,0,0|1,0,0]=3 11768 B16R2.1063 Oc1ccc(cc1F)NCc2cscn2 34a_100011220035_100000205941 [0,2,0,0,0,0|1,0,0]=3 11769 B16R2.1063 Oc1ccc(cc1F)NCc2cscn2 7a_100011220035_100000205941 [0,2,0,0,0,0|1,0,0]=3 11770 B16R2.1063 Oc1ccc(cc1F)NCc2ncc[nH]2 34a_100011220035_100016991755 [0,2,0,0,0,0|2,0,0]=4 11771 B16R2.1063 Oc1ccc(cc1F)NCc2ncc[nH]2 7a_100011220035_100000753453 [0,2,0,0,0,0|2,0,0]=4 11772 B16R2.1063 Oc1ccc(cc1F)NCc2ncco2 34a_100011220035_103436540062 [0,2,0,0,0,0|2,0,0]=4 11773 B16R2.1063 Oc1ccc(cc1F)NCc2ncco2 7a_100011220035_103436540062 [0,2,0,0,0,0|2,0,0]=4 11774 B16R2.1063 Oc1ccc(cc1F)NCc2nccs2 270302a_100011220035_100000750902 [0,2,0,0,0,0|2,0,0]=4 11775 B16R2.1063 Oc1ccc(cc1F)NCc2nccs2 34a_100011220035_100015184050 [0,2,0,0,0,0|2,0,0]=4 11776 B16R2.1063 Oc1ccc(cc1F)NCc2nccs2 7a_100011220035_100015184050 [0,2,0,0,0,0|2,0,0]=4 11777 B16R2.1063 Oc1ccc(cc1F)NCc2ncon2 34a_100011220035_100000233494 [0,2,0,0,0,0|2,0,0]=4 11778 B16R2.1063 Oc1ccc(cc1F)NCn2cncn2 34a_100011220035_200020645497 [0,2,0,0,0,0|1,0,1]=4 11779 B16R2.1063 Oc1ccc(cc1F)NCn2cncn2 7a_100011220035_200020645497 [0,2,0,0,0,0|1,0,1]=4 11780 B16R2.1063 Oc1ccc(cc1F)SCc2c[nH]cn2 62a_100000185481_100000707719 [0,2,0,0,0,0|1,0,0]=3 11781 B16R2.1063 Oc1ccc(cc1F)SCc2c[nH]cn2 62a_100000707719_100000185481 [0,2,0,0,0,0|1,0,0]=3 11782 B16R2.1063 Oc1ccc(cc1F)SCc2cscn2 62a_100000185481_100000205941 [0,2,0,0,0,0|2,0,0]=4 11783 B16R2.1063 Oc1ccc(cc1F)SCc2cscn2 62a_100000205941_100000185481 [0,2,0,0,0,0|2,0,0]=4 11784 B16R2.1063 Oc1ccc(cc1O)NCc2c[nH]cn2 34a_100102946323_100000707719 [0,2,0,0,0,0|0,0,0]=2 11785 B16R2.1063 Oc1ccc(cc1O)NCc2ccon2 34a_100102946323_100000234950 [0,2,0,0,0,0|2,0,0]=4 11786 B16R2.1063 Oc1ccc(cc1O)NCc2ccsc2 34a_100102946323_100011261437 [0,2,0,0,0,0|2,0,0]=4 11787 B16R2.1063 Oc1ccc(cc1O)NCc2cncs2 34a_100102946323_100015185245 [0,2,0,0,0,0|1,0,1]=4 11788 B16R2.1063 Oc1ccc(cc1O)NCc2cscn2 34a_100102946323_100000205941 [0,2,0,0,0,0|1,0,0]=3 11789 B16R2.1063 Oc1ccc(cc1O)NCc2ncc[nH]2 34a_100102946323_100016991755 [0,2,0,0,0,0|2,0,0]=4 11790 B16R2.1063 Oc1ccc(cc1O)NCc2ncco2 34a_100102946323_103436540062 [0,2,0,0,0,0|2,0,0]=4 11791 B16R2.1063 Oc1ccc(cc1O)NCc2nccs2 34a_100102946323_100015184050 [0,2,0,0,0,0|2,0,0]=4 11792 B16R2.1063 Oc1ccc(cc1O)NCc2ncon2 34a_100102946323_100000233494 [0,2,0,0,0,0|2,0,0]=4 11793 B16R2.1063 Oc1ccc(cc1O)NCn2cncn2 34a_100102946323_200020645497 [0,2,0,0,0,0|1,0,1]=4 11794 B16R2.1063 Oc1ccc(cc1O)SCc2c[nH]cn2 62a_100000707719_100009813601 [0,2,0,0,0,0|1,0,0]=3 11795 B16R2.1063 Oc1ccc(cc1O)SCc2cscn2 62a_100000205941_100009813601 [0,2,0,0,0,0|2,0,0]=4 11796 B16R2.1063 Oc1ccc(nc1Br)SCc2c[nH]cn2 62a_100000707719_100000725334 [0,2,0,0,0,0|2,0,0]=4 11797 B16R2.1063 Oc1ccc(nc1Br)SCc2c[nH]cn2 62a_100000725334_100000707719 [0,2,0,0,0,0|2,0,0]=4 11798 B16R2.1063 Oc1ccc(nc1Cl)SCc2c[nH]cn2 62a_100000707719_100000721234 [0,2,0,0,0,0|2,0,0]=4 11799 B16R2.1063 Oc1ccc(nc1F)SCc2c[nH]cn2 62a_100000707719_100009819667 [0,2,0,0,0,0|2,0,0]=4 11800 B16R2.1063 Oc1ccc(nc1F)SCc2c[nH]cn2 62a_100009819667_100000707719 [0,2,0,0,0,0|2,0,0]=4 11801 B16R2.1063 Oc1nc(ccc1F)SCc2c[nH]cn2 62a_100000707719_100010729010 [0,2,0,0,0,0|2,0,0]=4 11802 B16R2.1063 Oc1nc(ncc1F)NCc2c[nH]cn2 27a_100000758547_100011995740 [0,2,0,0,0,0|2,0,0]=4 11803 B16R2.1063 Oc1ncc(cc1Cl)SCc2c[nH]cn2 62a_100000707719_100010238531 [0,2,0,0,0,0|2,0,0]=4 11804 B16R2.1063 Oc1ncc(cc1Cl)SCc2c[nH]cn2 62a_100010238531_100000707719 [0,2,0,0,0,0|2,0,0]=4 11805 B16R2.3000 Brc1cc(ccc1CSc2c[nH]cn2)I 62a_100000756875_100010146610 [0,2,0,0,0,0|2,0,0]=4 11806 B16R2.3000 Brc1cc(ccc1CSc2c[nH]cn2)I 62a_100010146610_100000756875 [0,2,0,0,0,0|2,0,0]=4 11807 B16R2.3000 Brc1cc(ccc1OCc2c[nH]cn2)I 34a_100012361655_100000707719 [0,2,0,0,0,0|1,0,0]=3 11808 B16R2.3000 Brc1cc(ccc1OCc2cscn2)I 34a_100012361655_100000205941 [0,2,0,0,0,0|2,0,0]=4 11809 B16R2.3000 Brc1cc(ccc1OCc2cscn2)I 7a_100012361655_100000205941 [0,2,0,0,0,0|2,0,0]=4 11810 B16R2.3000 Brc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_100000756875_200012351560 [0,2,0,0,0,0|2,0,0]=4 11811 B16R2.3000 Brc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_200012351560_100000756875 [0,2,0,0,0,0|2,0,0]=4 11812 B16R2.3000 Brc1ccc(c(c1)Br)NCc2c[nH]cn2 34a_100000211012_100000707719 [0,2,0,0,0,0|0,0,0]=2 11813 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ccco2 270302a_100000211012_100000186105 [0,2,0,0,0,0|2,0,0]=4 11814 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cccs2 270302a_100000211012_100000209959 [0,2,0,0,0,0|2,0,0]=4 11815 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ccon2 34a_100000211012_100000234950 [0,2,0,0,0,0|2,0,0]=4 11816 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ccsc2 270302a_100000211012_100000188534 [0,2,0,0,0,0|2,0,0]=4 11817 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ccsc2 34a_100000211012_100011261437 [0,2,0,0,0,0|2,0,0]=4 11818 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cn[nH]c2 270302a_100000211012_100016992096 [0,2,0,0,0,0|2,0,0]=4 11819 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cncs2 270302a_100000211012_100000749870 [0,2,0,0,0,0|1,0,1]=4 11820 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cncs2 34a_100000211012_100015185245 [0,2,0,0,0,0|1,0,1]=4 11821 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cscn2 270302a_100000211012_100000743575 [0,2,0,0,0,0|1,0,0]=3 11822 B16R2.3000 Brc1ccc(c(c1)Br)NCc2cscn2 34a_100000211012_100000205941 [0,2,0,0,0,0|1,0,0]=3 11823 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100000211012_100016991755 [0,2,0,0,0,0|2,0,0]=4 11824 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ncco2 34a_100000211012_103436540062 [0,2,0,0,0,0|2,0,0]=4 11825 B16R2.3000 Brc1ccc(c(c1)Br)NCc2nccs2 270302a_100000211012_100000750902 [0,2,0,0,0,0|2,0,0]=4 11826 B16R2.3000 Brc1ccc(c(c1)Br)NCc2nccs2 34a_100000211012_100015184050 [0,2,0,0,0,0|2,0,0]=4 11827 B16R2.3000 Brc1ccc(c(c1)Br)NCc2ncon2 34a_100000211012_100000233494 [0,2,0,0,0,0|2,0,0]=4 11828 B16R2.3000 Brc1ccc(c(c1)Br)NCn2cncn2 34a_100000211012_200020645497 [0,2,0,0,0,0|1,0,1]=4 11829 B16R2.3000 Brc1ccc(c(c1)Br)OCc2c[nH]cn2 34a_100000188717_100000707719 [0,2,0,0,0,0|1,0,0]=3 11830 B16R2.3000 Brc1ccc(c(c1)Br)OCc2cscn2 34a_100000188717_100000205941 [0,2,0,0,0,0|2,0,0]=4 11831 B16R2.3000 Brc1ccc(c(c1)Br)OCc2cscn2 7a_100000188717_100000205941 [0,2,0,0,0,0|2,0,0]=4 11832 B16R2.3000 Brc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100011484698 [0,2,0,0,0,0|1,0,0]=3 11833 B16R2.3000 Brc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100011484698_100000707719 [0,2,0,0,0,0|1,0,0]=3 11834 B16R2.3000 Brc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100011484698 [0,2,0,0,0,0|2,0,0]=4 11835 B16R2.3000 Brc1ccc(c(c1)Br)SCc2cscn2 62a_100011484698_100000205941 [0,2,0,0,0,0|2,0,0]=4 11836 B16R2.3000 Brc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100000756875_100010146615 [0,2,0,0,0,0|2,0,0]=4 11837 B16R2.3000 Brc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100010146615_100000756875 [0,2,0,0,0,0|2,0,0]=4 11838 B16R2.3000 Brc1ccc(c(c1)I)NCc2c[nH]cn2 34a_100000187925_100000707719 [0,2,0,0,0,0|0,0,0]=2 11839 B16R2.3000 Brc1ccc(c(c1)I)NCc2ccon2 34a_100000187925_100000234950 [0,2,0,0,0,0|2,0,0]=4 11840 B16R2.3000 Brc1ccc(c(c1)I)NCc2ccsc2 34a_100000187925_100011261437 [0,2,0,0,0,0|2,0,0]=4 11841 B16R2.3000 Brc1ccc(c(c1)I)NCc2cncs2 34a_100000187925_100015185245 [0,2,0,0,0,0|1,0,1]=4 11842 B16R2.3000 Brc1ccc(c(c1)I)NCc2cscn2 34a_100000187925_100000205941 [0,2,0,0,0,0|1,0,0]=3 11843 B16R2.3000 Brc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100000187925_100016991755 [0,2,0,0,0,0|2,0,0]=4 11844 B16R2.3000 Brc1ccc(c(c1)I)NCc2ncco2 34a_100000187925_103436540062 [0,2,0,0,0,0|2,0,0]=4 11845 B16R2.3000 Brc1ccc(c(c1)I)NCc2nccs2 34a_100000187925_100015184050 [0,2,0,0,0,0|2,0,0]=4 11846 B16R2.3000 Brc1ccc(c(c1)I)NCc2ncon2 34a_100000187925_100000233494 [0,2,0,0,0,0|2,0,0]=4 11847 B16R2.3000 Brc1ccc(c(c1)I)NCn2cncn2 34a_100000187925_200020645497 [0,2,0,0,0,0|1,0,1]=4 11848 B16R2.3000 Brc1ccc(c(c1)I)OCc2c[nH]cn2 34a_100012355227_100000707719 [0,2,0,0,0,0|1,0,0]=3 11849 B16R2.3000 Brc1ccc(c(c1)I)OCc2cscn2 34a_100012355227_100000205941 [0,2,0,0,0,0|2,0,0]=4 11850 B16R2.3000 Brc1ccc(c(c1)I)OCc2cscn2 7a_100012355227_100000205941 [0,2,0,0,0,0|2,0,0]=4 11851 B16R2.3000 Brc1ccc(c(n1)Br)OCc2c[nH]cn2 34a_100009999766_100000707719 [0,2,0,0,0,0|2,0,0]=4 11852 B16R2.3000 Brc1ccc(c(n1)I)OCc2c[nH]cn2 34a_100010253912_100000707719 [0,2,0,0,0,0|2,0,0]=4 11853 B16R2.3000 Brc1cnc(c(c1)Br)OCc2c[nH]cn2 34a_100000701035_100000707719 [0,2,0,0,0,0|2,0,0]=4 11854 B16R2.3000 Brc1nc(ccc1OCc2c[nH]cn2)I 34a_100000725334_100000707719 [0,2,0,0,0,0|2,0,0]=4 11855 B16R2.3000 Cc1c[n+](ccc1SCc2c[nH]cn2)[O-] 62a_100000707719_100000074940 [0,2,0,0,0,0|2,0,0]=4 11856 B16R2.3000 Cc1cc(=O)c(co1)OCc2c[nH]cn2 34a_100000081520_100000707719 [0,2,0,0,0,0|2,0,0]=4 11857 B16R2.3000 Cc1cc(c(cn1)OCc2c[nH]cn2)Br 34a_100009843476_100000707719 [0,2,0,0,0,0|2,0,0]=4 11858 B16R2.3000 Cc1cc(c(cn1)OCc2c[nH]cn2)C 34a_200000068632_100000707719 [0,2,0,0,0,0|2,0,0]=4 11859 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)C 62a_100000707719_100009819613 [0,2,0,0,0,0|2,0,0]=4 11860 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)C 62a_100009819613_100000707719 [0,2,0,0,0,0|2,0,0]=4 11861 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)N 62a_100000707719_100009817891 [0,2,0,0,0,0|2,0,0]=4 11862 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)N 62a_100009817891_100000707719 [0,2,0,0,0,0|2,0,0]=4 11863 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)O 62a_100000707719_100011016184 [0,2,0,0,0,0|2,0,0]=4 11864 B16R2.3000 Cc1cc(c(cn1)SCc2c[nH]cn2)O 62a_100011016184_100000707719 [0,2,0,0,0,0|2,0,0]=4 11865 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)Br 62a_100000708836_100000756875 [0,2,0,0,0,0|2,0,0]=4 11866 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)Br 62a_100000756875_100000708836 [0,2,0,0,0,0|2,0,0]=4 11867 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)Cl 62a_100000756875_100012361307 [0,2,0,0,0,0|2,0,0]=4 11868 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)Cl 62a_100012361307_100000756875 [0,2,0,0,0,0|2,0,0]=4 11869 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)F 62a_100000700533_100000756875 [0,2,0,0,0,0|2,0,0]=4 11870 B16R2.3000 Cc1cc(ccc1CSc2c[nH]cn2)F 62a_100000756875_100000700533 [0,2,0,0,0,0|2,0,0]=4 11871 B16R2.3000 Cc1cc(ccc1NCc2c[nH]cn2)Br 34a_100000211769_100000707719 [0,2,0,0,0,0|0,0,0]=2 11872 B16R2.3000 Cc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100000210418_100000707719 [0,2,0,0,0,0|0,0,0]=2 11873 B16R2.3000 Cc1cc(ccc1NCc2c[nH]cn2)F 34a_100000211637_100000707719 [0,2,0,0,0,0|0,0,0]=2 11874 B16R2.3000 Cc1cc(ccc1NCc2c[nH]cn2)I 34a_100000184554_100000707719 [0,2,0,0,0,0|0,0,0]=2 11875 B16R2.3000 Cc1cc(ccc1NCc2c[nH]cn2)O 34a_100000756630_100000707719 [0,2,0,0,0,0|0,0,0]=2 11876 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)Br 207a_100000211769_100000738523 [0,2,0,0,0,0|2,0,0]=4 11877 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)Cl 207a_100000210418_100000738523 [0,2,0,0,0,0|2,0,0]=4 11878 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)F 207a_100000211637_100000738523 [0,2,0,0,0,0|2,0,0]=4 11879 B16R2.3000 Cc1cc(ccc1NCc2cc[nH]n2)I 207a_100000184554_100000738523 [0,2,0,0,0,0|2,0,0]=4 11880 B16R2.3000 Cc1cc(ccc1NCc2ccco2)Br 207a_100000211769_100000186105 [0,2,0,0,0,0|2,0,0]=4 11881 B16R2.3000 Cc1cc(ccc1NCc2ccco2)Br 270302a_100000211769_100000186105 [0,2,0,0,0,0|2,0,0]=4 11882 B16R2.3000 Cc1cc(ccc1NCc2ccco2)Cl 207a_100000210418_100000186105 [0,2,0,0,0,0|2,0,0]=4 11883 B16R2.3000 Cc1cc(ccc1NCc2ccco2)Cl 270302a_100000210418_100000186105 [0,2,0,0,0,0|2,0,0]=4 11884 B16R2.3000 Cc1cc(ccc1NCc2ccco2)F 207a_100000211637_100000186105 [0,2,0,0,0,0|2,0,0]=4 11885 B16R2.3000 Cc1cc(ccc1NCc2ccco2)F 270302a_100000211637_100000186105 [0,2,0,0,0,0|2,0,0]=4 11886 B16R2.3000 Cc1cc(ccc1NCc2ccco2)I 207a_100000184554_100000186105 [0,2,0,0,0,0|2,0,0]=4 11887 B16R2.3000 Cc1cc(ccc1NCc2ccco2)I 270302a_100000184554_100000186105 [0,2,0,0,0,0|2,0,0]=4 11888 B16R2.3000 Cc1cc(ccc1NCc2ccco2)O 270302a_100000756630_100000186105 [0,2,0,0,0,0|2,0,0]=4 11889 B16R2.3000 Cc1cc(ccc1NCc2cccs2)Br 207a_100000211769_100000209959 [0,2,0,0,0,0|2,0,0]=4 11890 B16R2.3000 Cc1cc(ccc1NCc2cccs2)Br 270302a_100000211769_100000209959 [0,2,0,0,0,0|2,0,0]=4 11891 B16R2.3000 Cc1cc(ccc1NCc2cccs2)Cl 207a_100000210418_100000209959 [0,2,0,0,0,0|2,0,0]=4 11892 B16R2.3000 Cc1cc(ccc1NCc2cccs2)Cl 270302a_100000210418_100000209959 [0,2,0,0,0,0|2,0,0]=4 11893 B16R2.3000 Cc1cc(ccc1NCc2cccs2)F 207a_100000211637_100000209959 [0,2,0,0,0,0|2,0,0]=4 11894 B16R2.3000 Cc1cc(ccc1NCc2cccs2)F 270302a_100000211637_100000209959 [0,2,0,0,0,0|2,0,0]=4 11895 B16R2.3000 Cc1cc(ccc1NCc2cccs2)I 207a_100000184554_100000209959 [0,2,0,0,0,0|2,0,0]=4 11896 B16R2.3000 Cc1cc(ccc1NCc2cccs2)I 270302a_100000184554_100000209959 [0,2,0,0,0,0|2,0,0]=4 11897 B16R2.3000 Cc1cc(ccc1NCc2cccs2)O 270302a_100000756630_100000209959 [0,2,0,0,0,0|2,0,0]=4 11898 B16R2.3000 Cc1cc(ccc1NCc2ccoc2)Br 207a_100000211769_100011215517 [0,2,0,0,0,0|2,0,0]=4 11899 B16R2.3000 Cc1cc(ccc1NCc2ccoc2)Cl 207a_100000210418_100011215517 [0,2,0,0,0,0|2,0,0]=4 11900 B16R2.3000 Cc1cc(ccc1NCc2ccoc2)F 207a_100000211637_100011215517 [0,2,0,0,0,0|2,0,0]=4 11901 B16R2.3000 Cc1cc(ccc1NCc2ccoc2)I 207a_100000184554_100011215517 [0,2,0,0,0,0|2,0,0]=4 11902 B16R2.3000 Cc1cc(ccc1NCc2ccon2)Br 34a_100000211769_100000234950 [0,2,0,0,0,0|2,0,0]=4 11903 B16R2.3000 Cc1cc(ccc1NCc2ccon2)Br 7a_100000211769_100000234950 [0,2,0,0,0,0|2,0,0]=4 11904 B16R2.3000 Cc1cc(ccc1NCc2ccon2)Cl 34a_100000210418_100000234950 [0,2,0,0,0,0|2,0,0]=4 11905 B16R2.3000 Cc1cc(ccc1NCc2ccon2)Cl 7a_100000210418_100000234950 [0,2,0,0,0,0|2,0,0]=4 11906 B16R2.3000 Cc1cc(ccc1NCc2ccon2)F 34a_100000211637_100000234950 [0,2,0,0,0,0|2,0,0]=4 11907 B16R2.3000 Cc1cc(ccc1NCc2ccon2)F 7a_100000211637_100000234950 [0,2,0,0,0,0|2,0,0]=4 11908 B16R2.3000 Cc1cc(ccc1NCc2ccon2)I 34a_100000184554_100000234950 [0,2,0,0,0,0|2,0,0]=4 11909 B16R2.3000 Cc1cc(ccc1NCc2ccon2)I 7a_100000184554_100000234950 [0,2,0,0,0,0|2,0,0]=4 11910 B16R2.3000 Cc1cc(ccc1NCc2ccon2)O 34a_100000756630_100000234950 [0,2,0,0,0,0|2,0,0]=4 11911 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Br 207a_100000211769_100000188534 [0,2,0,0,0,0|2,0,0]=4 11912 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Br 270302a_100000211769_100000188534 [0,2,0,0,0,0|2,0,0]=4 11913 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Br 34a_100000211769_100011261437 [0,2,0,0,0,0|2,0,0]=4 11914 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Br 7a_100000211769_100011261437 [0,2,0,0,0,0|2,0,0]=4 11915 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Cl 207a_100000210418_100000188534 [0,2,0,0,0,0|2,0,0]=4 11916 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Cl 270302a_100000210418_100000188534 [0,2,0,0,0,0|2,0,0]=4 11917 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Cl 34a_100000210418_100011261437 [0,2,0,0,0,0|2,0,0]=4 11918 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)Cl 7a_100000210418_100011261437 [0,2,0,0,0,0|2,0,0]=4 11919 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)F 207a_100000211637_100000188534 [0,2,0,0,0,0|2,0,0]=4 11920 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)F 270302a_100000211637_100000188534 [0,2,0,0,0,0|2,0,0]=4 11921 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)F 34a_100000211637_100011261437 [0,2,0,0,0,0|2,0,0]=4 11922 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)F 7a_100000211637_100011261437 [0,2,0,0,0,0|2,0,0]=4 11923 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)I 207a_100000184554_100000188534 [0,2,0,0,0,0|2,0,0]=4 11924 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)I 270302a_100000184554_100000188534 [0,2,0,0,0,0|2,0,0]=4 11925 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)I 34a_100000184554_100011261437 [0,2,0,0,0,0|2,0,0]=4 11926 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)I 7a_100000184554_100011261437 [0,2,0,0,0,0|2,0,0]=4 11927 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)O 270302a_100000756630_100000188534 [0,2,0,0,0,0|2,0,0]=4 11928 B16R2.3000 Cc1cc(ccc1NCc2ccsc2)O 34a_100000756630_100011261437 [0,2,0,0,0,0|2,0,0]=4 11929 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)Br 207a_100000211769_100016992096 [0,2,0,0,0,0|2,0,0]=4 11930 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)Br 270302a_100000211769_100016992096 [0,2,0,0,0,0|2,0,0]=4 11931 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)Cl 207a_100000210418_100016992096 [0,2,0,0,0,0|2,0,0]=4 11932 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)Cl 270302a_100000210418_100016992096 [0,2,0,0,0,0|2,0,0]=4 11933 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)F 207a_100000211637_100016992096 [0,2,0,0,0,0|2,0,0]=4 11934 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)F 270302a_100000211637_100016992096 [0,2,0,0,0,0|2,0,0]=4 11935 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)I 207a_100000184554_100016992096 [0,2,0,0,0,0|2,0,0]=4 11936 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)I 270302a_100000184554_100016992096 [0,2,0,0,0,0|2,0,0]=4 11937 B16R2.3000 Cc1cc(ccc1NCc2cn[nH]c2)O 270302a_100000756630_100016992096 [0,2,0,0,0,0|2,0,0]=4 11938 B16R2.3000 Cc1cc(ccc1NCc2cnc[nH]2)Br 207a_100000211769_100000742939 [0,2,0,0,0,0|0,0,2]=4 11939 B16R2.3000 Cc1cc(ccc1NCc2cnc[nH]2)Cl 207a_100000210418_100000742939 [0,2,0,0,0,0|0,0,2]=4 11940 B16R2.3000 Cc1cc(ccc1NCc2cnc[nH]2)F 207a_100000211637_100000742939 [0,2,0,0,0,0|0,0,2]=4 11941 B16R2.3000 Cc1cc(ccc1NCc2cnc[nH]2)I 207a_100000184554_100000742939 [0,2,0,0,0,0|0,0,2]=4 11942 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Br 207a_100000211769_100000749870 [0,2,0,0,0,0|1,0,1]=4 11943 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Br 270302a_100000211769_100000749870 [0,2,0,0,0,0|1,0,1]=4 11944 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Br 34a_100000211769_100015185245 [0,2,0,0,0,0|1,0,1]=4 11945 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Br 7a_100000211769_100015185245 [0,2,0,0,0,0|1,0,1]=4 11946 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Cl 207a_100000210418_100000749870 [0,2,0,0,0,0|1,0,1]=4 11947 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Cl 270302a_100000210418_100000749870 [0,2,0,0,0,0|1,0,1]=4 11948 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Cl 34a_100000210418_100015185245 [0,2,0,0,0,0|1,0,1]=4 11949 B16R2.3000 Cc1cc(ccc1NCc2cncs2)Cl 7a_100000210418_100015185245 [0,2,0,0,0,0|1,0,1]=4 11950 B16R2.3000 Cc1cc(ccc1NCc2cncs2)F 207a_100000211637_100000749870 [0,2,0,0,0,0|1,0,1]=4 11951 B16R2.3000 Cc1cc(ccc1NCc2cncs2)F 270302a_100000211637_100000749870 [0,2,0,0,0,0|1,0,1]=4 11952 B16R2.3000 Cc1cc(ccc1NCc2cncs2)F 34a_100000211637_100015185245 [0,2,0,0,0,0|1,0,1]=4 11953 B16R2.3000 Cc1cc(ccc1NCc2cncs2)F 7a_100000211637_100015185245 [0,2,0,0,0,0|1,0,1]=4 11954 B16R2.3000 Cc1cc(ccc1NCc2cncs2)I 207a_100000184554_100000749870 [0,2,0,0,0,0|1,0,1]=4 11955 B16R2.3000 Cc1cc(ccc1NCc2cncs2)I 270302a_100000184554_100000749870 [0,2,0,0,0,0|1,0,1]=4 11956 B16R2.3000 Cc1cc(ccc1NCc2cncs2)I 34a_100000184554_100015185245 [0,2,0,0,0,0|1,0,1]=4 11957 B16R2.3000 Cc1cc(ccc1NCc2cncs2)I 7a_100000184554_100015185245 [0,2,0,0,0,0|1,0,1]=4 11958 B16R2.3000 Cc1cc(ccc1NCc2cncs2)O 270302a_100000756630_100000749870 [0,2,0,0,0,0|1,0,1]=4 11959 B16R2.3000 Cc1cc(ccc1NCc2cncs2)O 34a_100000756630_100015185245 [0,2,0,0,0,0|1,0,1]=4 11960 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Br 207a_100000211769_100000743575 [0,2,0,0,0,0|1,0,0]=3 11961 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Br 270302a_100000211769_100000743575 [0,2,0,0,0,0|1,0,0]=3 11962 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Br 34a_100000211769_100000205941 [0,2,0,0,0,0|1,0,0]=3 11963 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Br 7a_100000211769_100000205941 [0,2,0,0,0,0|1,0,0]=3 11964 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Cl 207a_100000210418_100000743575 [0,2,0,0,0,0|1,0,0]=3 11965 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Cl 270302a_100000210418_100000743575 [0,2,0,0,0,0|1,0,0]=3 11966 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Cl 34a_100000210418_100000205941 [0,2,0,0,0,0|1,0,0]=3 11967 B16R2.3000 Cc1cc(ccc1NCc2cscn2)Cl 7a_100000210418_100000205941 [0,2,0,0,0,0|1,0,0]=3 11968 B16R2.3000 Cc1cc(ccc1NCc2cscn2)F 207a_100000211637_100000743575 [0,2,0,0,0,0|1,0,0]=3 11969 B16R2.3000 Cc1cc(ccc1NCc2cscn2)F 270302a_100000211637_100000743575 [0,2,0,0,0,0|1,0,0]=3 11970 B16R2.3000 Cc1cc(ccc1NCc2cscn2)F 34a_100000211637_100000205941 [0,2,0,0,0,0|1,0,0]=3 11971 B16R2.3000 Cc1cc(ccc1NCc2cscn2)F 7a_100000211637_100000205941 [0,2,0,0,0,0|1,0,0]=3 11972 B16R2.3000 Cc1cc(ccc1NCc2cscn2)I 207a_100000184554_100000743575 [0,2,0,0,0,0|1,0,0]=3 11973 B16R2.3000 Cc1cc(ccc1NCc2cscn2)I 270302a_100000184554_100000743575 [0,2,0,0,0,0|1,0,0]=3 11974 B16R2.3000 Cc1cc(ccc1NCc2cscn2)I 34a_100000184554_100000205941 [0,2,0,0,0,0|1,0,0]=3 11975 B16R2.3000 Cc1cc(ccc1NCc2cscn2)I 7a_100000184554_100000205941 [0,2,0,0,0,0|1,0,0]=3 11976 B16R2.3000 Cc1cc(ccc1NCc2cscn2)O 270302a_100000756630_100000743575 [0,2,0,0,0,0|1,0,0]=3 11977 B16R2.3000 Cc1cc(ccc1NCc2cscn2)O 34a_100000756630_100000205941 [0,2,0,0,0,0|1,0,0]=3 11978 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Br 207a_100000211769_100000743867 [0,2,0,0,0,0|2,0,0]=4 11979 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000211769_100016991755 [0,2,0,0,0,0|2,0,0]=4 11980 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Br 7a_100000211769_100000753453 [0,2,0,0,0,0|2,0,0]=4 11981 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Cl 207a_100000210418_100000743867 [0,2,0,0,0,0|2,0,0]=4 11982 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Cl 34a_100000210418_100016991755 [0,2,0,0,0,0|2,0,0]=4 11983 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)Cl 7a_100000210418_100000753453 [0,2,0,0,0,0|2,0,0]=4 11984 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)F 207a_100000211637_100000743867 [0,2,0,0,0,0|2,0,0]=4 11985 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)F 34a_100000211637_100016991755 [0,2,0,0,0,0|2,0,0]=4 11986 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)F 7a_100000211637_100000753453 [0,2,0,0,0,0|2,0,0]=4 11987 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)I 207a_100000184554_100000743867 [0,2,0,0,0,0|2,0,0]=4 11988 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)I 34a_100000184554_100016991755 [0,2,0,0,0,0|2,0,0]=4 11989 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)I 7a_100000184554_100000753453 [0,2,0,0,0,0|2,0,0]=4 11990 B16R2.3000 Cc1cc(ccc1NCc2ncc[nH]2)O 34a_100000756630_100016991755 [0,2,0,0,0,0|2,0,0]=4 11991 B16R2.3000 Cc1cc(ccc1NCc2ncco2)Br 34a_100000211769_103436540062 [0,2,0,0,0,0|2,0,0]=4 11992 B16R2.3000 Cc1cc(ccc1NCc2ncco2)Br 7a_100000211769_103436540062 [0,2,0,0,0,0|2,0,0]=4 11993 B16R2.3000 Cc1cc(ccc1NCc2ncco2)Cl 34a_100000210418_103436540062 [0,2,0,0,0,0|2,0,0]=4 11994 B16R2.3000 Cc1cc(ccc1NCc2ncco2)Cl 7a_100000210418_103436540062 [0,2,0,0,0,0|2,0,0]=4 11995 B16R2.3000 Cc1cc(ccc1NCc2ncco2)F 34a_100000211637_103436540062 [0,2,0,0,0,0|2,0,0]=4 11996 B16R2.3000 Cc1cc(ccc1NCc2ncco2)F 7a_100000211637_103436540062 [0,2,0,0,0,0|2,0,0]=4 11997 B16R2.3000 Cc1cc(ccc1NCc2ncco2)I 34a_100000184554_103436540062 [0,2,0,0,0,0|2,0,0]=4 11998 B16R2.3000 Cc1cc(ccc1NCc2ncco2)I 7a_100000184554_103436540062 [0,2,0,0,0,0|2,0,0]=4 11999 B16R2.3000 Cc1cc(ccc1NCc2ncco2)O 34a_100000756630_103436540062 [0,2,0,0,0,0|2,0,0]=4 12000 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Br 207a_100000211769_100000750902 [0,2,0,0,0,0|2,0,0]=4 12001 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Br 270302a_100000211769_100000750902 [0,2,0,0,0,0|2,0,0]=4 12002 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Br 34a_100000211769_100015184050 [0,2,0,0,0,0|2,0,0]=4 12003 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Br 7a_100000211769_100015184050 [0,2,0,0,0,0|2,0,0]=4 12004 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Cl 207a_100000210418_100000750902 [0,2,0,0,0,0|2,0,0]=4 12005 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Cl 270302a_100000210418_100000750902 [0,2,0,0,0,0|2,0,0]=4 12006 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Cl 34a_100000210418_100015184050 [0,2,0,0,0,0|2,0,0]=4 12007 B16R2.3000 Cc1cc(ccc1NCc2nccs2)Cl 7a_100000210418_100015184050 [0,2,0,0,0,0|2,0,0]=4 12008 B16R2.3000 Cc1cc(ccc1NCc2nccs2)F 207a_100000211637_100000750902 [0,2,0,0,0,0|2,0,0]=4 12009 B16R2.3000 Cc1cc(ccc1NCc2nccs2)F 270302a_100000211637_100000750902 [0,2,0,0,0,0|2,0,0]=4 12010 B16R2.3000 Cc1cc(ccc1NCc2nccs2)F 34a_100000211637_100015184050 [0,2,0,0,0,0|2,0,0]=4 12011 B16R2.3000 Cc1cc(ccc1NCc2nccs2)F 7a_100000211637_100015184050 [0,2,0,0,0,0|2,0,0]=4 12012 B16R2.3000 Cc1cc(ccc1NCc2nccs2)I 207a_100000184554_100000750902 [0,2,0,0,0,0|2,0,0]=4 12013 B16R2.3000 Cc1cc(ccc1NCc2nccs2)I 270302a_100000184554_100000750902 [0,2,0,0,0,0|2,0,0]=4 12014 B16R2.3000 Cc1cc(ccc1NCc2nccs2)I 34a_100000184554_100015184050 [0,2,0,0,0,0|2,0,0]=4 12015 B16R2.3000 Cc1cc(ccc1NCc2nccs2)I 7a_100000184554_100015184050 [0,2,0,0,0,0|2,0,0]=4 12016 B16R2.3000 Cc1cc(ccc1NCc2nccs2)O 270302a_100000756630_100000750902 [0,2,0,0,0,0|2,0,0]=4 12017 B16R2.3000 Cc1cc(ccc1NCc2nccs2)O 34a_100000756630_100015184050 [0,2,0,0,0,0|2,0,0]=4 12018 B16R2.3000 Cc1cc(ccc1NCc2ncon2)Br 34a_100000211769_100000233494 [0,2,0,0,0,0|2,0,0]=4 12019 B16R2.3000 Cc1cc(ccc1NCc2ncon2)Cl 34a_100000210418_100000233494 [0,2,0,0,0,0|2,0,0]=4 12020 B16R2.3000 Cc1cc(ccc1NCc2ncon2)F 34a_100000211637_100000233494 [0,2,0,0,0,0|2,0,0]=4 12021 B16R2.3000 Cc1cc(ccc1NCc2ncon2)I 34a_100000184554_100000233494 [0,2,0,0,0,0|2,0,0]=4 12022 B16R2.3000 Cc1cc(ccc1NCc2ncon2)O 34a_100000756630_100000233494 [0,2,0,0,0,0|2,0,0]=4 12023 B16R2.3000 Cc1cc(ccc1NCn2cncn2)Br 34a_100000211769_200020645497 [0,2,0,0,0,0|1,0,1]=4 12024 B16R2.3000 Cc1cc(ccc1NCn2cncn2)Br 7a_100000211769_200020645497 [0,2,0,0,0,0|1,0,1]=4 12025 B16R2.3000 Cc1cc(ccc1NCn2cncn2)Cl 34a_100000210418_200020645497 [0,2,0,0,0,0|1,0,1]=4 12026 B16R2.3000 Cc1cc(ccc1NCn2cncn2)Cl 7a_100000210418_200020645497 [0,2,0,0,0,0|1,0,1]=4 12027 B16R2.3000 Cc1cc(ccc1NCn2cncn2)F 34a_100000211637_200020645497 [0,2,0,0,0,0|1,0,1]=4 12028 B16R2.3000 Cc1cc(ccc1NCn2cncn2)F 7a_100000211637_200020645497 [0,2,0,0,0,0|1,0,1]=4 12029 B16R2.3000 Cc1cc(ccc1NCn2cncn2)I 34a_100000184554_200020645497 [0,2,0,0,0,0|1,0,1]=4 12030 B16R2.3000 Cc1cc(ccc1NCn2cncn2)I 7a_100000184554_200020645497 [0,2,0,0,0,0|1,0,1]=4 12031 B16R2.3000 Cc1cc(ccc1NCn2cncn2)O 34a_100000756630_200020645497 [0,2,0,0,0,0|1,0,1]=4 12032 B16R2.3000 Cc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000186361_100000707719 [0,2,0,0,0,0|1,0,0]=3 12033 B16R2.3000 Cc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100000211091_100000707719 [0,2,0,0,0,0|1,0,0]=3 12034 B16R2.3000 Cc1cc(ccc1OCc2c[nH]cn2)F 34a_100000764316_100000707719 [0,2,0,0,0,0|1,0,0]=3 12035 B16R2.3000 Cc1cc(ccc1OCc2c[nH]cn2)I 34a_100011218673_100000707719 [0,2,0,0,0,0|1,0,0]=3 12036 B16R2.3000 Cc1cc(ccc1OCc2c[nH]cn2)N 34a_100011218179_100000707719 [0,2,0,0,0,0|1,0,0]=3 12037 B16R2.3000 Cc1cc(ccc1OCc2cscn2)Br 34a_100000186361_100000205941 [0,2,0,0,0,0|2,0,0]=4 12038 B16R2.3000 Cc1cc(ccc1OCc2cscn2)Br 7a_100000186361_100000205941 [0,2,0,0,0,0|2,0,0]=4 12039 B16R2.3000 Cc1cc(ccc1OCc2cscn2)Cl 34a_100000211091_100000205941 [0,2,0,0,0,0|2,0,0]=4 12040 B16R2.3000 Cc1cc(ccc1OCc2cscn2)Cl 7a_100000211091_100000205941 [0,2,0,0,0,0|2,0,0]=4 12041 B16R2.3000 Cc1cc(ccc1OCc2cscn2)F 34a_100000764316_100000205941 [0,2,0,0,0,0|2,0,0]=4 12042 B16R2.3000 Cc1cc(ccc1OCc2cscn2)F 7a_100000764316_100000205941 [0,2,0,0,0,0|2,0,0]=4 12043 B16R2.3000 Cc1cc(ccc1OCc2cscn2)I 34a_100011218673_100000205941 [0,2,0,0,0,0|2,0,0]=4 12044 B16R2.3000 Cc1cc(ccc1OCc2cscn2)I 7a_100011218673_100000205941 [0,2,0,0,0,0|2,0,0]=4 12045 B16R2.3000 Cc1cc(ccc1OCc2cscn2)N 34a_100011218179_100000205941 [0,2,0,0,0,0|2,0,0]=4 12046 B16R2.3000 Cc1cc(ccc1OCc2cscn2)N 7a_100011218179_100000205941 [0,2,0,0,0,0|2,0,0]=4 12047 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000701812_100000707719 [0,2,0,0,0,0|1,0,0]=3 12048 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100000701812 [0,2,0,0,0,0|1,0,0]=3 12049 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100011219607 [0,2,0,0,0,0|1,0,0]=3 12050 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100011219607_100000707719 [0,2,0,0,0,0|1,0,0]=3 12051 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100011205405 [0,2,0,0,0,0|1,0,0]=3 12052 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)F 62a_100011205405_100000707719 [0,2,0,0,0,0|1,0,0]=3 12053 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)N 62a_100000210723_100000707719 [0,2,0,0,0,0|1,0,0]=3 12054 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)N 62a_100000707719_100000210723 [0,2,0,0,0,0|1,0,0]=3 12055 B16R2.3000 Cc1cc(ccc1SCc2c[nH]cn2)O 62a_100000707719_100000690111 [0,2,0,0,0,0|1,0,0]=3 12056 B16R2.3000 Cc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100000701812 [0,2,0,0,0,0|2,0,0]=4 12057 B16R2.3000 Cc1cc(ccc1SCc2cscn2)Br 62a_100000701812_100000205941 [0,2,0,0,0,0|2,0,0]=4 12058 B16R2.3000 Cc1cc(ccc1SCc2cscn2)Cl 62a_100000205941_100011219607 [0,2,0,0,0,0|2,0,0]=4 12059 B16R2.3000 Cc1cc(ccc1SCc2cscn2)Cl 62a_100011219607_100000205941 [0,2,0,0,0,0|2,0,0]=4 12060 B16R2.3000 Cc1cc(ccc1SCc2cscn2)F 62a_100000205941_100011205405 [0,2,0,0,0,0|2,0,0]=4 12061 B16R2.3000 Cc1cc(ccc1SCc2cscn2)F 62a_100011205405_100000205941 [0,2,0,0,0,0|2,0,0]=4 12062 B16R2.3000 Cc1cc(ccc1SCc2cscn2)N 62a_100000205941_100000210723 [0,2,0,0,0,0|2,0,0]=4 12063 B16R2.3000 Cc1cc(ccc1SCc2cscn2)N 62a_100000210723_100000205941 [0,2,0,0,0,0|2,0,0]=4 12064 B16R2.3000 Cc1cc(ccc1SCc2cscn2)O 62a_100000205941_100000690111 [0,2,0,0,0,0|2,0,0]=4 12065 B16R2.3000 Cc1cc(cnc1OCc2c[nH]cn2)Br 34a_100000685391_100000707719 [0,2,0,0,0,0|2,0,0]=4 12066 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)Br 62a_100000707719_100012353652 [0,2,0,0,0,0|2,0,0]=4 12067 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)Br 62a_100012353652_100000707719 [0,2,0,0,0,0|2,0,0]=4 12068 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)F 62a_100000707719_100009817009 [0,2,0,0,0,0|2,0,0]=4 12069 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)F 62a_100009817009_100000707719 [0,2,0,0,0,0|2,0,0]=4 12070 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)N 62a_100000707719_100000761747 [0,2,0,0,0,0|2,0,0]=4 12071 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)N 62a_100000761747_100000707719 [0,2,0,0,0,0|2,0,0]=4 12072 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)O 62a_100000707719_100012000486 [0,2,0,0,0,0|2,0,0]=4 12073 B16R2.3000 Cc1cc(cnc1SCc2c[nH]cn2)O 62a_100012000486_100000707719 [0,2,0,0,0,0|2,0,0]=4 12074 B16R2.3000 Cc1cc(ncc1OCc2c[nH]cn2)Cl 34a_100000692680_100000707719 [0,2,0,0,0,0|2,0,0]=4 12075 B16R2.3000 Cc1cc(ncc1OCc2c[nH]cn2)F 34a_100009856773_100000707719 [0,2,0,0,0,0|2,0,0]=4 12076 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)Br 62a_100000707719_100009816104 [0,2,0,0,0,0|2,0,0]=4 12077 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)Br 62a_100009816104_100000707719 [0,2,0,0,0,0|2,0,0]=4 12078 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100000707719_100010172789 [0,2,0,0,0,0|2,0,0]=4 12079 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100010172789_100000707719 [0,2,0,0,0,0|2,0,0]=4 12080 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)F 62a_100000707719_100009820716 [0,2,0,0,0,0|2,0,0]=4 12081 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)F 62a_100009820716_100000707719 [0,2,0,0,0,0|2,0,0]=4 12082 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)N 62a_100000050067_100000707719 [0,2,0,0,0,0|2,0,0]=4 12083 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)N 62a_100000707719_100000050067 [0,2,0,0,0,0|2,0,0]=4 12084 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)O 62a_100000707719_100000766222 [0,2,0,0,0,0|2,0,0]=4 12085 B16R2.3000 Cc1cc(ncc1SCc2c[nH]cn2)O 62a_100000766222_100000707719 [0,2,0,0,0,0|2,0,0]=4 12086 B16R2.3000 Cc1ccc([n+](c1)[O-])SCc2c[nH]cn2 62a_100000707719_100009819918 [0,2,0,0,0,0|2,0,0]=4 12087 B16R2.3000 Cc1ccc(c(c1)Br)NCc2c[nH]cn2 34a_100000210942_100000707719 [0,2,0,0,0,0|0,0,0]=2 12088 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ccco2 270302a_100000210942_100000186105 [0,2,0,0,0,0|2,0,0]=4 12089 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cccs2 270302a_100000210942_100000209959 [0,2,0,0,0,0|2,0,0]=4 12090 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ccon2 34a_100000210942_100000234950 [0,2,0,0,0,0|2,0,0]=4 12091 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ccsc2 270302a_100000210942_100000188534 [0,2,0,0,0,0|2,0,0]=4 12092 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ccsc2 34a_100000210942_100011261437 [0,2,0,0,0,0|2,0,0]=4 12093 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cn[nH]c2 270302a_100000210942_100016992096 [0,2,0,0,0,0|2,0,0]=4 12094 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cncs2 270302a_100000210942_100000749870 [0,2,0,0,0,0|1,0,1]=4 12095 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cncs2 34a_100000210942_100015185245 [0,2,0,0,0,0|1,0,1]=4 12096 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cscn2 270302a_100000210942_100000743575 [0,2,0,0,0,0|1,0,0]=3 12097 B16R2.3000 Cc1ccc(c(c1)Br)NCc2cscn2 34a_100000210942_100000205941 [0,2,0,0,0,0|1,0,0]=3 12098 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100000210942_100016991755 [0,2,0,0,0,0|2,0,0]=4 12099 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ncco2 34a_100000210942_103436540062 [0,2,0,0,0,0|2,0,0]=4 12100 B16R2.3000 Cc1ccc(c(c1)Br)NCc2nccs2 270302a_100000210942_100000750902 [0,2,0,0,0,0|2,0,0]=4 12101 B16R2.3000 Cc1ccc(c(c1)Br)NCc2nccs2 34a_100000210942_100015184050 [0,2,0,0,0,0|2,0,0]=4 12102 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ncon2 34a_100000210942_100000233494 [0,2,0,0,0,0|2,0,0]=4 12103 B16R2.3000 Cc1ccc(c(c1)Br)NCn2cncn2 34a_100000210942_200020645497 [0,2,0,0,0,0|1,0,1]=4 12104 B16R2.3000 Cc1ccc(c(c1)Br)OCc2c[nH]cn2 34a_100000210800_100000707719 [0,2,0,0,0,0|1,0,0]=3 12105 B16R2.3000 Cc1ccc(c(c1)Br)OCc2cscn2 34a_100000210800_100000205941 [0,2,0,0,0,0|2,0,0]=4 12106 B16R2.3000 Cc1ccc(c(c1)Br)OCc2cscn2 7a_100000210800_100000205941 [0,2,0,0,0,0|2,0,0]=4 12107 B16R2.3000 Cc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100009813563 [0,2,0,0,0,0|1,0,0]=3 12108 B16R2.3000 Cc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100009813563_100000707719 [0,2,0,0,0,0|1,0,0]=3 12109 B16R2.3000 Cc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100009813563 [0,2,0,0,0,0|2,0,0]=4 12110 B16R2.3000 Cc1ccc(c(c1)Br)SCc2cscn2 62a_100009813563_100000205941 [0,2,0,0,0,0|2,0,0]=4 12111 B16R2.3000 Cc1ccc(c(c1)C)CSc2c[nH]cn2 62a_100000756875_100011219618 [0,2,0,0,0,0|2,0,0]=4 12112 B16R2.3000 Cc1ccc(c(c1)C)CSc2c[nH]cn2 62a_100011219618_100000756875 [0,2,0,0,0,0|2,0,0]=4 12113 B16R2.3000 Cc1ccc(c(c1)C)NCc2c[nH]cn2 34a_100000736561_100000707719 [0,2,0,0,0,0|0,0,0]=2 12114 B16R2.3000 Cc1ccc(c(c1)C)NCc2cc[nH]n2 207a_100000736561_100000738523 [0,2,0,0,0,0|2,0,0]=4 12115 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccco2 207a_100000736561_100000186105 [0,2,0,0,0,0|2,0,0]=4 12116 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccco2 270302a_100000736561_100000186105 [0,2,0,0,0,0|2,0,0]=4 12117 B16R2.3000 Cc1ccc(c(c1)C)NCc2cccs2 207a_100000736561_100000209959 [0,2,0,0,0,0|2,0,0]=4 12118 B16R2.3000 Cc1ccc(c(c1)C)NCc2cccs2 270302a_100000736561_100000209959 [0,2,0,0,0,0|2,0,0]=4 12119 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccoc2 207a_100000736561_100011215517 [0,2,0,0,0,0|2,0,0]=4 12120 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccon2 34a_100000736561_100000234950 [0,2,0,0,0,0|2,0,0]=4 12121 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccon2 7a_100000736561_100000234950 [0,2,0,0,0,0|2,0,0]=4 12122 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccsc2 207a_100000736561_100000188534 [0,2,0,0,0,0|2,0,0]=4 12123 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccsc2 270302a_100000736561_100000188534 [0,2,0,0,0,0|2,0,0]=4 12124 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccsc2 34a_100000736561_100011261437 [0,2,0,0,0,0|2,0,0]=4 12125 B16R2.3000 Cc1ccc(c(c1)C)NCc2ccsc2 7a_100000736561_100011261437 [0,2,0,0,0,0|2,0,0]=4 12126 B16R2.3000 Cc1ccc(c(c1)C)NCc2cn[nH]c2 207a_100000736561_100016992096 [0,2,0,0,0,0|2,0,0]=4 12127 B16R2.3000 Cc1ccc(c(c1)C)NCc2cn[nH]c2 270302a_100000736561_100016992096 [0,2,0,0,0,0|2,0,0]=4 12128 B16R2.3000 Cc1ccc(c(c1)C)NCc2cnc[nH]2 207a_100000736561_100000742939 [0,2,0,0,0,0|0,0,2]=4 12129 B16R2.3000 Cc1ccc(c(c1)C)NCc2cncs2 207a_100000736561_100000749870 [0,2,0,0,0,0|1,0,1]=4 12130 B16R2.3000 Cc1ccc(c(c1)C)NCc2cncs2 270302a_100000736561_100000749870 [0,2,0,0,0,0|1,0,1]=4 12131 B16R2.3000 Cc1ccc(c(c1)C)NCc2cncs2 34a_100000736561_100015185245 [0,2,0,0,0,0|1,0,1]=4 12132 B16R2.3000 Cc1ccc(c(c1)C)NCc2cncs2 7a_100000736561_100015185245 [0,2,0,0,0,0|1,0,1]=4 12133 B16R2.3000 Cc1ccc(c(c1)C)NCc2cscn2 207a_100000736561_100000743575 [0,2,0,0,0,0|1,0,0]=3 12134 B16R2.3000 Cc1ccc(c(c1)C)NCc2cscn2 270302a_100000736561_100000743575 [0,2,0,0,0,0|1,0,0]=3 12135 B16R2.3000 Cc1ccc(c(c1)C)NCc2cscn2 34a_100000736561_100000205941 [0,2,0,0,0,0|1,0,0]=3 12136 B16R2.3000 Cc1ccc(c(c1)C)NCc2cscn2 7a_100000736561_100000205941 [0,2,0,0,0,0|1,0,0]=3 12137 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 207a_100000736561_100000743867 [0,2,0,0,0,0|2,0,0]=4 12138 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 34a_100000736561_100016991755 [0,2,0,0,0,0|2,0,0]=4 12139 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 7a_100000736561_100000753453 [0,2,0,0,0,0|2,0,0]=4 12140 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncco2 34a_100000736561_103436540062 [0,2,0,0,0,0|2,0,0]=4 12141 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncco2 7a_100000736561_103436540062 [0,2,0,0,0,0|2,0,0]=4 12142 B16R2.3000 Cc1ccc(c(c1)C)NCc2nccs2 207a_100000736561_100000750902 [0,2,0,0,0,0|2,0,0]=4 12143 B16R2.3000 Cc1ccc(c(c1)C)NCc2nccs2 270302a_100000736561_100000750902 [0,2,0,0,0,0|2,0,0]=4 12144 B16R2.3000 Cc1ccc(c(c1)C)NCc2nccs2 34a_100000736561_100015184050 [0,2,0,0,0,0|2,0,0]=4 12145 B16R2.3000 Cc1ccc(c(c1)C)NCc2nccs2 7a_100000736561_100015184050 [0,2,0,0,0,0|2,0,0]=4 12146 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncon2 34a_100000736561_100000233494 [0,2,0,0,0,0|2,0,0]=4 12147 B16R2.3000 Cc1ccc(c(c1)C)NCn2cncn2 34a_100000736561_200020645497 [0,2,0,0,0,0|1,0,1]=4 12148 B16R2.3000 Cc1ccc(c(c1)C)NCn2cncn2 7a_100000736561_200020645497 [0,2,0,0,0,0|1,0,1]=4 12149 B16R2.3000 Cc1ccc(c(c1)C)OCc2c[nH]cn2 34a_100000211776_100000707719 [0,2,0,0,0,0|1,0,0]=3 12150 B16R2.3000 Cc1ccc(c(c1)C)OCc2cscn2 34a_100000211776_100000205941 [0,2,0,0,0,0|2,0,0]=4 12151 B16R2.3000 Cc1ccc(c(c1)C)OCc2cscn2 7a_100000211776_100000205941 [0,2,0,0,0,0|2,0,0]=4 12152 B16R2.3000 Cc1ccc(c(c1)C)SCc2c[nH]cn2 62a_100000707719_100011217332 [0,2,0,0,0,0|1,0,0]=3 12153 B16R2.3000 Cc1ccc(c(c1)C)SCc2c[nH]cn2 62a_100011217332_100000707719 [0,2,0,0,0,0|1,0,0]=3 12154 B16R2.3000 Cc1ccc(c(c1)C)SCc2cscn2 62a_100000205941_100011217332 [0,2,0,0,0,0|2,0,0]=4 12155 B16R2.3000 Cc1ccc(c(c1)C)SCc2cscn2 62a_100011217332_100000205941 [0,2,0,0,0,0|2,0,0]=4 12156 B16R2.3000 Cc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100000756875_100012349684 [0,2,0,0,0,0|2,0,0]=4 12157 B16R2.3000 Cc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100012349684_100000756875 [0,2,0,0,0,0|2,0,0]=4 12158 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2c[nH]cn2 34a_100000210522_100000707719 [0,2,0,0,0,0|0,0,0]=2 12159 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccco2 270302a_100000210522_100000186105 [0,2,0,0,0,0|2,0,0]=4 12160 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cccs2 270302a_100000210522_100000209959 [0,2,0,0,0,0|2,0,0]=4 12161 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccon2 34a_100000210522_100000234950 [0,2,0,0,0,0|2,0,0]=4 12162 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccsc2 270302a_100000210522_100000188534 [0,2,0,0,0,0|2,0,0]=4 12163 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccsc2 34a_100000210522_100011261437 [0,2,0,0,0,0|2,0,0]=4 12164 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cn[nH]c2 270302a_100000210522_100016992096 [0,2,0,0,0,0|2,0,0]=4 12165 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cncs2 270302a_100000210522_100000749870 [0,2,0,0,0,0|1,0,1]=4 12166 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cncs2 34a_100000210522_100015185245 [0,2,0,0,0,0|1,0,1]=4 12167 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cscn2 270302a_100000210522_100000743575 [0,2,0,0,0,0|1,0,0]=3 12168 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cscn2 34a_100000210522_100000205941 [0,2,0,0,0,0|1,0,0]=3 12169 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000210522_100016991755 [0,2,0,0,0,0|2,0,0]=4 12170 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncco2 34a_100000210522_103436540062 [0,2,0,0,0,0|2,0,0]=4 12171 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2nccs2 270302a_100000210522_100000750902 [0,2,0,0,0,0|2,0,0]=4 12172 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2nccs2 34a_100000210522_100015184050 [0,2,0,0,0,0|2,0,0]=4 12173 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncon2 34a_100000210522_100000233494 [0,2,0,0,0,0|2,0,0]=4 12174 B16R2.3000 Cc1ccc(c(c1)Cl)NCn2cncn2 34a_100000210522_200020645497 [0,2,0,0,0,0|1,0,1]=4 12175 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2c[nH]cn2 34a_100000749699_100000707719 [0,2,0,0,0,0|1,0,0]=3 12176 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2cscn2 34a_100000749699_100000205941 [0,2,0,0,0,0|2,0,0]=4 12177 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2cscn2 7a_100000749699_100000205941 [0,2,0,0,0,0|2,0,0]=4 12178 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000707719_100011263221 [0,2,0,0,0,0|1,0,0]=3 12179 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100011263221_100000707719 [0,2,0,0,0,0|1,0,0]=3 12180 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2cscn2 62a_100000205941_100011263221 [0,2,0,0,0,0|2,0,0]=4 12181 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2cscn2 62a_100011263221_100000205941 [0,2,0,0,0,0|2,0,0]=4 12182 B16R2.3000 Cc1ccc(c(c1)F)CSc2c[nH]cn2 62a_100000756875_100011217900 [0,2,0,0,0,0|2,0,0]=4 12183 B16R2.3000 Cc1ccc(c(c1)F)CSc2c[nH]cn2 62a_100011217900_100000756875 [0,2,0,0,0,0|2,0,0]=4 12184 B16R2.3000 Cc1ccc(c(c1)F)NCc2c[nH]cn2 34a_100000211023_100000707719 [0,2,0,0,0,0|0,0,0]=2 12185 B16R2.3000 Cc1ccc(c(c1)F)NCc2cc[nH]n2 207a_100000211023_100000738523 [0,2,0,0,0,0|2,0,0]=4 12186 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccco2 207a_100000211023_100000186105 [0,2,0,0,0,0|2,0,0]=4 12187 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccco2 270302a_100000211023_100000186105 [0,2,0,0,0,0|2,0,0]=4 12188 B16R2.3000 Cc1ccc(c(c1)F)NCc2cccs2 207a_100000211023_100000209959 [0,2,0,0,0,0|2,0,0]=4 12189 B16R2.3000 Cc1ccc(c(c1)F)NCc2cccs2 270302a_100000211023_100000209959 [0,2,0,0,0,0|2,0,0]=4 12190 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccoc2 207a_100000211023_100011215517 [0,2,0,0,0,0|2,0,0]=4 12191 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccon2 34a_100000211023_100000234950 [0,2,0,0,0,0|2,0,0]=4 12192 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccsc2 207a_100000211023_100000188534 [0,2,0,0,0,0|2,0,0]=4 12193 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccsc2 270302a_100000211023_100000188534 [0,2,0,0,0,0|2,0,0]=4 12194 B16R2.3000 Cc1ccc(c(c1)F)NCc2ccsc2 34a_100000211023_100011261437 [0,2,0,0,0,0|2,0,0]=4 12195 B16R2.3000 Cc1ccc(c(c1)F)NCc2cn[nH]c2 207a_100000211023_100016992096 [0,2,0,0,0,0|2,0,0]=4 12196 B16R2.3000 Cc1ccc(c(c1)F)NCc2cn[nH]c2 270302a_100000211023_100016992096 [0,2,0,0,0,0|2,0,0]=4 12197 B16R2.3000 Cc1ccc(c(c1)F)NCc2cnc[nH]2 207a_100000211023_100000742939 [0,2,0,0,0,0|0,0,2]=4 12198 B16R2.3000 Cc1ccc(c(c1)F)NCc2cncs2 207a_100000211023_100000749870 [0,2,0,0,0,0|1,0,1]=4 12199 B16R2.3000 Cc1ccc(c(c1)F)NCc2cncs2 270302a_100000211023_100000749870 [0,2,0,0,0,0|1,0,1]=4 12200 B16R2.3000 Cc1ccc(c(c1)F)NCc2cncs2 34a_100000211023_100015185245 [0,2,0,0,0,0|1,0,1]=4 12201 B16R2.3000 Cc1ccc(c(c1)F)NCc2cscn2 207a_100000211023_100000743575 [0,2,0,0,0,0|1,0,0]=3 12202 B16R2.3000 Cc1ccc(c(c1)F)NCc2cscn2 270302a_100000211023_100000743575 [0,2,0,0,0,0|1,0,0]=3 12203 B16R2.3000 Cc1ccc(c(c1)F)NCc2cscn2 34a_100000211023_100000205941 [0,2,0,0,0,0|1,0,0]=3 12204 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncc[nH]2 207a_100000211023_100000743867 [0,2,0,0,0,0|2,0,0]=4 12205 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncc[nH]2 34a_100000211023_100016991755 [0,2,0,0,0,0|2,0,0]=4 12206 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncco2 34a_100000211023_103436540062 [0,2,0,0,0,0|2,0,0]=4 12207 B16R2.3000 Cc1ccc(c(c1)F)NCc2nccs2 207a_100000211023_100000750902 [0,2,0,0,0,0|2,0,0]=4 12208 B16R2.3000 Cc1ccc(c(c1)F)NCc2nccs2 270302a_100000211023_100000750902 [0,2,0,0,0,0|2,0,0]=4 12209 B16R2.3000 Cc1ccc(c(c1)F)NCc2nccs2 34a_100000211023_100015184050 [0,2,0,0,0,0|2,0,0]=4 12210 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncon2 34a_100000211023_100000233494 [0,2,0,0,0,0|2,0,0]=4 12211 B16R2.3000 Cc1ccc(c(c1)F)NCn2cncn2 34a_100000211023_200020645497 [0,2,0,0,0,0|1,0,1]=4 12212 B16R2.3000 Cc1ccc(c(c1)F)OCc2c[nH]cn2 34a_100011216688_100000707719 [0,2,0,0,0,0|1,0,0]=3 12213 B16R2.3000 Cc1ccc(c(c1)F)OCc2cscn2 34a_100011216688_100000205941 [0,2,0,0,0,0|2,0,0]=4 12214 B16R2.3000 Cc1ccc(c(c1)F)OCc2cscn2 7a_100011216688_100000205941 [0,2,0,0,0,0|2,0,0]=4 12215 B16R2.3000 Cc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100011216119 [0,2,0,0,0,0|1,0,0]=3 12216 B16R2.3000 Cc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100011216119_100000707719 [0,2,0,0,0,0|1,0,0]=3 12217 B16R2.3000 Cc1ccc(c(c1)F)SCc2cscn2 62a_100000205941_100011216119 [0,2,0,0,0,0|2,0,0]=4 12218 B16R2.3000 Cc1ccc(c(c1)F)SCc2cscn2 62a_100011216119_100000205941 [0,2,0,0,0,0|2,0,0]=4 12219 B16R2.3000 Cc1ccc(c(c1)I)NCc2c[nH]cn2 34a_100011356834_100000707719 [0,2,0,0,0,0|0,0,0]=2 12220 B16R2.3000 Cc1ccc(c(c1)I)NCc2ccco2 270302a_100011356834_100000186105 [0,2,0,0,0,0|2,0,0]=4 12221 B16R2.3000 Cc1ccc(c(c1)I)NCc2cccs2 270302a_100011356834_100000209959 [0,2,0,0,0,0|2,0,0]=4 12222 B16R2.3000 Cc1ccc(c(c1)I)NCc2ccon2 34a_100011356834_100000234950 [0,2,0,0,0,0|2,0,0]=4 12223 B16R2.3000 Cc1ccc(c(c1)I)NCc2ccsc2 270302a_100011356834_100000188534 [0,2,0,0,0,0|2,0,0]=4 12224 B16R2.3000 Cc1ccc(c(c1)I)NCc2ccsc2 34a_100011356834_100011261437 [0,2,0,0,0,0|2,0,0]=4 12225 B16R2.3000 Cc1ccc(c(c1)I)NCc2cn[nH]c2 270302a_100011356834_100016992096 [0,2,0,0,0,0|2,0,0]=4 12226 B16R2.3000 Cc1ccc(c(c1)I)NCc2cncs2 270302a_100011356834_100000749870 [0,2,0,0,0,0|1,0,1]=4 12227 B16R2.3000 Cc1ccc(c(c1)I)NCc2cncs2 34a_100011356834_100015185245 [0,2,0,0,0,0|1,0,1]=4 12228 B16R2.3000 Cc1ccc(c(c1)I)NCc2cscn2 270302a_100011356834_100000743575 [0,2,0,0,0,0|1,0,0]=3 12229 B16R2.3000 Cc1ccc(c(c1)I)NCc2cscn2 34a_100011356834_100000205941 [0,2,0,0,0,0|1,0,0]=3 12230 B16R2.3000 Cc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100011356834_100016991755 [0,2,0,0,0,0|2,0,0]=4 12231 B16R2.3000 Cc1ccc(c(c1)I)NCc2ncco2 34a_100011356834_103436540062 [0,2,0,0,0,0|2,0,0]=4 12232 B16R2.3000 Cc1ccc(c(c1)I)NCc2nccs2 270302a_100011356834_100000750902 [0,2,0,0,0,0|2,0,0]=4 12233 B16R2.3000 Cc1ccc(c(c1)I)NCc2nccs2 34a_100011356834_100015184050 [0,2,0,0,0,0|2,0,0]=4 12234 B16R2.3000 Cc1ccc(c(c1)I)NCc2ncon2 34a_100011356834_100000233494 [0,2,0,0,0,0|2,0,0]=4 12235 B16R2.3000 Cc1ccc(c(c1)I)NCn2cncn2 34a_100011356834_200020645497 [0,2,0,0,0,0|1,0,1]=4 12236 B16R2.3000 Cc1ccc(c(c1)I)OCc2c[nH]cn2 34a_100000765521_100000707719 [0,2,0,0,0,0|1,0,0]=3 12237 B16R2.3000 Cc1ccc(c(c1)I)OCc2cscn2 34a_100000765521_100000205941 [0,2,0,0,0,0|2,0,0]=4 12238 B16R2.3000 Cc1ccc(c(c1)I)OCc2cscn2 7a_100000765521_100000205941 [0,2,0,0,0,0|2,0,0]=4 12239 B16R2.3000 Cc1ccc(c(c1)N)OCc2c[nH]cn2 34a_100011215204_100000707719 [0,2,0,0,0,0|1,0,0]=3 12240 B16R2.3000 Cc1ccc(c(c1)N)OCc2cscn2 34a_100011215204_100000205941 [0,2,0,0,0,0|2,0,0]=4 12241 B16R2.3000 Cc1ccc(c(c1)N)OCc2cscn2 7a_100011215204_100000205941 [0,2,0,0,0,0|2,0,0]=4 12242 B16R2.3000 Cc1ccc(c(c1)N)SCc2c[nH]cn2 62a_100000707719_100011216686 [0,2,0,0,0,0|1,0,0]=3 12243 B16R2.3000 Cc1ccc(c(c1)N)SCc2c[nH]cn2 62a_100011216686_100000707719 [0,2,0,0,0,0|1,0,0]=3 12244 B16R2.3000 Cc1ccc(c(c1)N)SCc2cscn2 62a_100000205941_100011216686 [0,2,0,0,0,0|2,0,0]=4 12245 B16R2.3000 Cc1ccc(c(c1)N)SCc2cscn2 62a_100011216686_100000205941 [0,2,0,0,0,0|2,0,0]=4 12246 B16R2.3000 Cc1ccc(c(c1)O)NCc2c[nH]cn2 34a_100000211527_100000707719 [0,2,0,0,0,0|0,0,0]=2 12247 B16R2.3000 Cc1ccc(c(c1)O)NCc2ccon2 34a_100000211527_100000234950 [0,2,0,0,0,0|2,0,0]=4 12248 B16R2.3000 Cc1ccc(c(c1)O)NCc2ccsc2 34a_100000211527_100011261437 [0,2,0,0,0,0|2,0,0]=4 12249 B16R2.3000 Cc1ccc(c(c1)O)NCc2cncs2 34a_100000211527_100015185245 [0,2,0,0,0,0|1,0,1]=4 12250 B16R2.3000 Cc1ccc(c(c1)O)NCc2cscn2 34a_100000211527_100000205941 [0,2,0,0,0,0|1,0,0]=3 12251 B16R2.3000 Cc1ccc(c(c1)O)NCc2ncc[nH]2 34a_100000211527_100016991755 [0,2,0,0,0,0|2,0,0]=4 12252 B16R2.3000 Cc1ccc(c(c1)O)NCc2ncco2 34a_100000211527_103436540062 [0,2,0,0,0,0|2,0,0]=4 12253 B16R2.3000 Cc1ccc(c(c1)O)NCc2nccs2 34a_100000211527_100015184050 [0,2,0,0,0,0|2,0,0]=4 12254 B16R2.3000 Cc1ccc(c(c1)O)NCc2ncon2 34a_100000211527_100000233494 [0,2,0,0,0,0|2,0,0]=4 12255 B16R2.3000 Cc1ccc(c(c1)O)NCn2cncn2 34a_100000211527_200020645497 [0,2,0,0,0,0|1,0,1]=4 12256 B16R2.3000 Cc1ccc(c(c1)O)SCc2c[nH]cn2 62a_100000707719_100012002257 [0,2,0,0,0,0|1,0,0]=3 12257 B16R2.3000 Cc1ccc(c(c1)O)SCc2c[nH]cn2 62a_100012002257_100000707719 [0,2,0,0,0,0|1,0,0]=3 12258 B16R2.3000 Cc1ccc(c(c1)O)SCc2cscn2 62a_100000205941_100012002257 [0,2,0,0,0,0|2,0,0]=4 12259 B16R2.3000 Cc1ccc(c(c1)O)SCc2cscn2 62a_100012002257_100000205941 [0,2,0,0,0,0|2,0,0]=4 12260 B16R2.3000 Cc1ccc(c(n1)Br)OCc2c[nH]cn2 34a_100000702858_100000707719 [0,2,0,0,0,0|2,0,0]=4 12261 B16R2.3000 Cc1ccc(c(n1)C)OCc2c[nH]cn2 34a_100011218912_100000707719 [0,2,0,0,0,0|2,0,0]=4 12262 B16R2.3000 Cc1ccc(c(n1)C)SCc2c[nH]cn2 62a_100000707719_100009813853 [0,2,0,0,0,0|2,0,0]=4 12263 B16R2.3000 Cc1ccc(c(n1)C)SCc2c[nH]cn2 62a_100009813853_100000707719 [0,2,0,0,0,0|2,0,0]=4 12264 B16R2.3000 Cc1ccc(c(n1)Cl)OCc2c[nH]cn2 34a_100000086286_100000707719 [0,2,0,0,0,0|2,0,0]=4 12265 B16R2.3000 Cc1ccc(c(n1)F)OCc2c[nH]cn2 34a_100000079963_100000707719 [0,2,0,0,0,0|2,0,0]=4 12266 B16R2.3000 Cc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100000707719_100010006597 [0,2,0,0,0,0|2,0,0]=4 12267 B16R2.3000 Cc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100010006597_100000707719 [0,2,0,0,0,0|2,0,0]=4 12268 B16R2.3000 Cc1ccc(c(n1)I)OCc2c[nH]cn2 34a_100000023897_100000707719 [0,2,0,0,0,0|2,0,0]=4 12269 B16R2.3000 Cc1ccc(c(n1)N)OCc2c[nH]cn2 34a_100000694039_100000707719 [0,2,0,0,0,0|2,0,0]=4 12270 B16R2.3000 Cc1ccc(c(n1)N)SCc2c[nH]cn2 62a_100000707719_100009816662 [0,2,0,0,0,0|2,0,0]=4 12271 B16R2.3000 Cc1ccc(c(n1)N)SCc2c[nH]cn2 62a_100009816662_100000707719 [0,2,0,0,0,0|2,0,0]=4 12272 B16R2.3000 Cc1ccc(c(n1)O)SCc2c[nH]cn2 62a_100000707719_100009817604 [0,2,0,0,0,0|2,0,0]=4 12273 B16R2.3000 Cc1ccc(c(n1)O)SCc2c[nH]cn2 62a_100009817604_100000707719 [0,2,0,0,0,0|2,0,0]=4 12274 B16R2.3000 Cc1cnc(c(c1)Br)OCc2c[nH]cn2 34a_100000719714_100000707719 [0,2,0,0,0,0|2,0,0]=4 12275 B16R2.3000 Cc1cnc(c(c1)C)SCc2c[nH]cn2 62a_100000707719_100009864548 [0,2,0,0,0,0|2,0,0]=4 12276 B16R2.3000 Cc1cnc(c(c1)C)SCc2c[nH]cn2 62a_100009864548_100000707719 [0,2,0,0,0,0|2,0,0]=4 12277 B16R2.3000 Cc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100009819633 [0,2,0,0,0,0|2,0,0]=4 12278 B16R2.3000 Cc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100009819633_100000707719 [0,2,0,0,0,0|2,0,0]=4 12279 B16R2.3000 Cc1cnc(c(c1)N)OCc2c[nH]cn2 34a_100012000488_100000707719 [0,2,0,0,0,0|2,0,0]=4 12280 B16R2.3000 Cc1cnc(c(c1)N)SCc2c[nH]cn2 62a_100000707719_100000733613 [0,2,0,0,0,0|2,0,0]=4 12281 B16R2.3000 Cc1cnc(c(c1)N)SCc2c[nH]cn2 62a_100000733613_100000707719 [0,2,0,0,0,0|2,0,0]=4 12282 B16R2.3000 Cc1cnc(c(c1)O)SCc2c[nH]cn2 62a_100000707719_100012000487 [0,2,0,0,0,0|2,0,0]=4 12283 B16R2.3000 Cc1nc(ccc1OCc2c[nH]cn2)Br 34a_100012002022_100000707719 [0,2,0,0,0,0|2,0,0]=4 12284 B16R2.3000 Cc1nc(ccc1OCc2c[nH]cn2)Cl 34a_100012184626_100000707719 [0,2,0,0,0,0|2,0,0]=4 12285 B16R2.3000 Cc1nc(ccc1OCc2c[nH]cn2)F 34a_100009881036_100000707719 [0,2,0,0,0,0|2,0,0]=4 12286 B16R2.3000 Cc1nc(ccc1OCc2c[nH]cn2)I 34a_100010233687_100000707719 [0,2,0,0,0,0|2,0,0]=4 12287 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100000062408_100000707719 [0,2,0,0,0,0|2,0,0]=4 12288 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100000062408 [0,2,0,0,0,0|2,0,0]=4 12289 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)F 62a_100000688911_100000707719 [0,2,0,0,0,0|2,0,0]=4 12290 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100000688911 [0,2,0,0,0,0|2,0,0]=4 12291 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)N 62a_100000187202_100000707719 [0,2,0,0,0,0|2,0,0]=4 12292 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)N 62a_100000707719_100000187202 [0,2,0,0,0,0|2,0,0]=4 12293 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)O 62a_100000691680_100000707719 [0,2,0,0,0,0|2,0,0]=4 12294 B16R2.3000 Cc1nc(ccc1SCc2c[nH]cn2)O 62a_100000707719_100000691680 [0,2,0,0,0,0|2,0,0]=4 12295 B16R2.3000 Clc1cc(c(cn1)OCc2c[nH]cn2)Cl 34a_100009868576_100000707719 [0,2,0,0,0,0|2,0,0]=4 12296 B16R2.3000 Clc1cc(c(cn1)OCc2c[nH]cn2)I 34a_100000698892_100000707719 [0,2,0,0,0,0|2,0,0]=4 12297 B16R2.3000 Clc1cc(c(cn1)SCc2c[nH]cn2)Cl 62a_100000707719_100010200927 [0,2,0,0,0,0|2,0,0]=4 12298 B16R2.3000 Clc1cc(c(cn1)SCc2c[nH]cn2)Cl 62a_100010200927_100000707719 [0,2,0,0,0,0|2,0,0]=4 12299 B16R2.3000 Clc1cc(ccc1CSc2c[nH]cn2)Br 62a_100000756875_100011740631 [0,2,0,0,0,0|2,0,0]=4 12300 B16R2.3000 Clc1cc(ccc1CSc2c[nH]cn2)Br 62a_100011740631_100000756875 [0,2,0,0,0,0|2,0,0]=4 12301 B16R2.3000 Clc1cc(ccc1NCc2c[nH]cn2)Br 34a_100000211467_100000707719 [0,2,0,0,0,0|0,0,0]=2 12302 B16R2.3000 Clc1cc(ccc1NCc2c[nH]cn2)I 34a_100011218065_100000707719 [0,2,0,0,0,0|0,0,0]=2 12303 B16R2.3000 Clc1cc(ccc1NCc2ccco2)Br 270302a_100000211467_100000186105 [0,2,0,0,0,0|2,0,0]=4 12304 B16R2.3000 Clc1cc(ccc1NCc2ccco2)I 270302a_100011218065_100000186105 [0,2,0,0,0,0|2,0,0]=4 12305 B16R2.3000 Clc1cc(ccc1NCc2cccs2)Br 270302a_100000211467_100000209959 [0,2,0,0,0,0|2,0,0]=4 12306 B16R2.3000 Clc1cc(ccc1NCc2cccs2)I 270302a_100011218065_100000209959 [0,2,0,0,0,0|2,0,0]=4 12307 B16R2.3000 Clc1cc(ccc1NCc2ccon2)Br 34a_100000211467_100000234950 [0,2,0,0,0,0|2,0,0]=4 12308 B16R2.3000 Clc1cc(ccc1NCc2ccon2)I 34a_100011218065_100000234950 [0,2,0,0,0,0|2,0,0]=4 12309 B16R2.3000 Clc1cc(ccc1NCc2ccsc2)Br 270302a_100000211467_100000188534 [0,2,0,0,0,0|2,0,0]=4 12310 B16R2.3000 Clc1cc(ccc1NCc2ccsc2)Br 34a_100000211467_100011261437 [0,2,0,0,0,0|2,0,0]=4 12311 B16R2.3000 Clc1cc(ccc1NCc2ccsc2)I 270302a_100011218065_100000188534 [0,2,0,0,0,0|2,0,0]=4 12312 B16R2.3000 Clc1cc(ccc1NCc2ccsc2)I 34a_100011218065_100011261437 [0,2,0,0,0,0|2,0,0]=4 12313 B16R2.3000 Clc1cc(ccc1NCc2cn[nH]c2)Br 270302a_100000211467_100016992096 [0,2,0,0,0,0|2,0,0]=4 12314 B16R2.3000 Clc1cc(ccc1NCc2cn[nH]c2)I 270302a_100011218065_100016992096 [0,2,0,0,0,0|2,0,0]=4 12315 B16R2.3000 Clc1cc(ccc1NCc2cncs2)Br 270302a_100000211467_100000749870 [0,2,0,0,0,0|1,0,1]=4 12316 B16R2.3000 Clc1cc(ccc1NCc2cncs2)Br 34a_100000211467_100015185245 [0,2,0,0,0,0|1,0,1]=4 12317 B16R2.3000 Clc1cc(ccc1NCc2cncs2)I 270302a_100011218065_100000749870 [0,2,0,0,0,0|1,0,1]=4 12318 B16R2.3000 Clc1cc(ccc1NCc2cncs2)I 34a_100011218065_100015185245 [0,2,0,0,0,0|1,0,1]=4 12319 B16R2.3000 Clc1cc(ccc1NCc2cscn2)Br 270302a_100000211467_100000743575 [0,2,0,0,0,0|1,0,0]=3 12320 B16R2.3000 Clc1cc(ccc1NCc2cscn2)Br 34a_100000211467_100000205941 [0,2,0,0,0,0|1,0,0]=3 12321 B16R2.3000 Clc1cc(ccc1NCc2cscn2)I 270302a_100011218065_100000743575 [0,2,0,0,0,0|1,0,0]=3 12322 B16R2.3000 Clc1cc(ccc1NCc2cscn2)I 34a_100011218065_100000205941 [0,2,0,0,0,0|1,0,0]=3 12323 B16R2.3000 Clc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000211467_100016991755 [0,2,0,0,0,0|2,0,0]=4 12324 B16R2.3000 Clc1cc(ccc1NCc2ncc[nH]2)I 34a_100011218065_100016991755 [0,2,0,0,0,0|2,0,0]=4 12325 B16R2.3000 Clc1cc(ccc1NCc2ncco2)Br 34a_100000211467_103436540062 [0,2,0,0,0,0|2,0,0]=4 12326 B16R2.3000 Clc1cc(ccc1NCc2ncco2)I 34a_100011218065_103436540062 [0,2,0,0,0,0|2,0,0]=4 12327 B16R2.3000 Clc1cc(ccc1NCc2nccs2)Br 270302a_100000211467_100000750902 [0,2,0,0,0,0|2,0,0]=4 12328 B16R2.3000 Clc1cc(ccc1NCc2nccs2)Br 34a_100000211467_100015184050 [0,2,0,0,0,0|2,0,0]=4 12329 B16R2.3000 Clc1cc(ccc1NCc2nccs2)I 270302a_100011218065_100000750902 [0,2,0,0,0,0|2,0,0]=4 12330 B16R2.3000 Clc1cc(ccc1NCc2nccs2)I 34a_100011218065_100015184050 [0,2,0,0,0,0|2,0,0]=4 12331 B16R2.3000 Clc1cc(ccc1NCc2ncon2)Br 34a_100000211467_100000233494 [0,2,0,0,0,0|2,0,0]=4 12332 B16R2.3000 Clc1cc(ccc1NCc2ncon2)I 34a_100011218065_100000233494 [0,2,0,0,0,0|2,0,0]=4 12333 B16R2.3000 Clc1cc(ccc1NCn2cncn2)Br 34a_100000211467_200020645497 [0,2,0,0,0,0|1,0,1]=4 12334 B16R2.3000 Clc1cc(ccc1NCn2cncn2)I 34a_100011218065_200020645497 [0,2,0,0,0,0|1,0,1]=4 12335 B16R2.3000 Clc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000186472_100000707719 [0,2,0,0,0,0|1,0,0]=3 12336 B16R2.3000 Clc1cc(ccc1OCc2c[nH]cn2)I 34a_100012360047_100000707719 [0,2,0,0,0,0|1,0,0]=3 12337 B16R2.3000 Clc1cc(ccc1OCc2cscn2)Br 34a_100000186472_100000205941 [0,2,0,0,0,0|2,0,0]=4 12338 B16R2.3000 Clc1cc(ccc1OCc2cscn2)Br 7a_100000186472_100000205941 [0,2,0,0,0,0|2,0,0]=4 12339 B16R2.3000 Clc1cc(ccc1OCc2cscn2)I 34a_100012360047_100000205941 [0,2,0,0,0,0|2,0,0]=4 12340 B16R2.3000 Clc1cc(ccc1OCc2cscn2)I 7a_100012360047_100000205941 [0,2,0,0,0,0|2,0,0]=4 12341 B16R2.3000 Clc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100011216062 [0,2,0,0,0,0|1,0,0]=3 12342 B16R2.3000 Clc1cc(ccc1SCc2c[nH]cn2)Br 62a_100011216062_100000707719 [0,2,0,0,0,0|1,0,0]=3 12343 B16R2.3000 Clc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100011216062 [0,2,0,0,0,0|2,0,0]=4 12344 B16R2.3000 Clc1cc(ccc1SCc2cscn2)Br 62a_100011216062_100000205941 [0,2,0,0,0,0|2,0,0]=4 12345 B16R2.3000 Clc1cc(cnc1OCc2c[nH]cn2)Br 34a_100012339560_100000707719 [0,2,0,0,0,0|2,0,0]=4 12346 B16R2.3000 Clc1cc(ncc1SCc2c[nH]cn2)Br 62a_100000707719_100010381092 [0,2,0,0,0,0|2,0,0]=4 12347 B16R2.3000 Clc1cc(ncc1SCc2c[nH]cn2)Br 62a_100010381092_100000707719 [0,2,0,0,0,0|2,0,0]=4 12348 B16R2.3000 Clc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_100000755608_100000756875 [0,2,0,0,0,0|2,0,0]=4 12349 B16R2.3000 Clc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_100000756875_100000755608 [0,2,0,0,0,0|2,0,0]=4 12350 B16R2.3000 Clc1ccc(c(c1)Br)NCc2c[nH]cn2 34a_100000752454_100000707719 [0,2,0,0,0,0|0,0,0]=2 12351 B16R2.3000 Clc1ccc(c(c1)Br)NCc2ccon2 34a_100000752454_100000234950 [0,2,0,0,0,0|2,0,0]=4 12352 B16R2.3000 Clc1ccc(c(c1)Br)NCc2ccsc2 34a_100000752454_100011261437 [0,2,0,0,0,0|2,0,0]=4 12353 B16R2.3000 Clc1ccc(c(c1)Br)NCc2cncs2 34a_100000752454_100015185245 [0,2,0,0,0,0|1,0,1]=4 12354 B16R2.3000 Clc1ccc(c(c1)Br)NCc2cscn2 34a_100000752454_100000205941 [0,2,0,0,0,0|1,0,0]=3 12355 B16R2.3000 Clc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100000752454_100016991755 [0,2,0,0,0,0|2,0,0]=4 12356 B16R2.3000 Clc1ccc(c(c1)Br)NCc2ncco2 34a_100000752454_103436540062 [0,2,0,0,0,0|2,0,0]=4 12357 B16R2.3000 Clc1ccc(c(c1)Br)NCc2nccs2 34a_100000752454_100015184050 [0,2,0,0,0,0|2,0,0]=4 12358 B16R2.3000 Clc1ccc(c(c1)Br)NCc2ncon2 34a_100000752454_100000233494 [0,2,0,0,0,0|2,0,0]=4 12359 B16R2.3000 Clc1ccc(c(c1)Br)NCn2cncn2 34a_100000752454_200020645497 [0,2,0,0,0,0|1,0,1]=4 12360 B16R2.3000 Clc1ccc(c(c1)Br)OCc2c[nH]cn2 34a_100000211998_100000707719 [0,2,0,0,0,0|1,0,0]=3 12361 B16R2.3000 Clc1ccc(c(c1)Br)OCc2cscn2 34a_100000211998_100000205941 [0,2,0,0,0,0|2,0,0]=4 12362 B16R2.3000 Clc1ccc(c(c1)Br)OCc2cscn2 7a_100000211998_100000205941 [0,2,0,0,0,0|2,0,0]=4 12363 B16R2.3000 Clc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100011219703 [0,2,0,0,0,0|1,0,0]=3 12364 B16R2.3000 Clc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100011219703_100000707719 [0,2,0,0,0,0|1,0,0]=3 12365 B16R2.3000 Clc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100011219703 [0,2,0,0,0,0|2,0,0]=4 12366 B16R2.3000 Clc1ccc(c(c1)Br)SCc2cscn2 62a_100011219703_100000205941 [0,2,0,0,0,0|2,0,0]=4 12367 B16R2.3000 Clc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100000188473_100000756875 [0,2,0,0,0,0|2,0,0]=4 12368 B16R2.3000 Clc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100000756875_100000188473 [0,2,0,0,0,0|2,0,0]=4 12369 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2c[nH]cn2 34a_100000185861_100000707719 [0,2,0,0,0,0|0,0,0]=2 12370 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ccco2 270302a_100000185861_100000186105 [0,2,0,0,0,0|2,0,0]=4 12371 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cccs2 270302a_100000185861_100000209959 [0,2,0,0,0,0|2,0,0]=4 12372 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ccon2 34a_100000185861_100000234950 [0,2,0,0,0,0|2,0,0]=4 12373 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ccsc2 270302a_100000185861_100000188534 [0,2,0,0,0,0|2,0,0]=4 12374 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ccsc2 34a_100000185861_100011261437 [0,2,0,0,0,0|2,0,0]=4 12375 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cn[nH]c2 270302a_100000185861_100016992096 [0,2,0,0,0,0|2,0,0]=4 12376 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cncs2 270302a_100000185861_100000749870 [0,2,0,0,0,0|1,0,1]=4 12377 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cncs2 34a_100000185861_100015185245 [0,2,0,0,0,0|1,0,1]=4 12378 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cscn2 270302a_100000185861_100000743575 [0,2,0,0,0,0|1,0,0]=3 12379 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2cscn2 34a_100000185861_100000205941 [0,2,0,0,0,0|1,0,0]=3 12380 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000185861_100016991755 [0,2,0,0,0,0|2,0,0]=4 12381 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ncco2 34a_100000185861_103436540062 [0,2,0,0,0,0|2,0,0]=4 12382 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2nccs2 270302a_100000185861_100000750902 [0,2,0,0,0,0|2,0,0]=4 12383 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2nccs2 34a_100000185861_100015184050 [0,2,0,0,0,0|2,0,0]=4 12384 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ncon2 34a_100000185861_100000233494 [0,2,0,0,0,0|2,0,0]=4 12385 B16R2.3000 Clc1ccc(c(c1)Cl)NCn2cncn2 34a_100000185861_200020645497 [0,2,0,0,0,0|1,0,1]=4 12386 B16R2.3000 Clc1ccc(c(c1)Cl)OCc2c[nH]cn2 34a_100015191787_100000707719 [0,2,0,0,0,0|1,0,0]=3 12387 B16R2.3000 Clc1ccc(c(c1)Cl)OCc2cscn2 34a_100015191787_100000205941 [0,2,0,0,0,0|2,0,0]=4 12388 B16R2.3000 Clc1ccc(c(c1)Cl)OCc2cscn2 7a_100015191787_100000205941 [0,2,0,0,0,0|2,0,0]=4 12389 B16R2.3000 Clc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000699841_100000707719 [0,2,0,0,0,0|1,0,0]=3 12390 B16R2.3000 Clc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000707719_100000699841 [0,2,0,0,0,0|1,0,0]=3 12391 B16R2.3000 Clc1ccc(c(c1)Cl)SCc2cscn2 62a_100000205941_100000699841 [0,2,0,0,0,0|2,0,0]=4 12392 B16R2.3000 Clc1ccc(c(c1)Cl)SCc2cscn2 62a_100000699841_100000205941 [0,2,0,0,0,0|2,0,0]=4 12393 B16R2.3000 Clc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100000756875_100010254388 [0,2,0,0,0,0|2,0,0]=4 12394 B16R2.3000 Clc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100010254388_100000756875 [0,2,0,0,0,0|2,0,0]=4 12395 B16R2.3000 Clc1ccc(c(c1)I)NCc2c[nH]cn2 34a_100000761889_100000707719 [0,2,0,0,0,0|0,0,0]=2 12396 B16R2.3000 Clc1ccc(c(c1)I)NCc2ccon2 34a_100000761889_100000234950 [0,2,0,0,0,0|2,0,0]=4 12397 B16R2.3000 Clc1ccc(c(c1)I)NCc2ccsc2 34a_100000761889_100011261437 [0,2,0,0,0,0|2,0,0]=4 12398 B16R2.3000 Clc1ccc(c(c1)I)NCc2cncs2 34a_100000761889_100015185245 [0,2,0,0,0,0|1,0,1]=4 12399 B16R2.3000 Clc1ccc(c(c1)I)NCc2cscn2 34a_100000761889_100000205941 [0,2,0,0,0,0|1,0,0]=3 12400 B16R2.3000 Clc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100000761889_100016991755 [0,2,0,0,0,0|2,0,0]=4 12401 B16R2.3000 Clc1ccc(c(c1)I)NCc2ncco2 34a_100000761889_103436540062 [0,2,0,0,0,0|2,0,0]=4 12402 B16R2.3000 Clc1ccc(c(c1)I)NCc2nccs2 34a_100000761889_100015184050 [0,2,0,0,0,0|2,0,0]=4 12403 B16R2.3000 Clc1ccc(c(c1)I)NCc2ncon2 34a_100000761889_100000233494 [0,2,0,0,0,0|2,0,0]=4 12404 B16R2.3000 Clc1ccc(c(c1)I)NCn2cncn2 34a_100000761889_200020645497 [0,2,0,0,0,0|1,0,1]=4 12405 B16R2.3000 Clc1ccc(c(c1)I)OCc2c[nH]cn2 34a_100011356953_100000707719 [0,2,0,0,0,0|1,0,0]=3 12406 B16R2.3000 Clc1ccc(c(c1)I)OCc2cscn2 34a_100011356953_100000205941 [0,2,0,0,0,0|2,0,0]=4 12407 B16R2.3000 Clc1ccc(c(c1)I)OCc2cscn2 7a_100011356953_100000205941 [0,2,0,0,0,0|2,0,0]=4 12408 B16R2.3000 Clc1ccc(c(n1)Br)OCc2c[nH]cn2 34a_100010219353_100000707719 [0,2,0,0,0,0|2,0,0]=4 12409 B16R2.3000 Clc1ccc(c(n1)Cl)OCc2c[nH]cn2 34a_100000101165_100000707719 [0,2,0,0,0,0|2,0,0]=4 12410 B16R2.3000 Clc1ccc(c(n1)Cl)SCc2c[nH]cn2 62a_100000707719_100000043682 [0,2,0,0,0,0|2,0,0]=4 12411 B16R2.3000 Clc1ccc(c(n1)I)OCc2c[nH]cn2 34a_100000696390_100000707719 [0,2,0,0,0,0|2,0,0]=4 12412 B16R2.3000 Clc1cnc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100012154958 [0,2,0,0,0,0|2,0,0]=4 12413 B16R2.3000 Clc1cnc(c(c1)Br)SCc2c[nH]cn2 62a_100012154958_100000707719 [0,2,0,0,0,0|2,0,0]=4 12414 B16R2.3000 Clc1nc(ccc1OCc2c[nH]cn2)Br 34a_100010246206_100000707719 [0,2,0,0,0,0|2,0,0]=4 12415 B16R2.3000 Clc1nc(ccc1OCc2c[nH]cn2)I 34a_100000721234_100000707719 [0,2,0,0,0,0|2,0,0]=4 12416 B16R2.3000 Clc1nc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100010246183 [0,2,0,0,0,0|2,0,0]=4 12417 B16R2.3000 Clc1nc(ccc1SCc2c[nH]cn2)Br 62a_100010246183_100000707719 [0,2,0,0,0,0|2,0,0]=4 12418 B16R2.3000 Fc1cc(c(cn1)OCc2c[nH]cn2)F 34a_100009885687_100000707719 [0,2,0,0,0,0|2,0,0]=4 12419 B16R2.3000 Fc1cc(c(cn1)SCc2c[nH]cn2)Br 62a_100000707719_100015451857 [0,2,0,0,0,0|2,0,0]=4 12420 B16R2.3000 Fc1cc(c(cn1)SCc2c[nH]cn2)Br 62a_100015451857_100000707719 [0,2,0,0,0,0|2,0,0]=4 12421 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)Br 62a_100000211606_100000756875 [0,2,0,0,0,0|2,0,0]=4 12422 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)Br 62a_100000756875_100000211606 [0,2,0,0,0,0|2,0,0]=4 12423 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)Cl 62a_100000709361_100000756875 [0,2,0,0,0,0|2,0,0]=4 12424 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)Cl 62a_100000756875_100000709361 [0,2,0,0,0,0|2,0,0]=4 12425 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)I 62a_100000756875_100010244991 [0,2,0,0,0,0|2,0,0]=4 12426 B16R2.3000 Fc1cc(ccc1CSc2c[nH]cn2)I 62a_100010244991_100000756875 [0,2,0,0,0,0|2,0,0]=4 12427 B16R2.3000 Fc1cc(ccc1NCc2c[nH]cn2)Br 34a_100000210722_100000707719 [0,2,0,0,0,0|0,0,0]=2 12428 B16R2.3000 Fc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100000211020_100000707719 [0,2,0,0,0,0|0,0,0]=2 12429 B16R2.3000 Fc1cc(ccc1NCc2c[nH]cn2)I 34a_100011215594_100000707719 [0,2,0,0,0,0|0,0,0]=2 12430 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)Br 207a_100000210722_100000738523 [0,2,0,0,0,0|2,0,0]=4 12431 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)Cl 207a_100000211020_100000738523 [0,2,0,0,0,0|2,0,0]=4 12432 B16R2.3000 Fc1cc(ccc1NCc2cc[nH]n2)I 207a_100011215594_100000738523 [0,2,0,0,0,0|2,0,0]=4 12433 B16R2.3000 Fc1cc(ccc1NCc2ccco2)Br 207a_100000210722_100000186105 [0,2,0,0,0,0|2,0,0]=4 12434 B16R2.3000 Fc1cc(ccc1NCc2ccco2)Br 270302a_100000210722_100000186105 [0,2,0,0,0,0|2,0,0]=4 12435 B16R2.3000 Fc1cc(ccc1NCc2ccco2)Cl 207a_100000211020_100000186105 [0,2,0,0,0,0|2,0,0]=4 12436 B16R2.3000 Fc1cc(ccc1NCc2ccco2)Cl 270302a_100000211020_100000186105 [0,2,0,0,0,0|2,0,0]=4 12437 B16R2.3000 Fc1cc(ccc1NCc2ccco2)I 207a_100011215594_100000186105 [0,2,0,0,0,0|2,0,0]=4 12438 B16R2.3000 Fc1cc(ccc1NCc2ccco2)I 270302a_100011215594_100000186105 [0,2,0,0,0,0|2,0,0]=4 12439 B16R2.3000 Fc1cc(ccc1NCc2cccs2)Br 207a_100000210722_100000209959 [0,2,0,0,0,0|2,0,0]=4 12440 B16R2.3000 Fc1cc(ccc1NCc2cccs2)Br 270302a_100000210722_100000209959 [0,2,0,0,0,0|2,0,0]=4 12441 B16R2.3000 Fc1cc(ccc1NCc2cccs2)Cl 207a_100000211020_100000209959 [0,2,0,0,0,0|2,0,0]=4 12442 B16R2.3000 Fc1cc(ccc1NCc2cccs2)Cl 270302a_100000211020_100000209959 [0,2,0,0,0,0|2,0,0]=4 12443 B16R2.3000 Fc1cc(ccc1NCc2cccs2)I 207a_100011215594_100000209959 [0,2,0,0,0,0|2,0,0]=4 12444 B16R2.3000 Fc1cc(ccc1NCc2cccs2)I 270302a_100011215594_100000209959 [0,2,0,0,0,0|2,0,0]=4 12445 B16R2.3000 Fc1cc(ccc1NCc2ccoc2)Br 207a_100000210722_100011215517 [0,2,0,0,0,0|2,0,0]=4 12446 B16R2.3000 Fc1cc(ccc1NCc2ccoc2)Cl 207a_100000211020_100011215517 [0,2,0,0,0,0|2,0,0]=4 12447 B16R2.3000 Fc1cc(ccc1NCc2ccoc2)I 207a_100011215594_100011215517 [0,2,0,0,0,0|2,0,0]=4 12448 B16R2.3000 Fc1cc(ccc1NCc2ccon2)Br 34a_100000210722_100000234950 [0,2,0,0,0,0|2,0,0]=4 12449 B16R2.3000 Fc1cc(ccc1NCc2ccon2)Cl 34a_100000211020_100000234950 [0,2,0,0,0,0|2,0,0]=4 12450 B16R2.3000 Fc1cc(ccc1NCc2ccon2)I 34a_100011215594_100000234950 [0,2,0,0,0,0|2,0,0]=4 12451 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Br 207a_100000210722_100000188534 [0,2,0,0,0,0|2,0,0]=4 12452 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Br 270302a_100000210722_100000188534 [0,2,0,0,0,0|2,0,0]=4 12453 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Br 34a_100000210722_100011261437 [0,2,0,0,0,0|2,0,0]=4 12454 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Cl 207a_100000211020_100000188534 [0,2,0,0,0,0|2,0,0]=4 12455 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Cl 270302a_100000211020_100000188534 [0,2,0,0,0,0|2,0,0]=4 12456 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)Cl 34a_100000211020_100011261437 [0,2,0,0,0,0|2,0,0]=4 12457 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)I 207a_100011215594_100000188534 [0,2,0,0,0,0|2,0,0]=4 12458 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)I 270302a_100011215594_100000188534 [0,2,0,0,0,0|2,0,0]=4 12459 B16R2.3000 Fc1cc(ccc1NCc2ccsc2)I 34a_100011215594_100011261437 [0,2,0,0,0,0|2,0,0]=4 12460 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)Br 207a_100000210722_100016992096 [0,2,0,0,0,0|2,0,0]=4 12461 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)Br 270302a_100000210722_100016992096 [0,2,0,0,0,0|2,0,0]=4 12462 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)Cl 207a_100000211020_100016992096 [0,2,0,0,0,0|2,0,0]=4 12463 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)Cl 270302a_100000211020_100016992096 [0,2,0,0,0,0|2,0,0]=4 12464 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)I 207a_100011215594_100016992096 [0,2,0,0,0,0|2,0,0]=4 12465 B16R2.3000 Fc1cc(ccc1NCc2cn[nH]c2)I 270302a_100011215594_100016992096 [0,2,0,0,0,0|2,0,0]=4 12466 B16R2.3000 Fc1cc(ccc1NCc2cnc[nH]2)Br 207a_100000210722_100000742939 [0,2,0,0,0,0|0,0,2]=4 12467 B16R2.3000 Fc1cc(ccc1NCc2cnc[nH]2)Cl 207a_100000211020_100000742939 [0,2,0,0,0,0|0,0,2]=4 12468 B16R2.3000 Fc1cc(ccc1NCc2cnc[nH]2)I 207a_100011215594_100000742939 [0,2,0,0,0,0|0,0,2]=4 12469 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Br 207a_100000210722_100000749870 [0,2,0,0,0,0|1,0,1]=4 12470 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Br 270302a_100000210722_100000749870 [0,2,0,0,0,0|1,0,1]=4 12471 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Br 34a_100000210722_100015185245 [0,2,0,0,0,0|1,0,1]=4 12472 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Cl 207a_100000211020_100000749870 [0,2,0,0,0,0|1,0,1]=4 12473 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Cl 270302a_100000211020_100000749870 [0,2,0,0,0,0|1,0,1]=4 12474 B16R2.3000 Fc1cc(ccc1NCc2cncs2)Cl 34a_100000211020_100015185245 [0,2,0,0,0,0|1,0,1]=4 12475 B16R2.3000 Fc1cc(ccc1NCc2cncs2)I 207a_100011215594_100000749870 [0,2,0,0,0,0|1,0,1]=4 12476 B16R2.3000 Fc1cc(ccc1NCc2cncs2)I 270302a_100011215594_100000749870 [0,2,0,0,0,0|1,0,1]=4 12477 B16R2.3000 Fc1cc(ccc1NCc2cncs2)I 34a_100011215594_100015185245 [0,2,0,0,0,0|1,0,1]=4 12478 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Br 207a_100000210722_100000743575 [0,2,0,0,0,0|1,0,0]=3 12479 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Br 270302a_100000210722_100000743575 [0,2,0,0,0,0|1,0,0]=3 12480 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Br 34a_100000210722_100000205941 [0,2,0,0,0,0|1,0,0]=3 12481 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Cl 207a_100000211020_100000743575 [0,2,0,0,0,0|1,0,0]=3 12482 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Cl 270302a_100000211020_100000743575 [0,2,0,0,0,0|1,0,0]=3 12483 B16R2.3000 Fc1cc(ccc1NCc2cscn2)Cl 34a_100000211020_100000205941 [0,2,0,0,0,0|1,0,0]=3 12484 B16R2.3000 Fc1cc(ccc1NCc2cscn2)I 207a_100011215594_100000743575 [0,2,0,0,0,0|1,0,0]=3 12485 B16R2.3000 Fc1cc(ccc1NCc2cscn2)I 270302a_100011215594_100000743575 [0,2,0,0,0,0|1,0,0]=3 12486 B16R2.3000 Fc1cc(ccc1NCc2cscn2)I 34a_100011215594_100000205941 [0,2,0,0,0,0|1,0,0]=3 12487 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)Br 207a_100000210722_100000743867 [0,2,0,0,0,0|2,0,0]=4 12488 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000210722_100016991755 [0,2,0,0,0,0|2,0,0]=4 12489 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)Cl 207a_100000211020_100000743867 [0,2,0,0,0,0|2,0,0]=4 12490 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)Cl 34a_100000211020_100016991755 [0,2,0,0,0,0|2,0,0]=4 12491 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)I 207a_100011215594_100000743867 [0,2,0,0,0,0|2,0,0]=4 12492 B16R2.3000 Fc1cc(ccc1NCc2ncc[nH]2)I 34a_100011215594_100016991755 [0,2,0,0,0,0|2,0,0]=4 12493 B16R2.3000 Fc1cc(ccc1NCc2ncco2)Br 34a_100000210722_103436540062 [0,2,0,0,0,0|2,0,0]=4 12494 B16R2.3000 Fc1cc(ccc1NCc2ncco2)Cl 34a_100000211020_103436540062 [0,2,0,0,0,0|2,0,0]=4 12495 B16R2.3000 Fc1cc(ccc1NCc2ncco2)I 34a_100011215594_103436540062 [0,2,0,0,0,0|2,0,0]=4 12496 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Br 207a_100000210722_100000750902 [0,2,0,0,0,0|2,0,0]=4 12497 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Br 270302a_100000210722_100000750902 [0,2,0,0,0,0|2,0,0]=4 12498 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Br 34a_100000210722_100015184050 [0,2,0,0,0,0|2,0,0]=4 12499 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Cl 207a_100000211020_100000750902 [0,2,0,0,0,0|2,0,0]=4 12500 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Cl 270302a_100000211020_100000750902 [0,2,0,0,0,0|2,0,0]=4 12501 B16R2.3000 Fc1cc(ccc1NCc2nccs2)Cl 34a_100000211020_100015184050 [0,2,0,0,0,0|2,0,0]=4 12502 B16R2.3000 Fc1cc(ccc1NCc2nccs2)I 207a_100011215594_100000750902 [0,2,0,0,0,0|2,0,0]=4 12503 B16R2.3000 Fc1cc(ccc1NCc2nccs2)I 270302a_100011215594_100000750902 [0,2,0,0,0,0|2,0,0]=4 12504 B16R2.3000 Fc1cc(ccc1NCc2nccs2)I 34a_100011215594_100015184050 [0,2,0,0,0,0|2,0,0]=4 12505 B16R2.3000 Fc1cc(ccc1NCc2ncon2)Br 34a_100000210722_100000233494 [0,2,0,0,0,0|2,0,0]=4 12506 B16R2.3000 Fc1cc(ccc1NCc2ncon2)Cl 34a_100000211020_100000233494 [0,2,0,0,0,0|2,0,0]=4 12507 B16R2.3000 Fc1cc(ccc1NCc2ncon2)I 34a_100011215594_100000233494 [0,2,0,0,0,0|2,0,0]=4 12508 B16R2.3000 Fc1cc(ccc1NCn2cncn2)Br 34a_100000210722_200020645497 [0,2,0,0,0,0|1,0,1]=4 12509 B16R2.3000 Fc1cc(ccc1NCn2cncn2)Cl 34a_100000211020_200020645497 [0,2,0,0,0,0|1,0,1]=4 12510 B16R2.3000 Fc1cc(ccc1NCn2cncn2)I 34a_100011215594_200020645497 [0,2,0,0,0,0|1,0,1]=4 12511 B16R2.3000 Fc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000185481_100000707719 [0,2,0,0,0,0|1,0,0]=3 12512 B16R2.3000 Fc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100000230166_100000707719 [0,2,0,0,0,0|1,0,0]=3 12513 B16R2.3000 Fc1cc(ccc1OCc2c[nH]cn2)I 34a_100011356965_100000707719 [0,2,0,0,0,0|1,0,0]=3 12514 B16R2.3000 Fc1cc(ccc1OCc2cscn2)Br 34a_100000185481_100000205941 [0,2,0,0,0,0|2,0,0]=4 12515 B16R2.3000 Fc1cc(ccc1OCc2cscn2)Br 7a_100000185481_100000205941 [0,2,0,0,0,0|2,0,0]=4 12516 B16R2.3000 Fc1cc(ccc1OCc2cscn2)Cl 34a_100000230166_100000205941 [0,2,0,0,0,0|2,0,0]=4 12517 B16R2.3000 Fc1cc(ccc1OCc2cscn2)Cl 7a_100000230166_100000205941 [0,2,0,0,0,0|2,0,0]=4 12518 B16R2.3000 Fc1cc(ccc1OCc2cscn2)I 34a_100011356965_100000205941 [0,2,0,0,0,0|2,0,0]=4 12519 B16R2.3000 Fc1cc(ccc1OCc2cscn2)I 7a_100011356965_100000205941 [0,2,0,0,0,0|2,0,0]=4 12520 B16R2.3000 Fc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100009814013 [0,2,0,0,0,0|1,0,0]=3 12521 B16R2.3000 Fc1cc(ccc1SCc2c[nH]cn2)Br 62a_100009814013_100000707719 [0,2,0,0,0,0|1,0,0]=3 12522 B16R2.3000 Fc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100011216042 [0,2,0,0,0,0|1,0,0]=3 12523 B16R2.3000 Fc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100011216042_100000707719 [0,2,0,0,0,0|1,0,0]=3 12524 B16R2.3000 Fc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100009814013 [0,2,0,0,0,0|2,0,0]=4 12525 B16R2.3000 Fc1cc(ccc1SCc2cscn2)Br 62a_100009814013_100000205941 [0,2,0,0,0,0|2,0,0]=4 12526 B16R2.3000 Fc1cc(ccc1SCc2cscn2)Cl 62a_100000205941_100011216042 [0,2,0,0,0,0|2,0,0]=4 12527 B16R2.3000 Fc1cc(ccc1SCc2cscn2)Cl 62a_100011216042_100000205941 [0,2,0,0,0,0|2,0,0]=4 12528 B16R2.3000 Fc1cc(cnc1OCc2c[nH]cn2)Cl 34a_100011998252_100000707719 [0,2,0,0,0,0|2,0,0]=4 12529 B16R2.3000 Fc1cc(cnc1SCc2c[nH]cn2)Br 62a_100000707719_100012348576 [0,2,0,0,0,0|2,0,0]=4 12530 B16R2.3000 Fc1cc(cnc1SCc2c[nH]cn2)Br 62a_100012348576_100000707719 [0,2,0,0,0,0|2,0,0]=4 12531 B16R2.3000 Fc1cc(cnc1SCc2c[nH]cn2)Cl 62a_100000707719_100012348686 [0,2,0,0,0,0|2,0,0]=4 12532 B16R2.3000 Fc1cc(cnc1SCc2c[nH]cn2)Cl 62a_100012348686_100000707719 [0,2,0,0,0,0|2,0,0]=4 12533 B16R2.3000 Fc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100000707719_100010128100 [0,2,0,0,0,0|2,0,0]=4 12534 B16R2.3000 Fc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100010128100_100000707719 [0,2,0,0,0,0|2,0,0]=4 12535 B16R2.3000 Fc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_100000243222_100000756875 [0,2,0,0,0,0|2,0,0]=4 12536 B16R2.3000 Fc1ccc(c(c1)Br)CSc2c[nH]cn2 62a_100000756875_100000243222 [0,2,0,0,0,0|2,0,0]=4 12537 B16R2.3000 Fc1ccc(c(c1)Br)NCc2c[nH]cn2 34a_100000738039_100000707719 [0,2,0,0,0,0|0,0,0]=2 12538 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ccco2 270302a_100000738039_100000186105 [0,2,0,0,0,0|2,0,0]=4 12539 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cccs2 270302a_100000738039_100000209959 [0,2,0,0,0,0|2,0,0]=4 12540 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ccon2 34a_100000738039_100000234950 [0,2,0,0,0,0|2,0,0]=4 12541 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ccsc2 270302a_100000738039_100000188534 [0,2,0,0,0,0|2,0,0]=4 12542 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ccsc2 34a_100000738039_100011261437 [0,2,0,0,0,0|2,0,0]=4 12543 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cn[nH]c2 270302a_100000738039_100016992096 [0,2,0,0,0,0|2,0,0]=4 12544 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cncs2 270302a_100000738039_100000749870 [0,2,0,0,0,0|1,0,1]=4 12545 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cncs2 34a_100000738039_100015185245 [0,2,0,0,0,0|1,0,1]=4 12546 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cscn2 270302a_100000738039_100000743575 [0,2,0,0,0,0|1,0,0]=3 12547 B16R2.3000 Fc1ccc(c(c1)Br)NCc2cscn2 34a_100000738039_100000205941 [0,2,0,0,0,0|1,0,0]=3 12548 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100000738039_100016991755 [0,2,0,0,0,0|2,0,0]=4 12549 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ncco2 34a_100000738039_103436540062 [0,2,0,0,0,0|2,0,0]=4 12550 B16R2.3000 Fc1ccc(c(c1)Br)NCc2nccs2 270302a_100000738039_100000750902 [0,2,0,0,0,0|2,0,0]=4 12551 B16R2.3000 Fc1ccc(c(c1)Br)NCc2nccs2 34a_100000738039_100015184050 [0,2,0,0,0,0|2,0,0]=4 12552 B16R2.3000 Fc1ccc(c(c1)Br)NCc2ncon2 34a_100000738039_100000233494 [0,2,0,0,0,0|2,0,0]=4 12553 B16R2.3000 Fc1ccc(c(c1)Br)NCn2cncn2 34a_100000738039_200020645497 [0,2,0,0,0,0|1,0,1]=4 12554 B16R2.3000 Fc1ccc(c(c1)Br)OCc2c[nH]cn2 34a_100000211999_100000707719 [0,2,0,0,0,0|1,0,0]=3 12555 B16R2.3000 Fc1ccc(c(c1)Br)OCc2cscn2 34a_100000211999_100000205941 [0,2,0,0,0,0|2,0,0]=4 12556 B16R2.3000 Fc1ccc(c(c1)Br)OCc2cscn2 7a_100000211999_100000205941 [0,2,0,0,0,0|2,0,0]=4 12557 B16R2.3000 Fc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100011217111 [0,2,0,0,0,0|1,0,0]=3 12558 B16R2.3000 Fc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100011217111_100000707719 [0,2,0,0,0,0|1,0,0]=3 12559 B16R2.3000 Fc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100011217111 [0,2,0,0,0,0|2,0,0]=4 12560 B16R2.3000 Fc1ccc(c(c1)Br)SCc2cscn2 62a_100011217111_100000205941 [0,2,0,0,0,0|2,0,0]=4 12561 B16R2.3000 Fc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100000187853_100000756875 [0,2,0,0,0,0|2,0,0]=4 12562 B16R2.3000 Fc1ccc(c(c1)Cl)CSc2c[nH]cn2 62a_100000756875_100000187853 [0,2,0,0,0,0|2,0,0]=4 12563 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2c[nH]cn2 34a_100000212003_100000707719 [0,2,0,0,0,0|0,0,0]=2 12564 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ccco2 270302a_100000212003_100000186105 [0,2,0,0,0,0|2,0,0]=4 12565 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cccs2 270302a_100000212003_100000209959 [0,2,0,0,0,0|2,0,0]=4 12566 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ccon2 34a_100000212003_100000234950 [0,2,0,0,0,0|2,0,0]=4 12567 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ccsc2 270302a_100000212003_100000188534 [0,2,0,0,0,0|2,0,0]=4 12568 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ccsc2 34a_100000212003_100011261437 [0,2,0,0,0,0|2,0,0]=4 12569 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cn[nH]c2 270302a_100000212003_100016992096 [0,2,0,0,0,0|2,0,0]=4 12570 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cncs2 270302a_100000212003_100000749870 [0,2,0,0,0,0|1,0,1]=4 12571 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cncs2 34a_100000212003_100015185245 [0,2,0,0,0,0|1,0,1]=4 12572 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cscn2 270302a_100000212003_100000743575 [0,2,0,0,0,0|1,0,0]=3 12573 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2cscn2 34a_100000212003_100000205941 [0,2,0,0,0,0|1,0,0]=3 12574 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000212003_100016991755 [0,2,0,0,0,0|2,0,0]=4 12575 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ncco2 34a_100000212003_103436540062 [0,2,0,0,0,0|2,0,0]=4 12576 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2nccs2 270302a_100000212003_100000750902 [0,2,0,0,0,0|2,0,0]=4 12577 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2nccs2 34a_100000212003_100015184050 [0,2,0,0,0,0|2,0,0]=4 12578 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ncon2 34a_100000212003_100000233494 [0,2,0,0,0,0|2,0,0]=4 12579 B16R2.3000 Fc1ccc(c(c1)Cl)NCn2cncn2 34a_100000212003_200020645497 [0,2,0,0,0,0|1,0,1]=4 12580 B16R2.3000 Fc1ccc(c(c1)Cl)OCc2c[nH]cn2 34a_100000212004_100000707719 [0,2,0,0,0,0|1,0,0]=3 12581 B16R2.3000 Fc1ccc(c(c1)Cl)OCc2cscn2 34a_100000212004_100000205941 [0,2,0,0,0,0|2,0,0]=4 12582 B16R2.3000 Fc1ccc(c(c1)Cl)OCc2cscn2 7a_100000212004_100000205941 [0,2,0,0,0,0|2,0,0]=4 12583 B16R2.3000 Fc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000707719_100000733362 [0,2,0,0,0,0|1,0,0]=3 12584 B16R2.3000 Fc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000733362_100000707719 [0,2,0,0,0,0|1,0,0]=3 12585 B16R2.3000 Fc1ccc(c(c1)Cl)SCc2cscn2 62a_100000205941_100000733362 [0,2,0,0,0,0|2,0,0]=4 12586 B16R2.3000 Fc1ccc(c(c1)Cl)SCc2cscn2 62a_100000733362_100000205941 [0,2,0,0,0,0|2,0,0]=4 12587 B16R2.3000 Fc1ccc(c(c1)F)C=Cc2c[nH]cn2 271570a_100102527928_100000756875 [0,2,0,0,0,0|1,0,1]=4 12588 B16R2.3000 Fc1ccc(c(c1)F)CSc2c[nH]cn2 62a_100000748237_100000756875 [0,2,0,0,0,0|2,0,0]=4 12589 B16R2.3000 Fc1ccc(c(c1)F)CSc2c[nH]cn2 62a_100000756875_100000748237 [0,2,0,0,0,0|2,0,0]=4 12590 B16R2.3000 Fc1ccc(c(c1)F)NCc2c[nH]cn2 34a_100000210720_100000707719 [0,2,0,0,0,0|0,0,0]=2 12591 B16R2.3000 Fc1ccc(c(c1)F)NCc2cc[nH]n2 207a_100000210720_100000738523 [0,2,0,0,0,0|2,0,0]=4 12592 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccco2 207a_100000210720_100000186105 [0,2,0,0,0,0|2,0,0]=4 12593 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccco2 270302a_100000210720_100000186105 [0,2,0,0,0,0|2,0,0]=4 12594 B16R2.3000 Fc1ccc(c(c1)F)NCc2cccs2 207a_100000210720_100000209959 [0,2,0,0,0,0|2,0,0]=4 12595 B16R2.3000 Fc1ccc(c(c1)F)NCc2cccs2 270302a_100000210720_100000209959 [0,2,0,0,0,0|2,0,0]=4 12596 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccoc2 207a_100000210720_100011215517 [0,2,0,0,0,0|2,0,0]=4 12597 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccon2 34a_100000210720_100000234950 [0,2,0,0,0,0|2,0,0]=4 12598 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccsc2 207a_100000210720_100000188534 [0,2,0,0,0,0|2,0,0]=4 12599 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccsc2 270302a_100000210720_100000188534 [0,2,0,0,0,0|2,0,0]=4 12600 B16R2.3000 Fc1ccc(c(c1)F)NCc2ccsc2 34a_100000210720_100011261437 [0,2,0,0,0,0|2,0,0]=4 12601 B16R2.3000 Fc1ccc(c(c1)F)NCc2cn[nH]c2 207a_100000210720_100016992096 [0,2,0,0,0,0|2,0,0]=4 12602 B16R2.3000 Fc1ccc(c(c1)F)NCc2cn[nH]c2 270302a_100000210720_100016992096 [0,2,0,0,0,0|2,0,0]=4 12603 B16R2.3000 Fc1ccc(c(c1)F)NCc2cnc[nH]2 207a_100000210720_100000742939 [0,2,0,0,0,0|0,0,2]=4 12604 B16R2.3000 Fc1ccc(c(c1)F)NCc2cncs2 207a_100000210720_100000749870 [0,2,0,0,0,0|1,0,1]=4 12605 B16R2.3000 Fc1ccc(c(c1)F)NCc2cncs2 270302a_100000210720_100000749870 [0,2,0,0,0,0|1,0,1]=4 12606 B16R2.3000 Fc1ccc(c(c1)F)NCc2cncs2 34a_100000210720_100015185245 [0,2,0,0,0,0|1,0,1]=4 12607 B16R2.3000 Fc1ccc(c(c1)F)NCc2cscn2 207a_100000210720_100000743575 [0,2,0,0,0,0|1,0,0]=3 12608 B16R2.3000 Fc1ccc(c(c1)F)NCc2cscn2 270302a_100000210720_100000743575 [0,2,0,0,0,0|1,0,0]=3 12609 B16R2.3000 Fc1ccc(c(c1)F)NCc2cscn2 34a_100000210720_100000205941 [0,2,0,0,0,0|1,0,0]=3 12610 B16R2.3000 Fc1ccc(c(c1)F)NCc2ncc[nH]2 207a_100000210720_100000743867 [0,2,0,0,0,0|2,0,0]=4 12611 B16R2.3000 Fc1ccc(c(c1)F)NCc2ncc[nH]2 34a_100000210720_100016991755 [0,2,0,0,0,0|2,0,0]=4 12612 B16R2.3000 Fc1ccc(c(c1)F)NCc2ncco2 34a_100000210720_103436540062 [0,2,0,0,0,0|2,0,0]=4 12613 B16R2.3000 Fc1ccc(c(c1)F)NCc2nccs2 207a_100000210720_100000750902 [0,2,0,0,0,0|2,0,0]=4 12614 B16R2.3000 Fc1ccc(c(c1)F)NCc2nccs2 270302a_100000210720_100000750902 [0,2,0,0,0,0|2,0,0]=4 12615 B16R2.3000 Fc1ccc(c(c1)F)NCc2nccs2 34a_100000210720_100015184050 [0,2,0,0,0,0|2,0,0]=4 12616 B16R2.3000 Fc1ccc(c(c1)F)NCc2ncon2 34a_100000210720_100000233494 [0,2,0,0,0,0|2,0,0]=4 12617 B16R2.3000 Fc1ccc(c(c1)F)NCn2cncn2 34a_100000210720_200020645497 [0,2,0,0,0,0|1,0,1]=4 12618 B16R2.3000 Fc1ccc(c(c1)F)OCc2c[nH]cn2 34a_100000230127_100000707719 [0,2,0,0,0,0|1,0,0]=3 12619 B16R2.3000 Fc1ccc(c(c1)F)OCc2cscn2 34a_100000230127_100000205941 [0,2,0,0,0,0|2,0,0]=4 12620 B16R2.3000 Fc1ccc(c(c1)F)OCc2cscn2 7a_100000230127_100000205941 [0,2,0,0,0,0|2,0,0]=4 12621 B16R2.3000 Fc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100000750030 [0,2,0,0,0,0|1,0,0]=3 12622 B16R2.3000 Fc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000750030_100000707719 [0,2,0,0,0,0|1,0,0]=3 12623 B16R2.3000 Fc1ccc(c(c1)F)SCc2cscn2 62a_100000205941_100000750030 [0,2,0,0,0,0|2,0,0]=4 12624 B16R2.3000 Fc1ccc(c(c1)F)SCc2cscn2 62a_100000750030_100000205941 [0,2,0,0,0,0|2,0,0]=4 12625 B16R2.3000 Fc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100000756875_100012354799 [0,2,0,0,0,0|2,0,0]=4 12626 B16R2.3000 Fc1ccc(c(c1)I)CSc2c[nH]cn2 62a_100012354799_100000756875 [0,2,0,0,0,0|2,0,0]=4 12627 B16R2.3000 Fc1ccc(c(c1)I)NCc2c[nH]cn2 34a_100000760547_100000707719 [0,2,0,0,0,0|0,0,0]=2 12628 B16R2.3000 Fc1ccc(c(c1)I)NCc2ccon2 34a_100000760547_100000234950 [0,2,0,0,0,0|2,0,0]=4 12629 B16R2.3000 Fc1ccc(c(c1)I)NCc2ccsc2 34a_100000760547_100011261437 [0,2,0,0,0,0|2,0,0]=4 12630 B16R2.3000 Fc1ccc(c(c1)I)NCc2cncs2 34a_100000760547_100015185245 [0,2,0,0,0,0|1,0,1]=4 12631 B16R2.3000 Fc1ccc(c(c1)I)NCc2cscn2 34a_100000760547_100000205941 [0,2,0,0,0,0|1,0,0]=3 12632 B16R2.3000 Fc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100000760547_100016991755 [0,2,0,0,0,0|2,0,0]=4 12633 B16R2.3000 Fc1ccc(c(c1)I)NCc2ncco2 34a_100000760547_103436540062 [0,2,0,0,0,0|2,0,0]=4 12634 B16R2.3000 Fc1ccc(c(c1)I)NCc2nccs2 34a_100000760547_100015184050 [0,2,0,0,0,0|2,0,0]=4 12635 B16R2.3000 Fc1ccc(c(c1)I)NCc2ncon2 34a_100000760547_100000233494 [0,2,0,0,0,0|2,0,0]=4 12636 B16R2.3000 Fc1ccc(c(c1)I)NCn2cncn2 34a_100000760547_200020645497 [0,2,0,0,0,0|1,0,1]=4 12637 B16R2.3000 Fc1ccc(c(c1)I)OCc2c[nH]cn2 34a_100012355409_100000707719 [0,2,0,0,0,0|1,0,0]=3 12638 B16R2.3000 Fc1ccc(c(c1)I)OCc2cscn2 34a_100012355409_100000205941 [0,2,0,0,0,0|2,0,0]=4 12639 B16R2.3000 Fc1ccc(c(c1)I)OCc2cscn2 7a_100012355409_100000205941 [0,2,0,0,0,0|2,0,0]=4 12640 B16R2.3000 Fc1ccc(c(n1)Br)OCc2c[nH]cn2 34a_100009887730_100000707719 [0,2,0,0,0,0|2,0,0]=4 12641 B16R2.3000 Fc1ccc(c(n1)F)OCc2c[nH]cn2 34a_100000101184_100000707719 [0,2,0,0,0,0|2,0,0]=4 12642 B16R2.3000 Fc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100000070099_100000707719 [0,2,0,0,0,0|2,0,0]=4 12643 B16R2.3000 Fc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100000707719_100000070099 [0,2,0,0,0,0|2,0,0]=4 12644 B16R2.3000 Fc1ccc(c(n1)I)OCc2c[nH]cn2 34a_100010382442_100000707719 [0,2,0,0,0,0|2,0,0]=4 12645 B16R2.3000 Fc1cnc(c(c1)Cl)OCc2c[nH]cn2 34a_100009847679_100000707719 [0,2,0,0,0,0|2,0,0]=4 12646 B16R2.3000 Fc1cnc(c(c1)F)OCc2c[nH]cn2 34a_100012025737_100000707719 [0,2,0,0,0,0|2,0,0]=4 12647 B16R2.3000 Fc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100011219543 [0,2,0,0,0,0|2,0,0]=4 12648 B16R2.3000 Fc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100011219543_100000707719 [0,2,0,0,0,0|2,0,0]=4 12649 B16R2.3000 Fc1nc(ccc1OCc2c[nH]cn2)Br 34a_100009819667_100000707719 [0,2,0,0,0,0|2,0,0]=4 12650 B16R2.3000 Fc1nc(ccc1OCc2c[nH]cn2)Cl 34a_100009880201_100000707719 [0,2,0,0,0,0|2,0,0]=4 12651 B16R2.3000 Fc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100010168078 [0,2,0,0,0,0|2,0,0]=4 12652 B16R2.3000 Fc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100010168078_100000707719 [0,2,0,0,0,0|2,0,0]=4 12653 B16R2.3000 Ic1ccc(c(c1)I)OCc2cscn2 7a_100010001573_100000205941 [0,2,0,0,0,0|2,0,0]=4 12654 B16R2.3000 Nc1[nH]c(=O)ccc1SCc2c[nH]cn2 62a_100009884077_100000707719 [0,2,0,0,0,0|2,0,0]=4 12655 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)Br 62a_100000707719_100010074611 [0,2,0,0,0,0|2,0,0]=4 12656 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)Br 62a_100010074611_100000707719 [0,2,0,0,0,0|2,0,0]=4 12657 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)Cl 62a_100000694920_100000707719 [0,2,0,0,0,0|2,0,0]=4 12658 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)Cl 62a_100000707719_100000694920 [0,2,0,0,0,0|2,0,0]=4 12659 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)F 62a_100000707719_100009844730 [0,2,0,0,0,0|2,0,0]=4 12660 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)F 62a_100009844730_100000707719 [0,2,0,0,0,0|2,0,0]=4 12661 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)N 62a_100000707719_200009857908 [0,2,0,0,0,0|2,0,0]=4 12662 B16R2.3000 Nc1cc(c(cn1)SCc2c[nH]cn2)N 62a_200009857908_100000707719 [0,2,0,0,0,0|2,0,0]=4 12663 B16R2.3000 Nc1cc(ccc1OCc2c[nH]cn2)Br 34a_100000752626_100000707719 [0,2,0,0,0,0|1,0,0]=3 12664 B16R2.3000 Nc1cc(ccc1OCc2c[nH]cn2)Cl 34a_100000210500_100000707719 [0,2,0,0,0,0|1,0,0]=3 12665 B16R2.3000 Nc1cc(ccc1OCc2c[nH]cn2)F 34a_100000759472_100000707719 [0,2,0,0,0,0|1,0,0]=3 12666 B16R2.3000 Nc1cc(ccc1OCc2c[nH]cn2)I 34a_100000753495_100000707719 [0,2,0,0,0,0|1,0,0]=3 12667 B16R2.3000 Nc1cc(ccc1OCc2cscn2)Br 34a_100000752626_100000205941 [0,2,0,0,0,0|2,0,0]=4 12668 B16R2.3000 Nc1cc(ccc1OCc2cscn2)Br 7a_100000752626_100000205941 [0,2,0,0,0,0|2,0,0]=4 12669 B16R2.3000 Nc1cc(ccc1OCc2cscn2)Cl 34a_100000210500_100000205941 [0,2,0,0,0,0|2,0,0]=4 12670 B16R2.3000 Nc1cc(ccc1OCc2cscn2)Cl 7a_100000210500_100000205941 [0,2,0,0,0,0|2,0,0]=4 12671 B16R2.3000 Nc1cc(ccc1OCc2cscn2)F 34a_100000759472_100000205941 [0,2,0,0,0,0|2,0,0]=4 12672 B16R2.3000 Nc1cc(ccc1OCc2cscn2)F 7a_100000759472_100000205941 [0,2,0,0,0,0|2,0,0]=4 12673 B16R2.3000 Nc1cc(ccc1OCc2cscn2)I 34a_100000753495_100000205941 [0,2,0,0,0,0|2,0,0]=4 12674 B16R2.3000 Nc1cc(ccc1OCc2cscn2)I 7a_100000753495_100000205941 [0,2,0,0,0,0|2,0,0]=4 12675 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100000743836 [0,2,0,0,0,0|1,0,0]=3 12676 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000743836_100000707719 [0,2,0,0,0,0|1,0,0]=3 12677 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100000761886 [0,2,0,0,0,0|1,0,0]=3 12678 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000761886_100000707719 [0,2,0,0,0,0|1,0,0]=3 12679 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)F 62a_100000687223_100000707719 [0,2,0,0,0,0|1,0,0]=3 12680 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100000687223 [0,2,0,0,0,0|1,0,0]=3 12681 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)O 62a_100000707719_100011999798 [0,2,0,0,0,0|1,0,0]=3 12682 B16R2.3000 Nc1cc(ccc1SCc2c[nH]cn2)O 62a_100011999798_100000707719 [0,2,0,0,0,0|1,0,0]=3 12683 B16R2.3000 Nc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100000743836 [0,2,0,0,0,0|2,0,0]=4 12684 B16R2.3000 Nc1cc(ccc1SCc2cscn2)Br 62a_100000743836_100000205941 [0,2,0,0,0,0|2,0,0]=4 12685 B16R2.3000 Nc1cc(ccc1SCc2cscn2)Cl 62a_100000205941_100000761886 [0,2,0,0,0,0|2,0,0]=4 12686 B16R2.3000 Nc1cc(ccc1SCc2cscn2)Cl 62a_100000761886_100000205941 [0,2,0,0,0,0|2,0,0]=4 12687 B16R2.3000 Nc1cc(ccc1SCc2cscn2)F 62a_100000205941_100000687223 [0,2,0,0,0,0|2,0,0]=4 12688 B16R2.3000 Nc1cc(ccc1SCc2cscn2)F 62a_100000687223_100000205941 [0,2,0,0,0,0|2,0,0]=4 12689 B16R2.3000 Nc1cc(ccc1SCc2cscn2)O 62a_100000205941_100011999798 [0,2,0,0,0,0|2,0,0]=4 12690 B16R2.3000 Nc1cc(ccc1SCc2cscn2)O 62a_100011999798_100000205941 [0,2,0,0,0,0|2,0,0]=4 12691 B16R2.3000 Nc1cc(cnc1OCc2c[nH]cn2)Br 34a_100000743729_100000707719 [0,2,0,0,0,0|2,0,0]=4 12692 B16R2.3000 Nc1cc(cnc1OCc2c[nH]cn2)Cl 34a_100011998249_100000707719 [0,2,0,0,0,0|2,0,0]=4 12693 B16R2.3000 Nc1cc(cnc1SCc2c[nH]cn2)Br 62a_100000707719_100010090555 [0,2,0,0,0,0|2,0,0]=4 12694 B16R2.3000 Nc1cc(cnc1SCc2c[nH]cn2)Br 62a_100010090555_100000707719 [0,2,0,0,0,0|2,0,0]=4 12695 B16R2.3000 Nc1cc(cnc1SCc2c[nH]cn2)F 62a_100000707719_100009817643 [0,2,0,0,0,0|2,0,0]=4 12696 B16R2.3000 Nc1cc(cnc1SCc2c[nH]cn2)F 62a_100009817643_100000707719 [0,2,0,0,0,0|2,0,0]=4 12697 B16R2.3000 Nc1cc(ncc1OCc2c[nH]cn2)Br 34a_100009819941_100000707719 [0,2,0,0,0,0|2,0,0]=4 12698 B16R2.3000 Nc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100000707719_100010209552 [0,2,0,0,0,0|2,0,0]=4 12699 B16R2.3000 Nc1cc(ncc1SCc2c[nH]cn2)Cl 62a_100010209552_100000707719 [0,2,0,0,0,0|2,0,0]=4 12700 B16R2.3000 Nc1ccc(c(c1)Br)OCc2c[nH]cn2 34a_100011534360_100000707719 [0,2,0,0,0,0|1,0,0]=3 12701 B16R2.3000 Nc1ccc(c(c1)Br)OCc2cscn2 34a_100011534360_100000205941 [0,2,0,0,0,0|2,0,0]=4 12702 B16R2.3000 Nc1ccc(c(c1)Br)OCc2cscn2 7a_100011534360_100000205941 [0,2,0,0,0,0|2,0,0]=4 12703 B16R2.3000 Nc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100000750458 [0,2,0,0,0,0|1,0,0]=3 12704 B16R2.3000 Nc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000750458_100000707719 [0,2,0,0,0,0|1,0,0]=3 12705 B16R2.3000 Nc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100000750458 [0,2,0,0,0,0|2,0,0]=4 12706 B16R2.3000 Nc1ccc(c(c1)Br)SCc2cscn2 62a_100000750458_100000205941 [0,2,0,0,0,0|2,0,0]=4 12707 B16R2.3000 Nc1ccc(c(c1)Cl)OCc2c[nH]cn2 34a_100000744943_100000707719 [0,2,0,0,0,0|1,0,0]=3 12708 B16R2.3000 Nc1ccc(c(c1)Cl)OCc2cscn2 34a_100000744943_100000205941 [0,2,0,0,0,0|2,0,0]=4 12709 B16R2.3000 Nc1ccc(c(c1)Cl)OCc2cscn2 7a_100000744943_100000205941 [0,2,0,0,0,0|2,0,0]=4 12710 B16R2.3000 Nc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000707719_100000761885 [0,2,0,0,0,0|1,0,0]=3 12711 B16R2.3000 Nc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000761885_100000707719 [0,2,0,0,0,0|1,0,0]=3 12712 B16R2.3000 Nc1ccc(c(c1)Cl)SCc2cscn2 62a_100000205941_100000761885 [0,2,0,0,0,0|2,0,0]=4 12713 B16R2.3000 Nc1ccc(c(c1)Cl)SCc2cscn2 62a_100000761885_100000205941 [0,2,0,0,0,0|2,0,0]=4 12714 B16R2.3000 Nc1ccc(c(c1)F)OCc2c[nH]cn2 34a_100011220035_100000707719 [0,2,0,0,0,0|1,0,0]=3 12715 B16R2.3000 Nc1ccc(c(c1)F)OCc2cscn2 34a_100011220035_100000205941 [0,2,0,0,0,0|2,0,0]=4 12716 B16R2.3000 Nc1ccc(c(c1)F)OCc2cscn2 7a_100011220035_100000205941 [0,2,0,0,0,0|2,0,0]=4 12717 B16R2.3000 Nc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100011356925 [0,2,0,0,0,0|1,0,0]=3 12718 B16R2.3000 Nc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100011356925_100000707719 [0,2,0,0,0,0|1,0,0]=3 12719 B16R2.3000 Nc1ccc(c(c1)F)SCc2cscn2 62a_100000205941_100011356925 [0,2,0,0,0,0|2,0,0]=4 12720 B16R2.3000 Nc1ccc(c(c1)F)SCc2cscn2 62a_100011356925_100000205941 [0,2,0,0,0,0|2,0,0]=4 12721 B16R2.3000 Nc1ccc(c(c1)N)OCc2c[nH]cn2 34a_100000725306_100000707719 [0,2,0,0,0,0|1,0,0]=3 12722 B16R2.3000 Nc1ccc(c(c1)N)OCc2cscn2 34a_100000725306_100000205941 [0,2,0,0,0,0|2,0,0]=4 12723 B16R2.3000 Nc1ccc(c(c1)N)SCc2c[nH]cn2 62a_100000707719_200012175722 [0,2,0,0,0,0|1,0,0]=3 12724 B16R2.3000 Nc1ccc(c(c1)N)SCc2c[nH]cn2 62a_200012175722_100000707719 [0,2,0,0,0,0|1,0,0]=3 12725 B16R2.3000 Nc1ccc(c(c1)N)SCc2cscn2 62a_100000205941_200012175722 [0,2,0,0,0,0|2,0,0]=4 12726 B16R2.3000 Nc1ccc(c(c1)N)SCc2cscn2 62a_200012175722_100000205941 [0,2,0,0,0,0|2,0,0]=4 12727 B16R2.3000 Nc1ccc(c(n1)Br)SCc2c[nH]cn2 62a_100000707719_100010734177 [0,2,0,0,0,0|2,0,0]=4 12728 B16R2.3000 Nc1ccc(c(n1)Br)SCc2c[nH]cn2 62a_100010734177_100000707719 [0,2,0,0,0,0|2,0,0]=4 12729 B16R2.3000 Nc1ccc(c(n1)Cl)SCc2c[nH]cn2 62a_100000707719_100010270343 [0,2,0,0,0,0|2,0,0]=4 12730 B16R2.3000 Nc1ccc(c(n1)Cl)SCc2c[nH]cn2 62a_100010270343_100000707719 [0,2,0,0,0,0|2,0,0]=4 12731 B16R2.3000 Nc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100000707719_100009882772 [0,2,0,0,0,0|2,0,0]=4 12732 B16R2.3000 Nc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100009882772_100000707719 [0,2,0,0,0,0|2,0,0]=4 12733 B16R2.3000 Nc1ccc(c(n1)N)SCc2c[nH]cn2 62a_100011356871_100000707719 [0,2,0,0,0,0|2,0,0]=4 12734 B16R2.3000 Nc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100010280766 [0,2,0,0,0,0|2,0,0]=4 12735 B16R2.3000 Nc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100010280766_100000707719 [0,2,0,0,0,0|2,0,0]=4 12736 B16R2.3000 Nc1cnc(c(c1)N)SCc2c[nH]cn2 62a_100000707719_200000093520 [0,2,0,0,0,0|2,0,0]=4 12737 B16R2.3000 Nc1cnc(c(c1)N)SCc2c[nH]cn2 62a_200000093520_100000707719 [0,2,0,0,0,0|2,0,0]=4 12738 B16R2.3000 Nc1nc(ccc1OCc2c[nH]cn2)Br 34a_100000685527_100000707719 [0,2,0,0,0,0|2,0,0]=4 12739 B16R2.3000 Nc1nc(ccc1OCc2c[nH]cn2)Cl 34a_100000717809_100000707719 [0,2,0,0,0,0|2,0,0]=4 12740 B16R2.3000 Nc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100010171640 [0,2,0,0,0,0|2,0,0]=4 12741 B16R2.3000 Nc1nc(ccc1SCc2c[nH]cn2)Cl 62a_100010171640_100000707719 [0,2,0,0,0,0|2,0,0]=4 12742 B16R2.3000 Nc1nc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100009854977 [0,2,0,0,0,0|2,0,0]=4 12743 B16R2.3000 Nc1nc(ccc1SCc2c[nH]cn2)F 62a_100009854977_100000707719 [0,2,0,0,0,0|2,0,0]=4 12744 B16R2.3000 O=c1cc(c(c[nH]1)SCc2c[nH]cn2)F 62a_100000707719_100015631685 [0,2,0,0,0,0|2,0,0]=4 12745 B16R2.3000 O=c1cc(c(c[nH]1)SCc2c[nH]cn2)F 62a_100015631685_100000707719 [0,2,0,0,0,0|2,0,0]=4 12746 B16R2.3000 Oc1cc(ccc1NCc2c[nH]cn2)Br 34a_100000739049_100000707719 [0,2,0,0,0,0|0,0,0]=2 12747 B16R2.3000 Oc1cc(ccc1NCc2c[nH]cn2)Cl 34a_100000185728_100000707719 [0,2,0,0,0,0|0,0,0]=2 12748 B16R2.3000 Oc1cc(ccc1NCc2c[nH]cn2)F 34a_100000753323_100000707719 [0,2,0,0,0,0|0,0,0]=2 12749 B16R2.3000 Oc1cc(ccc1NCc2ccon2)Br 34a_100000739049_100000234950 [0,2,0,0,0,0|2,0,0]=4 12750 B16R2.3000 Oc1cc(ccc1NCc2ccon2)Cl 34a_100000185728_100000234950 [0,2,0,0,0,0|2,0,0]=4 12751 B16R2.3000 Oc1cc(ccc1NCc2ccon2)F 34a_100000753323_100000234950 [0,2,0,0,0,0|2,0,0]=4 12752 B16R2.3000 Oc1cc(ccc1NCc2ccsc2)Br 34a_100000739049_100011261437 [0,2,0,0,0,0|2,0,0]=4 12753 B16R2.3000 Oc1cc(ccc1NCc2ccsc2)Cl 34a_100000185728_100011261437 [0,2,0,0,0,0|2,0,0]=4 12754 B16R2.3000 Oc1cc(ccc1NCc2ccsc2)F 34a_100000753323_100011261437 [0,2,0,0,0,0|2,0,0]=4 12755 B16R2.3000 Oc1cc(ccc1NCc2cncs2)Br 34a_100000739049_100015185245 [0,2,0,0,0,0|1,0,1]=4 12756 B16R2.3000 Oc1cc(ccc1NCc2cncs2)Cl 34a_100000185728_100015185245 [0,2,0,0,0,0|1,0,1]=4 12757 B16R2.3000 Oc1cc(ccc1NCc2cncs2)F 34a_100000753323_100015185245 [0,2,0,0,0,0|1,0,1]=4 12758 B16R2.3000 Oc1cc(ccc1NCc2cscn2)Br 34a_100000739049_100000205941 [0,2,0,0,0,0|1,0,0]=3 12759 B16R2.3000 Oc1cc(ccc1NCc2cscn2)Cl 34a_100000185728_100000205941 [0,2,0,0,0,0|1,0,0]=3 12760 B16R2.3000 Oc1cc(ccc1NCc2cscn2)F 34a_100000753323_100000205941 [0,2,0,0,0,0|1,0,0]=3 12761 B16R2.3000 Oc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000739049_100016991755 [0,2,0,0,0,0|2,0,0]=4 12762 B16R2.3000 Oc1cc(ccc1NCc2ncc[nH]2)Cl 34a_100000185728_100016991755 [0,2,0,0,0,0|2,0,0]=4 12763 B16R2.3000 Oc1cc(ccc1NCc2ncc[nH]2)F 34a_100000753323_100016991755 [0,2,0,0,0,0|2,0,0]=4 12764 B16R2.3000 Oc1cc(ccc1NCc2ncco2)Br 34a_100000739049_103436540062 [0,2,0,0,0,0|2,0,0]=4 12765 B16R2.3000 Oc1cc(ccc1NCc2ncco2)Cl 34a_100000185728_103436540062 [0,2,0,0,0,0|2,0,0]=4 12766 B16R2.3000 Oc1cc(ccc1NCc2ncco2)F 34a_100000753323_103436540062 [0,2,0,0,0,0|2,0,0]=4 12767 B16R2.3000 Oc1cc(ccc1NCc2nccs2)Br 34a_100000739049_100015184050 [0,2,0,0,0,0|2,0,0]=4 12768 B16R2.3000 Oc1cc(ccc1NCc2nccs2)Cl 34a_100000185728_100015184050 [0,2,0,0,0,0|2,0,0]=4 12769 B16R2.3000 Oc1cc(ccc1NCc2nccs2)F 34a_100000753323_100015184050 [0,2,0,0,0,0|2,0,0]=4 12770 B16R2.3000 Oc1cc(ccc1NCc2ncon2)Br 34a_100000739049_100000233494 [0,2,0,0,0,0|2,0,0]=4 12771 B16R2.3000 Oc1cc(ccc1NCc2ncon2)Cl 34a_100000185728_100000233494 [0,2,0,0,0,0|2,0,0]=4 12772 B16R2.3000 Oc1cc(ccc1NCc2ncon2)F 34a_100000753323_100000233494 [0,2,0,0,0,0|2,0,0]=4 12773 B16R2.3000 Oc1cc(ccc1NCn2cncn2)Br 34a_100000739049_200020645497 [0,2,0,0,0,0|1,0,1]=4 12774 B16R2.3000 Oc1cc(ccc1NCn2cncn2)Cl 34a_100000185728_200020645497 [0,2,0,0,0,0|1,0,1]=4 12775 B16R2.3000 Oc1cc(ccc1NCn2cncn2)F 34a_100000753323_200020645497 [0,2,0,0,0,0|1,0,1]=4 12776 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)Br 62a_100000707719_100012344904 [0,2,0,0,0,0|1,0,0]=3 12777 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)Br 62a_100012344904_100000707719 [0,2,0,0,0,0|1,0,0]=3 12778 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000050036_100000707719 [0,2,0,0,0,0|1,0,0]=3 12779 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)Cl 62a_100000707719_100000050036 [0,2,0,0,0,0|1,0,0]=3 12780 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)F 62a_100000690578_100000707719 [0,2,0,0,0,0|1,0,0]=3 12781 B16R2.3000 Oc1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100000690578 [0,2,0,0,0,0|1,0,0]=3 12782 B16R2.3000 Oc1cc(ccc1SCc2cscn2)Br 62a_100000205941_100012344904 [0,2,0,0,0,0|2,0,0]=4 12783 B16R2.3000 Oc1cc(ccc1SCc2cscn2)Br 62a_100012344904_100000205941 [0,2,0,0,0,0|2,0,0]=4 12784 B16R2.3000 Oc1cc(ccc1SCc2cscn2)Cl 62a_100000050036_100000205941 [0,2,0,0,0,0|2,0,0]=4 12785 B16R2.3000 Oc1cc(ccc1SCc2cscn2)Cl 62a_100000205941_100000050036 [0,2,0,0,0,0|2,0,0]=4 12786 B16R2.3000 Oc1cc(ccc1SCc2cscn2)F 62a_100000205941_100000690578 [0,2,0,0,0,0|2,0,0]=4 12787 B16R2.3000 Oc1cc(ccc1SCc2cscn2)F 62a_100000690578_100000205941 [0,2,0,0,0,0|2,0,0]=4 12788 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)Br 62a_100000707719_100010210634 [0,2,0,0,0,0|2,0,0]=4 12789 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)Br 62a_100010210634_100000707719 [0,2,0,0,0,0|2,0,0]=4 12790 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)Cl 62a_100000707719_100010233512 [0,2,0,0,0,0|2,0,0]=4 12791 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)Cl 62a_100010233512_100000707719 [0,2,0,0,0,0|2,0,0]=4 12792 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)F 62a_100000707719_100000079967 [0,2,0,0,0,0|2,0,0]=4 12793 B16R2.3000 Oc1cc(cnc1SCc2c[nH]cn2)F 62a_100009820119_100000707719 [0,2,0,0,0,0|2,0,0]=4 12794 B16R2.3000 Oc1ccc(c(c1)Br)NCc2c[nH]cn2 34a_100012001276_100000707719 [0,2,0,0,0,0|0,0,0]=2 12795 B16R2.3000 Oc1ccc(c(c1)Br)NCc2ccon2 34a_100012001276_100000234950 [0,2,0,0,0,0|2,0,0]=4 12796 B16R2.3000 Oc1ccc(c(c1)Br)NCc2ccsc2 34a_100012001276_100011261437 [0,2,0,0,0,0|2,0,0]=4 12797 B16R2.3000 Oc1ccc(c(c1)Br)NCc2cncs2 34a_100012001276_100015185245 [0,2,0,0,0,0|1,0,1]=4 12798 B16R2.3000 Oc1ccc(c(c1)Br)NCc2cscn2 34a_100012001276_100000205941 [0,2,0,0,0,0|1,0,0]=3 12799 B16R2.3000 Oc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100012001276_100016991755 [0,2,0,0,0,0|2,0,0]=4 12800 B16R2.3000 Oc1ccc(c(c1)Br)NCc2ncco2 34a_100012001276_103436540062 [0,2,0,0,0,0|2,0,0]=4 12801 B16R2.3000 Oc1ccc(c(c1)Br)NCc2nccs2 34a_100012001276_100015184050 [0,2,0,0,0,0|2,0,0]=4 12802 B16R2.3000 Oc1ccc(c(c1)Br)NCc2ncon2 34a_100012001276_100000233494 [0,2,0,0,0,0|2,0,0]=4 12803 B16R2.3000 Oc1ccc(c(c1)Br)NCn2cncn2 34a_100012001276_200020645497 [0,2,0,0,0,0|1,0,1]=4 12804 B16R2.3000 Oc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000701344_100000707719 [0,2,0,0,0,0|1,0,0]=3 12805 B16R2.3000 Oc1ccc(c(c1)Br)SCc2c[nH]cn2 62a_100000707719_100000701344 [0,2,0,0,0,0|1,0,0]=3 12806 B16R2.3000 Oc1ccc(c(c1)Br)SCc2cscn2 62a_100000205941_100000701344 [0,2,0,0,0,0|2,0,0]=4 12807 B16R2.3000 Oc1ccc(c(c1)Br)SCc2cscn2 62a_100000701344_100000205941 [0,2,0,0,0,0|2,0,0]=4 12808 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2c[nH]cn2 34a_100011215599_100000707719 [0,2,0,0,0,0|0,0,0]=2 12809 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ccon2 34a_100011215599_100000234950 [0,2,0,0,0,0|2,0,0]=4 12810 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ccsc2 34a_100011215599_100011261437 [0,2,0,0,0,0|2,0,0]=4 12811 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2cncs2 34a_100011215599_100015185245 [0,2,0,0,0,0|1,0,1]=4 12812 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2cscn2 34a_100011215599_100000205941 [0,2,0,0,0,0|1,0,0]=3 12813 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100011215599_100016991755 [0,2,0,0,0,0|2,0,0]=4 12814 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ncco2 34a_100011215599_103436540062 [0,2,0,0,0,0|2,0,0]=4 12815 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2nccs2 34a_100011215599_100015184050 [0,2,0,0,0,0|2,0,0]=4 12816 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ncon2 34a_100011215599_100000233494 [0,2,0,0,0,0|2,0,0]=4 12817 B16R2.3000 Oc1ccc(c(c1)Cl)NCn2cncn2 34a_100011215599_200020645497 [0,2,0,0,0,0|1,0,1]=4 12818 B16R2.3000 Oc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000047559_100000707719 [0,2,0,0,0,0|1,0,0]=3 12819 B16R2.3000 Oc1ccc(c(c1)Cl)SCc2c[nH]cn2 62a_100000707719_100000047559 [0,2,0,0,0,0|1,0,0]=3 12820 B16R2.3000 Oc1ccc(c(c1)Cl)SCc2cscn2 62a_100000047559_100000205941 [0,2,0,0,0,0|2,0,0]=4 12821 B16R2.3000 Oc1ccc(c(c1)Cl)SCc2cscn2 62a_100000205941_100000047559 [0,2,0,0,0,0|2,0,0]=4 12822 B16R2.3000 Oc1ccc(c(c1)F)NCc2c[nH]cn2 34a_100000759473_100000707719 [0,2,0,0,0,0|0,0,0]=2 12823 B16R2.3000 Oc1ccc(c(c1)F)NCc2ccon2 34a_100000759473_100000234950 [0,2,0,0,0,0|2,0,0]=4 12824 B16R2.3000 Oc1ccc(c(c1)F)NCc2ccsc2 34a_100000759473_100011261437 [0,2,0,0,0,0|2,0,0]=4 12825 B16R2.3000 Oc1ccc(c(c1)F)NCc2cncs2 34a_100000759473_100015185245 [0,2,0,0,0,0|1,0,1]=4 12826 B16R2.3000 Oc1ccc(c(c1)F)NCc2cscn2 34a_100000759473_100000205941 [0,2,0,0,0,0|1,0,0]=3 12827 B16R2.3000 Oc1ccc(c(c1)F)NCc2ncc[nH]2 34a_100000759473_100016991755 [0,2,0,0,0,0|2,0,0]=4 12828 B16R2.3000 Oc1ccc(c(c1)F)NCc2ncco2 34a_100000759473_103436540062 [0,2,0,0,0,0|2,0,0]=4 12829 B16R2.3000 Oc1ccc(c(c1)F)NCc2nccs2 34a_100000759473_100015184050 [0,2,0,0,0,0|2,0,0]=4 12830 B16R2.3000 Oc1ccc(c(c1)F)NCc2ncon2 34a_100000759473_100000233494 [0,2,0,0,0,0|2,0,0]=4 12831 B16R2.3000 Oc1ccc(c(c1)F)NCn2cncn2 34a_100000759473_200020645497 [0,2,0,0,0,0|1,0,1]=4 12832 B16R2.3000 Oc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100000755031 [0,2,0,0,0,0|1,0,0]=3 12833 B16R2.3000 Oc1ccc(c(c1)F)SCc2c[nH]cn2 62a_100000755031_100000707719 [0,2,0,0,0,0|1,0,0]=3 12834 B16R2.3000 Oc1ccc(c(c1)F)SCc2cscn2 62a_100000205941_100000755031 [0,2,0,0,0,0|2,0,0]=4 12835 B16R2.3000 Oc1ccc(c(c1)F)SCc2cscn2 62a_100000755031_100000205941 [0,2,0,0,0,0|2,0,0]=4 12836 B16R2.3000 Oc1ccc(c(c1)I)NCc2c[nH]cn2 34a_100010084370_100000707719 [0,2,0,0,0,0|0,0,0]=2 12837 B16R2.3000 Oc1ccc(c(c1)I)NCc2ccon2 34a_100010084370_100000234950 [0,2,0,0,0,0|2,0,0]=4 12838 B16R2.3000 Oc1ccc(c(c1)I)NCc2ccsc2 34a_100010084370_100011261437 [0,2,0,0,0,0|2,0,0]=4 12839 B16R2.3000 Oc1ccc(c(c1)I)NCc2cncs2 34a_100010084370_100015185245 [0,2,0,0,0,0|1,0,1]=4 12840 B16R2.3000 Oc1ccc(c(c1)I)NCc2cscn2 34a_100010084370_100000205941 [0,2,0,0,0,0|1,0,0]=3 12841 B16R2.3000 Oc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100010084370_100016991755 [0,2,0,0,0,0|2,0,0]=4 12842 B16R2.3000 Oc1ccc(c(c1)I)NCc2ncco2 34a_100010084370_103436540062 [0,2,0,0,0,0|2,0,0]=4 12843 B16R2.3000 Oc1ccc(c(c1)I)NCc2nccs2 34a_100010084370_100015184050 [0,2,0,0,0,0|2,0,0]=4 12844 B16R2.3000 Oc1ccc(c(c1)I)NCc2ncon2 34a_100010084370_100000233494 [0,2,0,0,0,0|2,0,0]=4 12845 B16R2.3000 Oc1ccc(c(c1)I)NCn2cncn2 34a_100010084370_200020645497 [0,2,0,0,0,0|1,0,1]=4 12846 B16R2.3000 Oc1ccc(c(c1)O)NCc2c[nH]cn2 34a_100000106777_100000707719 [0,2,0,0,0,0|0,0,0]=2 12847 B16R2.3000 Oc1ccc(c(c1)O)NCc2ccon2 34a_100000106777_100000234950 [0,2,0,0,0,0|2,0,0]=4 12848 B16R2.3000 Oc1ccc(c(c1)O)NCc2ccsc2 34a_100000106777_100011261437 [0,2,0,0,0,0|2,0,0]=4 12849 B16R2.3000 Oc1ccc(c(c1)O)NCc2cncs2 34a_100000106777_100015185245 [0,2,0,0,0,0|1,0,1]=4 12850 B16R2.3000 Oc1ccc(c(c1)O)NCc2cscn2 34a_100000106777_100000205941 [0,2,0,0,0,0|1,0,0]=3 12851 B16R2.3000 Oc1ccc(c(c1)O)NCc2ncc[nH]2 34a_100000106777_100016991755 [0,2,0,0,0,0|2,0,0]=4 12852 B16R2.3000 Oc1ccc(c(c1)O)NCc2ncco2 34a_100000106777_103436540062 [0,2,0,0,0,0|2,0,0]=4 12853 B16R2.3000 Oc1ccc(c(c1)O)NCc2nccs2 34a_100000106777_100015184050 [0,2,0,0,0,0|2,0,0]=4 12854 B16R2.3000 Oc1ccc(c(c1)O)NCc2ncon2 34a_100000106777_100000233494 [0,2,0,0,0,0|2,0,0]=4 12855 B16R2.3000 Oc1ccc(c(c1)O)NCn2cncn2 34a_100000106777_200020645497 [0,2,0,0,0,0|1,0,1]=4 12856 B16R2.3000 Oc1ccc(c(c1)O)SCc2c[nH]cn2 62a_100000707719_100009813921 [0,2,0,0,0,0|1,0,0]=3 12857 B16R2.3000 Oc1ccc(c(c1)O)SCc2cscn2 62a_100000205941_100009813921 [0,2,0,0,0,0|2,0,0]=4 12858 B16R2.3000 Oc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100000707719_100009879308 [0,2,0,0,0,0|2,0,0]=4 12859 B16R2.3000 Oc1ccc(c(n1)F)SCc2c[nH]cn2 62a_100009879308_100000707719 [0,2,0,0,0,0|2,0,0]=4 12860 B16R2.3000 Oc1cnc(c(c1)F)SCc2c[nH]cn2 62a_100000707719_100000063512 [0,2,0,0,0,0|2,0,0]=4 12861 B16R2.3000 [O-][n+]1cc(ccc1SCc2c[nH]cn2)F 62a_100000707719_100009817261 [0,2,0,0,0,0|2,0,0]=4 12862 B16R2.3000 [O-][n+]1cc(ccc1SCc2c[nH]cn2)F 62a_100009817261_100000707719 [0,2,0,0,0,0|2,0,0]=4 12863 B16R2.258 Brc1cc(cs1)CNc2cccc(c2)I 207a_100000211102_100000737087 [0,2,0,0,0,0|2,0,0]=4 12864 B16R2.258 Brc1cc(cs1)CNc2cccc(c2)I 270302a_100000211102_100000737087 [0,2,0,0,0,0|2,0,0]=4 12865 B16R2.258 Brc1ccc(o1)CNc2cccc(c2)I 207a_100000211102_100000185145 [0,2,0,0,0,0|2,0,0]=4 12866 B16R2.258 Brc1ccc(s1)CNc2cccc(c2)I 207a_100000211102_100000179771 [0,2,0,0,0,0|2,0,0]=4 12867 B16R2.258 Brc1ccc(s1)CNc2cccc(c2)I 270302a_100000211102_100000179771 [0,2,0,0,0,0|2,0,0]=4 12868 B16R2.258 Brc1ccc(s1)CNc2cccc(c2)I 34a_100000211102_100000708592 [0,2,0,0,0,0|2,0,0]=4 12869 B16R2.258 Brc1cccc(c1)NCc2cc(co2)Br 270302a_100000210019_100000747035 [0,2,0,0,0,0|2,0,0]=4 12870 B16R2.258 Brc1cccc(c1)NCc2cc(cs2)Br 207a_100000210019_100000211722 [0,2,0,0,0,0|2,0,0]=4 12871 B16R2.258 Brc1cccc(c1)NCc2cc(cs2)Br 270302a_100000210019_100000211722 [0,2,0,0,0,0|2,0,0]=4 12872 B16R2.258 Brc1cccc(c1)NCc2cc(cs2)Br 34a_100000210019_100000746031 [0,2,0,0,0,0|2,0,0]=4 12873 B16R2.258 Brc1cccc(c1)NCc2cc(cs2)I 207a_100000210019_100010179861 [0,2,0,0,0,0|2,0,0]=4 12874 B16R2.258 Brc1cccc(c1)NCc2cc(cs2)I 270302a_100000210019_100010179861 [0,2,0,0,0,0|2,0,0]=4 12875 B16R2.258 Brc1cccc(c1)NCc2ccc(o2)Br 207a_100000210019_100000185145 [0,2,0,0,0,0|2,0,0]=4 12876 B16R2.258 Brc1cccc(c1)NCc2ccc(o2)I 207a_100000210019_100000186757 [0,2,0,0,0,0|2,0,0]=4 12877 B16R2.258 Brc1cccc(c1)NCc2ccc(s2)Br 207a_100000210019_100000179771 [0,2,0,0,0,0|2,0,0]=4 12878 B16R2.258 Brc1cccc(c1)NCc2ccc(s2)Br 270302a_100000210019_100000179771 [0,2,0,0,0,0|2,0,0]=4 12879 B16R2.258 Brc1cccc(c1)NCc2ccc(s2)Br 34a_100000210019_100000708592 [0,2,0,0,0,0|2,0,0]=4 12880 B16R2.258 Brc1cccc(c1)NCc2cnc(s2)Br 34a_100000210019_100000717027 [0,2,0,0,0,0|1,0,1]=4 12881 B16R2.258 Brc1cccc(c1)NCc2csc(c2)Br 207a_100000210019_100000737087 [0,2,0,0,0,0|2,0,0]=4 12882 B16R2.258 Brc1cccc(c1)NCc2csc(c2)Br 270302a_100000210019_100000737087 [0,2,0,0,0,0|2,0,0]=4 12883 B16R2.258 Brc1cccc(c1)NCc2ncc(s2)Br 270302a_100000210019_100000699580 [0,2,0,0,0,0|2,0,0]=4 12884 B16R2.258 Brc1cnc(s1)CNc2cccc(c2)I 270302a_100000211102_100000699580 [0,2,0,0,0,0|2,0,0]=4 12885 B16R2.258 Brc1coc(c1)CNc2cccc(c2)I 270302a_100000211102_100000747035 [0,2,0,0,0,0|2,0,0]=4 12886 B16R2.258 Brc1csc(c1)CNc2cccc(c2)I 207a_100000211102_100000211722 [0,2,0,0,0,0|2,0,0]=4 12887 B16R2.258 Brc1csc(c1)CNc2cccc(c2)I 270302a_100000211102_100000211722 [0,2,0,0,0,0|2,0,0]=4 12888 B16R2.258 Brc1csc(c1)CNc2cccc(c2)I 34a_100000211102_100000746031 [0,2,0,0,0,0|2,0,0]=4 12889 B16R2.258 Brc1ncc(s1)CNc2cccc(c2)I 34a_100000211102_100000717027 [0,2,0,0,0,0|1,0,1]=4 12890 B16R2.258 Cc1c[nH]c(n1)CNc2cccc(c2)Br 207a_100000210019_100000082322 [0,2,0,0,0,0|2,0,0]=4 12891 B16R2.258 Cc1c[nH]c(n1)CNc2cccc(c2)Cl 207a_100000185859_100000082322 [0,2,0,0,0,0|2,0,0]=4 12892 B16R2.258 Cc1c[nH]c(n1)CNc2cccc(c2)F 207a_100000210047_100000082322 [0,2,0,0,0,0|2,0,0]=4 12893 B16R2.258 Cc1c[nH]c(n1)CNc2cccc(c2)I 207a_100000211102_100000082322 [0,2,0,0,0,0|2,0,0]=4 12894 B16R2.258 Cc1cc(ccn1)NCc2cn(cn2)C 27a_100011834058_100000758586 [0,2,0,0,0,0|1,0,0]=3 12895 B16R2.258 Cc1cc(ccn1)NCc2csc(n2)C 27a_100000707933_100000758586 [0,2,0,0,0,0|2,0,0]=4 12896 B16R2.258 Cc1cc(ccn1)NCc2n[nH]c(n2)C 27a_100000752542_100000758586 [0,2,0,0,0,0|2,0,0]=4 12897 B16R2.258 Cc1cc(ccn1)NCc2ncn(n2)C 27a_100000695864_100000758586 [0,2,0,0,0,0|2,0,0]=4 12898 B16R2.258 Cc1cc(ccn1)OCc2cn(cn2)C 34a_100000688365_100000717665 [0,2,0,0,0,0|2,0,0]=4 12899 B16R2.258 Cc1cc(ccn1)SCc2cn(cn2)C 62a_100000717665_100000758586 [0,2,0,0,0,0|2,0,0]=4 12900 B16R2.258 Cc1cc(ccn1)SCc2cn(cn2)C 62a_100000758586_100000717665 [0,2,0,0,0,0|2,0,0]=4 12901 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)Br 207a_100000210019_100011998532 [0,2,0,0,0,0|2,0,0]=4 12902 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)Br 270302a_100000210019_100011998532 [0,2,0,0,0,0|2,0,0]=4 12903 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)Cl 207a_100000185859_100011998532 [0,2,0,0,0,0|2,0,0]=4 12904 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)Cl 270302a_100000185859_100011998532 [0,2,0,0,0,0|2,0,0]=4 12905 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)F 207a_100000210047_100011998532 [0,2,0,0,0,0|2,0,0]=4 12906 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)F 270302a_100000210047_100011998532 [0,2,0,0,0,0|2,0,0]=4 12907 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)I 207a_100000211102_100011998532 [0,2,0,0,0,0|2,0,0]=4 12908 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)I 270302a_100000211102_100011998532 [0,2,0,0,0,0|2,0,0]=4 12909 B16R2.258 Cc1cc(cs1)CNc2cccc(c2)O 270302a_100000210217_100011998532 [0,2,0,0,0,0|2,0,0]=4 12910 B16R2.258 Cc1cc(ncn1)NCc2cn(cn2)C 27a_100011834058_100000744208 [0,2,0,0,0,0|2,0,0]=4 12911 B16R2.258 Cc1cc(no1)CNc2cccc(c2)Br 207a_100000210019_100011217994 [0,2,0,0,0,0|2,0,0]=4 12912 B16R2.258 Cc1cc(no1)CNc2cccc(c2)Br 34a_100000210019_100000199038 [0,2,0,0,0,0|2,0,0]=4 12913 B16R2.258 Cc1cc(no1)CNc2cccc(c2)Cl 207a_100000185859_100011217994 [0,2,0,0,0,0|2,0,0]=4 12914 B16R2.258 Cc1cc(no1)CNc2cccc(c2)Cl 34a_100000185859_100000199038 [0,2,0,0,0,0|2,0,0]=4 12915 B16R2.258 Cc1cc(no1)CNc2cccc(c2)F 207a_100000210047_100011217994 [0,2,0,0,0,0|2,0,0]=4 12916 B16R2.258 Cc1cc(no1)CNc2cccc(c2)F 34a_100000210047_100000199038 [0,2,0,0,0,0|2,0,0]=4 12917 B16R2.258 Cc1cc(no1)CNc2cccc(c2)I 207a_100000211102_100011217994 [0,2,0,0,0,0|2,0,0]=4 12918 B16R2.258 Cc1cc(no1)CNc2cccc(c2)I 34a_100000211102_100000199038 [0,2,0,0,0,0|2,0,0]=4 12919 B16R2.258 Cc1cc(no1)CNc2cccc(c2)O 34a_100000210217_100000199038 [0,2,0,0,0,0|2,0,0]=4 12920 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)Br 207a_100000210019_200000100279 [0,2,0,0,0,0|2,0,0]=4 12921 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)Br 270302a_100000210019_200000100279 [0,2,0,0,0,0|2,0,0]=4 12922 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)Cl 207a_100000185859_200000100279 [0,2,0,0,0,0|2,0,0]=4 12923 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)Cl 270302a_100000185859_200000100279 [0,2,0,0,0,0|2,0,0]=4 12924 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)F 207a_100000210047_200000100279 [0,2,0,0,0,0|2,0,0]=4 12925 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)F 270302a_100000210047_200000100279 [0,2,0,0,0,0|2,0,0]=4 12926 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)I 207a_100000211102_200000100279 [0,2,0,0,0,0|2,0,0]=4 12927 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)I 270302a_100000211102_200000100279 [0,2,0,0,0,0|2,0,0]=4 12928 B16R2.258 Cc1cc(ns1)CNc2cccc(c2)O 270302a_100000210217_200000100279 [0,2,0,0,0,0|2,0,0]=4 12929 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)Br 207a_100000210019_100000183696 [0,2,0,0,0,0|2,0,0]=4 12930 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)Br 270302a_100000210019_100000183696 [0,2,0,0,0,0|2,0,0]=4 12931 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)Cl 207a_100000185859_100000183696 [0,2,0,0,0,0|2,0,0]=4 12932 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)Cl 270302a_100000185859_100000183696 [0,2,0,0,0,0|2,0,0]=4 12933 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)F 207a_100000210047_100000183696 [0,2,0,0,0,0|2,0,0]=4 12934 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)F 270302a_100000210047_100000183696 [0,2,0,0,0,0|2,0,0]=4 12935 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)I 207a_100000211102_100000183696 [0,2,0,0,0,0|2,0,0]=4 12936 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)I 270302a_100000211102_100000183696 [0,2,0,0,0,0|2,0,0]=4 12937 B16R2.258 Cc1ccc(o1)CNc2cccc(c2)O 270302a_100000210217_100000183696 [0,2,0,0,0,0|2,0,0]=4 12938 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)Br 207a_100000210019_100000211121 [0,2,0,0,0,0|2,0,0]=4 12939 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)Br 270302a_100000210019_100000211121 [0,2,0,0,0,0|2,0,0]=4 12940 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)Cl 207a_100000185859_100000211121 [0,2,0,0,0,0|2,0,0]=4 12941 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)Cl 270302a_100000185859_100000211121 [0,2,0,0,0,0|2,0,0]=4 12942 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)F 207a_100000210047_100000211121 [0,2,0,0,0,0|2,0,0]=4 12943 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)F 270302a_100000210047_100000211121 [0,2,0,0,0,0|2,0,0]=4 12944 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)I 207a_100000211102_100000211121 [0,2,0,0,0,0|2,0,0]=4 12945 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)I 270302a_100000211102_100000211121 [0,2,0,0,0,0|2,0,0]=4 12946 B16R2.258 Cc1ccc(s1)CNc2cccc(c2)O 270302a_100000210217_100000211121 [0,2,0,0,0,0|2,0,0]=4 12947 B16R2.258 Cc1cccc(c1)C=Cc2c[nH]c(n2)C 271570a_200135466880_100009814057 [0,2,0,0,0,0|1,0,1]=4 12948 B16R2.258 Cc1cccc(c1)C=Cc2cn(cn2)C 271570a_200135466880_100000040308 [0,2,0,0,0,0|1,0,1]=4 12949 B16R2.258 Cc1cccc(c1)CSc2c[nH]c(n2)C 62a_100000211840_100009814057 [0,2,0,0,0,0|2,0,0]=4 12950 B16R2.258 Cc1cccc(c1)CSc2c[nH]c(n2)C 62a_100009814057_100000211840 [0,2,0,0,0,0|2,0,0]=4 12951 B16R2.258 Cc1cccc(c1)CSc2cn(cn2)C 62a_100000040308_100000211840 [0,2,0,0,0,0|2,0,0]=4 12952 B16R2.258 Cc1cccc(c1)CSc2cn(cn2)C 62a_100000211840_100000040308 [0,2,0,0,0,0|2,0,0]=4 12953 B16R2.258 Cc1cccc(c1)NCc2c[nH]c(n2)C 207a_100000188690_100011219055 [0,2,0,0,0,0|0,0,0]=2 12954 B16R2.258 Cc1cccc(c1)NCc2cc(co2)Br 270302a_100000188690_100000747035 [0,2,0,0,0,0|2,0,0]=4 12955 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Br 207a_100000188690_100000211722 [0,2,0,0,0,0|2,0,0]=4 12956 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Br 2230a_100000188690_100000746031 [0,2,0,0,0,0|2,0,0]=4 12957 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Br 270302a_100000188690_100000211722 [0,2,0,0,0,0|2,0,0]=4 12958 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Br 34a_100000188690_100000746031 [0,2,0,0,0,0|2,0,0]=4 12959 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)C 207a_100000188690_100102525248 [0,2,0,0,0,0|2,0,0]=4 12960 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)C 270302a_100000188690_100102525248 [0,2,0,0,0,0|2,0,0]=4 12961 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Cl 207a_100000188690_100000102487 [0,2,0,0,0,0|2,0,0]=4 12962 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)Cl 270302a_100000188690_100000102487 [0,2,0,0,0,0|2,0,0]=4 12963 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)I 207a_100000188690_100010179861 [0,2,0,0,0,0|2,0,0]=4 12964 B16R2.258 Cc1cccc(c1)NCc2cc(cs2)I 270302a_100000188690_100010179861 [0,2,0,0,0,0|2,0,0]=4 12965 B16R2.258 Cc1cccc(c1)NCc2cc(on2)C 207a_100000188690_100011217994 [0,2,0,0,0,0|2,0,0]=4 12966 B16R2.258 Cc1cccc(c1)NCc2cc(on2)C 2230a_100000188690_100000199038 [0,2,0,0,0,0|2,0,0]=4 12967 B16R2.258 Cc1cccc(c1)NCc2cc(on2)C 34a_100000188690_100000199038 [0,2,0,0,0,0|2,0,0]=4 12968 B16R2.258 Cc1cccc(c1)NCc2cc(sn2)C 207a_100000188690_200000100279 [0,2,0,0,0,0|2,0,0]=4 12969 B16R2.258 Cc1cccc(c1)NCc2cc(sn2)C 270302a_100000188690_200000100279 [0,2,0,0,0,0|2,0,0]=4 12970 B16R2.258 Cc1cccc(c1)NCc2ccc(o2)Br 207a_100000188690_100000185145 [0,2,0,0,0,0|2,0,0]=4 12971 B16R2.258 Cc1cccc(c1)NCc2ccc(o2)C 207a_100000188690_100000183696 [0,2,0,0,0,0|2,0,0]=4 12972 B16R2.258 Cc1cccc(c1)NCc2ccc(o2)C 270302a_100000188690_100000183696 [0,2,0,0,0,0|2,0,0]=4 12973 B16R2.258 Cc1cccc(c1)NCc2ccc(o2)Cl 207a_100000188690_100000188459 [0,2,0,0,0,0|2,0,0]=4 12974 B16R2.258 Cc1cccc(c1)NCc2ccc(o2)I 207a_100000188690_100000186757 [0,2,0,0,0,0|2,0,0]=4 12975 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Br 207a_100000188690_100000179771 [0,2,0,0,0,0|2,0,0]=4 12976 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Br 2230a_100000188690_100000708592 [0,2,0,0,0,0|2,0,0]=4 12977 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Br 270302a_100000188690_100000179771 [0,2,0,0,0,0|2,0,0]=4 12978 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Br 34a_100000188690_100000708592 [0,2,0,0,0,0|2,0,0]=4 12979 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)C 207a_100000188690_100000211121 [0,2,0,0,0,0|2,0,0]=4 12980 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)C 270302a_100000188690_100000211121 [0,2,0,0,0,0|2,0,0]=4 12981 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Cl 207a_100000188690_100000242774 [0,2,0,0,0,0|2,0,0]=4 12982 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Cl 2230a_100000188690_100000185097 [0,2,0,0,0,0|2,0,0]=4 12983 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Cl 270302a_100000188690_100000242774 [0,2,0,0,0,0|2,0,0]=4 12984 B16R2.258 Cc1cccc(c1)NCc2ccc(s2)Cl 34a_100000188690_100000185097 [0,2,0,0,0,0|2,0,0]=4 12985 B16R2.258 Cc1cccc(c1)NCc2ccn(n2)C 207a_100000188690_100000750880 [0,2,0,0,0,0|2,0,0]=4 12986 B16R2.258 Cc1cccc(c1)NCc2ccn(n2)C 2230a_100000188690_100000726502 [0,2,0,0,0,0|2,0,0]=4 12987 B16R2.258 Cc1cccc(c1)NCc2ccn(n2)C 270302a_100000188690_100000750880 [0,2,0,0,0,0|2,0,0]=4 12988 B16R2.258 Cc1cccc(c1)NCc2ccn(n2)C 34a_100000188690_100000726502 [0,2,0,0,0,0|2,0,0]=4 12989 B16R2.258 Cc1cccc(c1)NCc2cn(cn2)C 207a_100000188690_100000684808 [0,2,0,0,0,0|0,0,0]=2 12990 B16R2.258 Cc1cccc(c1)NCc2cn(cn2)C 2230a_100000188690_100000717665 [0,2,0,0,0,0|0,0,0]=2 12991 B16R2.258 Cc1cccc(c1)NCc2cn(cn2)C 34a_100000188690_100000717665 [0,2,0,0,0,0|0,0,0]=2 12992 B16R2.258 Cc1cccc(c1)NCc2cn(nn2)C 207a_100000188690_100000749909 [0,2,0,0,0,0|1,0,0]=3 12993 B16R2.258 Cc1cccc(c1)NCc2cnc(o2)C 207a_100000188690_100000084308 [0,2,0,0,0,0|1,0,1]=4 12994 B16R2.258 Cc1cccc(c1)NCc2cnc(o2)C 270302a_100000188690_100000084308 [0,2,0,0,0,0|1,0,1]=4 12995 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)Br 2230a_100000188690_100000717027 [0,2,0,0,0,0|1,0,1]=4 12996 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)Br 34a_100000188690_100000717027 [0,2,0,0,0,0|1,0,1]=4 12997 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)C 207a_100000188690_100000740557 [0,2,0,0,0,0|1,0,1]=4 12998 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)C 2230a_100000188690_100020635045 [0,2,0,0,0,0|1,0,1]=4 12999 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)C 34a_100000188690_100020635045 [0,2,0,0,0,0|1,0,1]=4 13000 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)Cl 2230a_100000188690_100000058068 [0,2,0,0,0,0|1,0,1]=4 13001 B16R2.258 Cc1cccc(c1)NCc2cnc(s2)Cl 34a_100000188690_100000058068 [0,2,0,0,0,0|1,0,1]=4 13002 B16R2.258 Cc1cccc(c1)NCc2cnn(c2)C 207a_100000188690_100000206001 [0,2,0,0,0,0|2,0,0]=4 13003 B16R2.258 Cc1cccc(c1)NCc2cnn(c2)C 2230a_100000188690_100000744441 [0,2,0,0,0,0|2,0,0]=4 13004 B16R2.258 Cc1cccc(c1)NCc2cnn(c2)C 270302a_100000188690_100000206001 [0,2,0,0,0,0|2,0,0]=4 13005 B16R2.258 Cc1cccc(c1)NCc2cnn(c2)C 34a_100000188690_100000744441 [0,2,0,0,0,0|2,0,0]=4 13006 B16R2.258 Cc1cccc(c1)NCc2coc(n2)C 207a_100000188690_100011361629 [0,2,0,0,0,0|1,0,0]=3 13007 B16R2.258 Cc1cccc(c1)NCc2csc(c2)Br 207a_100000188690_100000737087 [0,2,0,0,0,0|2,0,0]=4 13008 B16R2.258 Cc1cccc(c1)NCc2csc(c2)Br 270302a_100000188690_100000737087 [0,2,0,0,0,0|2,0,0]=4 13009 B16R2.258 Cc1cccc(c1)NCc2csc(c2)C 207a_100000188690_100011998532 [0,2,0,0,0,0|2,0,0]=4 13010 B16R2.258 Cc1cccc(c1)NCc2csc(c2)C 270302a_100000188690_100011998532 [0,2,0,0,0,0|2,0,0]=4 13011 B16R2.258 Cc1cccc(c1)NCc2csc(c2)Cl 207a_100000188690_100009844934 [0,2,0,0,0,0|2,0,0]=4 13012 B16R2.258 Cc1cccc(c1)NCc2csc(c2)Cl 270302a_100000188690_100009844934 [0,2,0,0,0,0|2,0,0]=4 13013 B16R2.258 Cc1cccc(c1)NCc2csc(n2)C 207a_100000188690_100000203724 [0,2,0,0,0,0|1,0,0]=3 13014 B16R2.258 Cc1cccc(c1)NCc2csc(n2)C 2230a_100000188690_100015186478 [0,2,0,0,0,0|1,0,0]=3 13015 B16R2.258 Cc1cccc(c1)NCc2csc(n2)C 270302a_100000188690_100000203724 [0,2,0,0,0,0|1,0,0]=3 13016 B16R2.258 Cc1cccc(c1)NCc2csc(n2)C 34a_100000188690_100015186478 [0,2,0,0,0,0|1,0,0]=3 13017 B16R2.258 Cc1cccc(c1)NCc2csc(n2)Cl 2230a_100000188690_100000024076 [0,2,0,0,0,0|1,0,0]=3 13018 B16R2.258 Cc1cccc(c1)NCc2csc(n2)Cl 34a_100000188690_100000024076 [0,2,0,0,0,0|1,0,0]=3 13019 B16R2.258 Cc1cccc(c1)NCc2n[nH]c(=O)[nH]2 2230a_100000188690_100000754189 [0,2,0,0,0,0|1,0,1]=4 13020 B16R2.258 Cc1cccc(c1)NCc2nc(c[nH]2)C 207a_100000188690_100000082322 [0,2,0,0,0,0|2,0,0]=4 13021 B16R2.258 Cc1cccc(c1)NCc2nc(cs2)C 207a_100000188690_100000756994 [0,2,0,0,0,0|2,0,0]=4 13022 B16R2.258 Cc1cccc(c1)NCc2nc(no2)C 2230a_100000188690_100000735555 [0,2,0,0,0,0|1,0,1]=4 13023 B16R2.258 Cc1cccc(c1)NCc2nc(no2)C 34a_100000188690_100000735555 [0,2,0,0,0,0|1,0,1]=4 13024 B16R2.258 Cc1cccc(c1)NCc2ncc(s2)Br 270302a_100000188690_100000699580 [0,2,0,0,0,0|2,0,0]=4 13025 B16R2.258 Cc1cccc(c1)NCc2ncc(s2)C 207a_100000188690_100011361622 [0,2,0,0,0,0|2,0,0]=4 13026 B16R2.258 Cc1cccc(c1)NCc2ncc(s2)C 270302a_100000188690_100011361622 [0,2,0,0,0,0|2,0,0]=4 13027 B16R2.258 Cc1cccc(c1)NCc2ncc(s2)Cl 270302a_100000188690_100000699884 [0,2,0,0,0,0|2,0,0]=4 13028 B16R2.258 Cc1cccc(c1)NCc2ncn(n2)C 207a_100000188690_100010630104 [0,2,0,0,0,0|1,0,0]=3 13029 B16R2.258 Cc1cccc(c1)NCc2ncn(n2)C 2230a_100000188690_100016995526 [0,2,0,0,0,0|1,0,0]=3 13030 B16R2.258 Cc1cccc(c1)NCc2ncn(n2)C 34a_100000188690_100016995526 [0,2,0,0,0,0|1,0,0]=3 13031 B16R2.258 Cc1cccc(c1)NCc2noc(n2)C 2230a_100000188690_100000231061 [0,2,0,0,0,0|2,0,0]=4 13032 B16R2.258 Cc1cccc(c1)NCc2noc(n2)C 34a_100000188690_100000231061 [0,2,0,0,0,0|2,0,0]=4 13033 B16R2.258 Cc1cccc(c1)NCc2nsc(n2)Cl 2230a_100000188690_100000043760 [0,2,0,0,0,0|2,0,0]=4 13034 B16R2.258 Cc1cccc(c1)NCc2nsc(n2)Cl 34a_100000188690_100000043760 [0,2,0,0,0,0|2,0,0]=4 13035 B16R2.258 Cc1cccc(c1)OCc2cn(cn2)C 34a_100000210337_100000717665 [0,2,0,0,0,0|1,0,0]=3 13036 B16R2.258 Cc1cccc(c1)OCc2cn(cn2)C 7a_100000210337_100000717665 [0,2,0,0,0,0|1,0,0]=3 13037 B16R2.258 Cc1cccc(c1)OCc2cn(nn2)C 274090a_200000210301_100000172635 [0,2,0,0,0,0|2,0,0]=4 13038 B16R2.258 Cc1cccc(c1)OCc2cn(nn2)[13CH3] 274090a_200025704644_100000172635 [0,2,0,0,0,0|2,0,0]=4 13039 B16R2.258 Cc1cccc(c1)OCc2csc(n2)C 34a_100000210337_100015186478 [0,2,0,0,0,0|2,0,0]=4 13040 B16R2.258 Cc1cccc(c1)OCc2csc(n2)C 7a_100000210337_100015186478 [0,2,0,0,0,0|2,0,0]=4 13041 B16R2.258 Cc1cccc(c1)OCc2csc(n2)Cl 34a_100000210337_100000024076 [0,2,0,0,0,0|2,0,0]=4 13042 B16R2.258 Cc1cccc(c1)OCc2csc(n2)Cl 7a_100000210337_100000024076 [0,2,0,0,0,0|2,0,0]=4 13043 B16R2.258 Cc1cccc(c1)OCc2ncn(n2)C 34a_100000210337_100016995526 [0,2,0,0,0,0|2,0,0]=4 13044 B16R2.258 Cc1cccc(c1)OCc2ncn(n2)C 7a_100000210337_100016995526 [0,2,0,0,0,0|2,0,0]=4 13045 B16R2.258 Cc1cccc(c1)SCc2cn(cn2)C 62a_100000717665_100011215228 [0,2,0,0,0,0|1,0,0]=3 13046 B16R2.258 Cc1cccc(c1)SCc2cn(cn2)C 62a_100011215228_100000717665 [0,2,0,0,0,0|1,0,0]=3 13047 B16R2.258 Cc1cccc(c1)SCc2csc(n2)C 62a_100011215228_100015186478 [0,2,0,0,0,0|2,0,0]=4 13048 B16R2.258 Cc1cccc(c1)SCc2csc(n2)C 62a_100015186478_100011215228 [0,2,0,0,0,0|2,0,0]=4 13049 B16R2.258 Cc1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_100011215228 [0,2,0,0,0,0|2,0,0]=4 13050 B16R2.258 Cc1cccc(c1)SCc2csc(n2)Cl 62a_100011215228_100000024076 [0,2,0,0,0,0|2,0,0]=4 13051 B16R2.258 Cc1cccc(c1)SCc2ncn(n2)C 62a_100011215228_100016995526 [0,2,0,0,0,0|2,0,0]=4 13052 B16R2.258 Cc1cccc(c1)SCc2ncn(n2)C 62a_100016995526_100011215228 [0,2,0,0,0,0|2,0,0]=4 13053 B16R2.258 Cc1cccc(n1)SCc2cn(cn2)C 62a_100000717665_100000742759 [0,2,0,0,0,0|2,0,0]=4 13054 B16R2.258 Cc1cccc(n1)SCc2cn(cn2)C 62a_100000742759_100000717665 [0,2,0,0,0,0|2,0,0]=4 13055 B16R2.258 Cc1ccnc(c1)SCc2cn(cn2)C 62a_100000717665_100000750283 [0,2,0,0,0,0|2,0,0]=4 13056 B16R2.258 Cc1ccnc(c1)SCc2cn(cn2)C 62a_100000750283_100000717665 [0,2,0,0,0,0|2,0,0]=4 13057 B16R2.258 Cc1ccnc(n1)NCc2cn(cn2)C 27a_100011834058_100000750684 [0,2,0,0,0,0|2,0,0]=4 13058 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)Br 207a_100000210019_100011361622 [0,2,0,0,0,0|2,0,0]=4 13059 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)Br 270302a_100000210019_100011361622 [0,2,0,0,0,0|2,0,0]=4 13060 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)Cl 207a_100000185859_100011361622 [0,2,0,0,0,0|2,0,0]=4 13061 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)Cl 270302a_100000185859_100011361622 [0,2,0,0,0,0|2,0,0]=4 13062 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)F 207a_100000210047_100011361622 [0,2,0,0,0,0|2,0,0]=4 13063 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)F 270302a_100000210047_100011361622 [0,2,0,0,0,0|2,0,0]=4 13064 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)I 207a_100000211102_100011361622 [0,2,0,0,0,0|2,0,0]=4 13065 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)I 270302a_100000211102_100011361622 [0,2,0,0,0,0|2,0,0]=4 13066 B16R2.258 Cc1cnc(s1)CNc2cccc(c2)O 270302a_100000210217_100011361622 [0,2,0,0,0,0|2,0,0]=4 13067 B16R2.258 Cc1cncc(c1)OCc2cn(cn2)C 34a_100011830280_100000717665 [0,2,0,0,0,0|2,0,0]=4 13068 B16R2.258 Cc1cncc(c1)OCc2cn(cn2)C 7a_100011830280_100000717665 [0,2,0,0,0,0|2,0,0]=4 13069 B16R2.258 Cc1cncc(c1)SCc2cn(cn2)C 62a_100000717665_100000760492 [0,2,0,0,0,0|2,0,0]=4 13070 B16R2.258 Cc1cncc(c1)SCc2cn(cn2)C 62a_100000760492_100000717665 [0,2,0,0,0,0|2,0,0]=4 13071 B16R2.258 Cc1cncc(n1)NCc2cn(cn2)C 27a_100011834058_100000754123 [0,2,0,0,0,0|2,0,0]=4 13072 B16R2.258 Cc1cnnc(c1)NCc2cn(cn2)C 27a_100011834058_100000070100 [0,2,0,0,0,0|2,0,0]=4 13073 B16R2.258 Cc1csc(c1)CNc2cccc(c2)Br 207a_100000210019_100102525248 [0,2,0,0,0,0|2,0,0]=4 13074 B16R2.258 Cc1csc(c1)CNc2cccc(c2)Br 270302a_100000210019_100102525248 [0,2,0,0,0,0|2,0,0]=4 13075 B16R2.258 Cc1csc(c1)CNc2cccc(c2)Cl 207a_100000185859_100102525248 [0,2,0,0,0,0|2,0,0]=4 13076 B16R2.258 Cc1csc(c1)CNc2cccc(c2)Cl 270302a_100000185859_100102525248 [0,2,0,0,0,0|2,0,0]=4 13077 B16R2.258 Cc1csc(c1)CNc2cccc(c2)F 207a_100000210047_100102525248 [0,2,0,0,0,0|2,0,0]=4 13078 B16R2.258 Cc1csc(c1)CNc2cccc(c2)F 270302a_100000210047_100102525248 [0,2,0,0,0,0|2,0,0]=4 13079 B16R2.258 Cc1csc(c1)CNc2cccc(c2)I 207a_100000211102_100102525248 [0,2,0,0,0,0|2,0,0]=4 13080 B16R2.258 Cc1csc(c1)CNc2cccc(c2)I 270302a_100000211102_100102525248 [0,2,0,0,0,0|2,0,0]=4 13081 B16R2.258 Cc1csc(c1)CNc2cccc(c2)O 270302a_100000210217_100102525248 [0,2,0,0,0,0|2,0,0]=4 13082 B16R2.258 Cc1csc(n1)CNc2cccc(c2)Br 207a_100000210019_100000756994 [0,2,0,0,0,0|2,0,0]=4 13083 B16R2.258 Cc1csc(n1)CNc2cccc(c2)Cl 207a_100000185859_100000756994 [0,2,0,0,0,0|2,0,0]=4 13084 B16R2.258 Cc1csc(n1)CNc2cccc(c2)F 207a_100000210047_100000756994 [0,2,0,0,0,0|2,0,0]=4 13085 B16R2.258 Cc1csc(n1)CNc2cccc(c2)I 207a_100000211102_100000756994 [0,2,0,0,0,0|2,0,0]=4 13086 B16R2.258 Cc1nc(c[nH]1)C=Cc2cccc(c2)Cl 271570a_100102525933_100009814057 [0,2,0,0,0,0|1,0,1]=4 13087 B16R2.258 Cc1nc(c[nH]1)C=Cc2cccc(c2)F 271570a_100102525537_100009814057 [0,2,0,0,0,0|1,0,1]=4 13088 B16R2.258 Cc1nc(c[nH]1)CNc2cccc(c2)Br 207a_100000210019_100011219055 [0,2,0,0,0,0|0,0,0]=2 13089 B16R2.258 Cc1nc(c[nH]1)CNc2cccc(c2)Cl 207a_100000185859_100011219055 [0,2,0,0,0,0|0,0,0]=2 13090 B16R2.258 Cc1nc(c[nH]1)CNc2cccc(c2)F 207a_100000210047_100011219055 [0,2,0,0,0,0|0,0,0]=2 13091 B16R2.258 Cc1nc(c[nH]1)CNc2cccc(c2)I 207a_100000211102_100011219055 [0,2,0,0,0,0|0,0,0]=2 13092 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)Br 62a_100000211773_100009814057 [0,2,0,0,0,0|2,0,0]=4 13093 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)Br 62a_100009814057_100000211773 [0,2,0,0,0,0|2,0,0]=4 13094 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)Cl 62a_100000187163_100009814057 [0,2,0,0,0,0|2,0,0]=4 13095 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)Cl 62a_100009814057_100000187163 [0,2,0,0,0,0|2,0,0]=4 13096 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)F 62a_100000230114_100009814057 [0,2,0,0,0,0|2,0,0]=4 13097 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)F 62a_100009814057_100000230114 [0,2,0,0,0,0|2,0,0]=4 13098 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)I 62a_100009814057_100011218688 [0,2,0,0,0,0|2,0,0]=4 13099 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)I 62a_100011218688_100009814057 [0,2,0,0,0,0|2,0,0]=4 13100 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)O 62a_100009814057_100011660834 [0,2,0,0,0,0|2,0,0]=4 13101 B16R2.258 Cc1nc(c[nH]1)SCc2cccc(c2)O 62a_100011660834_100009814057 [0,2,0,0,0,0|2,0,0]=4 13102 B16R2.258 Cc1nc(co1)CNc2cccc(c2)Br 207a_100000210019_100011361629 [0,2,0,0,0,0|1,0,0]=3 13103 B16R2.258 Cc1nc(co1)CNc2cccc(c2)Cl 207a_100000185859_100011361629 [0,2,0,0,0,0|1,0,0]=3 13104 B16R2.258 Cc1nc(co1)CNc2cccc(c2)F 207a_100000210047_100011361629 [0,2,0,0,0,0|1,0,0]=3 13105 B16R2.258 Cc1nc(co1)CNc2cccc(c2)I 207a_100000211102_100011361629 [0,2,0,0,0,0|1,0,0]=3 13106 B16R2.258 Cc1nc(cs1)CNc2cc(ccn2)F 27a_100000707933_100000764206 [0,2,0,0,0,0|2,0,0]=4 13107 B16R2.258 Cc1nc(cs1)CNc2cc[nH]c(=O)c2 27a_100000707933_100000061649 [0,2,0,0,0,0|2,0,0]=4 13108 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Br 207a_100000210019_100000203724 [0,2,0,0,0,0|1,0,0]=3 13109 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Br 270302a_100000210019_100000203724 [0,2,0,0,0,0|1,0,0]=3 13110 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Br 34a_100000210019_100015186478 [0,2,0,0,0,0|1,0,0]=3 13111 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Cl 207a_100000185859_100000203724 [0,2,0,0,0,0|1,0,0]=3 13112 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Cl 270302a_100000185859_100000203724 [0,2,0,0,0,0|1,0,0]=3 13113 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)Cl 34a_100000185859_100015186478 [0,2,0,0,0,0|1,0,0]=3 13114 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)F 207a_100000210047_100000203724 [0,2,0,0,0,0|1,0,0]=3 13115 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)F 270302a_100000210047_100000203724 [0,2,0,0,0,0|1,0,0]=3 13116 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)F 34a_100000210047_100015186478 [0,2,0,0,0,0|1,0,0]=3 13117 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)I 207a_100000211102_100000203724 [0,2,0,0,0,0|1,0,0]=3 13118 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)I 270302a_100000211102_100000203724 [0,2,0,0,0,0|1,0,0]=3 13119 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)I 34a_100000211102_100015186478 [0,2,0,0,0,0|1,0,0]=3 13120 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)O 270302a_100000210217_100000203724 [0,2,0,0,0,0|1,0,0]=3 13121 B16R2.258 Cc1nc(cs1)CNc2cccc(c2)O 34a_100000210217_100015186478 [0,2,0,0,0,0|1,0,0]=3 13122 B16R2.258 Cc1nc(cs1)CNc2cccc(n2)F 27a_100000707933_100009815982 [0,2,0,0,0,0|2,0,0]=4 13123 B16R2.258 Cc1nc(cs1)CNc2ccnc(c2)F 27a_100000707933_100009816116 [0,2,0,0,0,0|2,0,0]=4 13124 B16R2.258 Cc1nc(cs1)COc2cccc(c2)Br 34a_100000210342_100015186478 [0,2,0,0,0,0|2,0,0]=4 13125 B16R2.258 Cc1nc(cs1)COc2cccc(c2)Br 7a_100000210342_100015186478 [0,2,0,0,0,0|2,0,0]=4 13126 B16R2.258 Cc1nc(cs1)COc2cccc(c2)Cl 34a_100000210295_100015186478 [0,2,0,0,0,0|2,0,0]=4 13127 B16R2.258 Cc1nc(cs1)COc2cccc(c2)Cl 7a_100000210295_100015186478 [0,2,0,0,0,0|2,0,0]=4 13128 B16R2.258 Cc1nc(cs1)COc2cccc(c2)F 34a_100000210426_100015186478 [0,2,0,0,0,0|2,0,0]=4 13129 B16R2.258 Cc1nc(cs1)COc2cccc(c2)F 7a_100000210426_100015186478 [0,2,0,0,0,0|2,0,0]=4 13130 B16R2.258 Cc1nc(cs1)COc2cccc(c2)I 34a_100000211634_100015186478 [0,2,0,0,0,0|2,0,0]=4 13131 B16R2.258 Cc1nc(cs1)COc2cccc(c2)I 7a_100000211634_100015186478 [0,2,0,0,0,0|2,0,0]=4 13132 B16R2.258 Cc1nc(cs1)COc2cccc(c2)N 34a_100000210217_100015186478 [0,2,0,0,0,0|2,0,0]=4 13133 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)Br 62a_100000691529_100015186478 [0,2,0,0,0,0|2,0,0]=4 13134 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)Br 62a_100015186478_100000691529 [0,2,0,0,0,0|2,0,0]=4 13135 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)Cl 62a_100000699651_100015186478 [0,2,0,0,0,0|2,0,0]=4 13136 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)Cl 62a_100015186478_100000699651 [0,2,0,0,0,0|2,0,0]=4 13137 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)F 62a_100000685547_100015186478 [0,2,0,0,0,0|2,0,0]=4 13138 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)F 62a_100015186478_100000685547 [0,2,0,0,0,0|2,0,0]=4 13139 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)N 62a_100000210019_100015186478 [0,2,0,0,0,0|2,0,0]=4 13140 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)N 62a_100015186478_100000210019 [0,2,0,0,0,0|2,0,0]=4 13141 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)O 62a_100015186478_100000211634 [0,2,0,0,0,0|2,0,0]=4 13142 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)[S] 62a_100015186478_114929384022 [0,2,0,0,0,0|2,0,0]=4 13143 B16R2.258 Cc1nc(cs1)CSc2cccc(c2)[S] 62a_114929384022_100015186478 [0,2,0,0,0,0|2,0,0]=4 13144 B16R2.258 Cc1nc(n[nH]1)CNc2cc(ccn2)F 27a_100000752542_100000764206 [0,2,0,0,0,0|2,0,0]=4 13145 B16R2.258 Cc1nc(n[nH]1)CNc2cc[nH]c(=O)c2 27a_100000752542_100000061649 [0,2,0,0,0,0|2,0,0]=4 13146 B16R2.258 Cc1nc(n[nH]1)CNc2cccc(n2)F 27a_100000752542_100009815982 [0,2,0,0,0,0|2,0,0]=4 13147 B16R2.258 Cc1nc(n[nH]1)CNc2ccnc(c2)F 27a_100000752542_100009816116 [0,2,0,0,0,0|2,0,0]=4 13148 B16R2.258 Cc1nc(no1)CNc2cccc(c2)Br 34a_100000210019_100000231061 [0,2,0,0,0,0|2,0,0]=4 13149 B16R2.258 Cc1nc(no1)CNc2cccc(c2)Cl 34a_100000185859_100000231061 [0,2,0,0,0,0|2,0,0]=4 13150 B16R2.258 Cc1nc(no1)CNc2cccc(c2)F 34a_100000210047_100000231061 [0,2,0,0,0,0|2,0,0]=4 13151 B16R2.258 Cc1nc(no1)CNc2cccc(c2)I 34a_100000211102_100000231061 [0,2,0,0,0,0|2,0,0]=4 13152 B16R2.258 Cc1nc(no1)CNc2cccc(c2)O 34a_100000210217_100000231061 [0,2,0,0,0,0|2,0,0]=4 13153 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)Br 207a_100000210019_100000084308 [0,2,0,0,0,0|1,0,1]=4 13154 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)Br 270302a_100000210019_100000084308 [0,2,0,0,0,0|1,0,1]=4 13155 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)Cl 207a_100000185859_100000084308 [0,2,0,0,0,0|1,0,1]=4 13156 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)Cl 270302a_100000185859_100000084308 [0,2,0,0,0,0|1,0,1]=4 13157 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)F 207a_100000210047_100000084308 [0,2,0,0,0,0|1,0,1]=4 13158 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)F 270302a_100000210047_100000084308 [0,2,0,0,0,0|1,0,1]=4 13159 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)I 207a_100000211102_100000084308 [0,2,0,0,0,0|1,0,1]=4 13160 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)I 270302a_100000211102_100000084308 [0,2,0,0,0,0|1,0,1]=4 13161 B16R2.258 Cc1ncc(o1)CNc2cccc(c2)O 270302a_100000210217_100000084308 [0,2,0,0,0,0|1,0,1]=4 13162 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)Br 207a_100000210019_100000740557 [0,2,0,0,0,0|1,0,1]=4 13163 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)Br 34a_100000210019_100020635045 [0,2,0,0,0,0|1,0,1]=4 13164 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)Cl 207a_100000185859_100000740557 [0,2,0,0,0,0|1,0,1]=4 13165 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)Cl 34a_100000185859_100020635045 [0,2,0,0,0,0|1,0,1]=4 13166 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)F 207a_100000210047_100000740557 [0,2,0,0,0,0|1,0,1]=4 13167 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)F 34a_100000210047_100020635045 [0,2,0,0,0,0|1,0,1]=4 13168 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)I 207a_100000211102_100000740557 [0,2,0,0,0,0|1,0,1]=4 13169 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)I 34a_100000211102_100020635045 [0,2,0,0,0,0|1,0,1]=4 13170 B16R2.258 Cc1ncc(s1)CNc2cccc(c2)O 34a_100000210217_100020635045 [0,2,0,0,0,0|1,0,1]=4 13171 B16R2.258 Cc1nccc(n1)NCc2cn(cn2)C 27a_100011834058_100000749937 [0,2,0,0,0,0|2,0,0]=4 13172 B16R2.258 Cc1noc(n1)CNc2cccc(c2)Br 34a_100000210019_100000735555 [0,2,0,0,0,0|1,0,1]=4 13173 B16R2.258 Cc1noc(n1)CNc2cccc(c2)Cl 34a_100000185859_100000735555 [0,2,0,0,0,0|1,0,1]=4 13174 B16R2.258 Cc1noc(n1)CNc2cccc(c2)F 34a_100000210047_100000735555 [0,2,0,0,0,0|1,0,1]=4 13175 B16R2.258 Cc1noc(n1)CNc2cccc(c2)I 34a_100000211102_100000735555 [0,2,0,0,0,0|1,0,1]=4 13176 B16R2.258 Cc1noc(n1)CNc2cccc(c2)O 34a_100000210217_100000735555 [0,2,0,0,0,0|1,0,1]=4 13177 B16R2.258 Clc1cc(cs1)CNc2cccc(c2)Br 207a_100000210019_100009844934 [0,2,0,0,0,0|2,0,0]=4 13178 B16R2.258 Clc1cc(cs1)CNc2cccc(c2)Br 270302a_100000210019_100009844934 [0,2,0,0,0,0|2,0,0]=4 13179 B16R2.258 Clc1cc(cs1)CNc2cccc(c2)I 207a_100000211102_100009844934 [0,2,0,0,0,0|2,0,0]=4 13180 B16R2.258 Clc1cc(cs1)CNc2cccc(c2)I 270302a_100000211102_100009844934 [0,2,0,0,0,0|2,0,0]=4 13181 B16R2.258 Clc1ccc(o1)CNc2cccc(c2)Br 207a_100000210019_100000188459 [0,2,0,0,0,0|2,0,0]=4 13182 B16R2.258 Clc1ccc(o1)CNc2cccc(c2)I 207a_100000211102_100000188459 [0,2,0,0,0,0|2,0,0]=4 13183 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)Br 207a_100000210019_100000242774 [0,2,0,0,0,0|2,0,0]=4 13184 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)Br 270302a_100000210019_100000242774 [0,2,0,0,0,0|2,0,0]=4 13185 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)Br 34a_100000210019_100000185097 [0,2,0,0,0,0|2,0,0]=4 13186 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)I 207a_100000211102_100000242774 [0,2,0,0,0,0|2,0,0]=4 13187 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)I 270302a_100000211102_100000242774 [0,2,0,0,0,0|2,0,0]=4 13188 B16R2.258 Clc1ccc(s1)CNc2cccc(c2)I 34a_100000211102_100000185097 [0,2,0,0,0,0|2,0,0]=4 13189 B16R2.258 Clc1cccc(c1)NCc2cc(co2)Br 270302a_100000185859_100000747035 [0,2,0,0,0,0|2,0,0]=4 13190 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)Br 207a_100000185859_100000211722 [0,2,0,0,0,0|2,0,0]=4 13191 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)Br 270302a_100000185859_100000211722 [0,2,0,0,0,0|2,0,0]=4 13192 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)Br 34a_100000185859_100000746031 [0,2,0,0,0,0|2,0,0]=4 13193 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)Cl 207a_100000185859_100000102487 [0,2,0,0,0,0|2,0,0]=4 13194 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)Cl 270302a_100000185859_100000102487 [0,2,0,0,0,0|2,0,0]=4 13195 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)I 207a_100000185859_100010179861 [0,2,0,0,0,0|2,0,0]=4 13196 B16R2.258 Clc1cccc(c1)NCc2cc(cs2)I 270302a_100000185859_100010179861 [0,2,0,0,0,0|2,0,0]=4 13197 B16R2.258 Clc1cccc(c1)NCc2ccc(o2)Br 207a_100000185859_100000185145 [0,2,0,0,0,0|2,0,0]=4 13198 B16R2.258 Clc1cccc(c1)NCc2ccc(o2)Cl 207a_100000185859_100000188459 [0,2,0,0,0,0|2,0,0]=4 13199 B16R2.258 Clc1cccc(c1)NCc2ccc(o2)I 207a_100000185859_100000186757 [0,2,0,0,0,0|2,0,0]=4 13200 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Br 207a_100000185859_100000179771 [0,2,0,0,0,0|2,0,0]=4 13201 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Br 270302a_100000185859_100000179771 [0,2,0,0,0,0|2,0,0]=4 13202 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Br 34a_100000185859_100000708592 [0,2,0,0,0,0|2,0,0]=4 13203 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Cl 207a_100000185859_100000242774 [0,2,0,0,0,0|2,0,0]=4 13204 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Cl 270302a_100000185859_100000242774 [0,2,0,0,0,0|2,0,0]=4 13205 B16R2.258 Clc1cccc(c1)NCc2ccc(s2)Cl 34a_100000185859_100000185097 [0,2,0,0,0,0|2,0,0]=4 13206 B16R2.258 Clc1cccc(c1)NCc2cnc(s2)Br 34a_100000185859_100000717027 [0,2,0,0,0,0|1,0,1]=4 13207 B16R2.258 Clc1cccc(c1)NCc2cnc(s2)Cl 34a_100000185859_100000058068 [0,2,0,0,0,0|1,0,1]=4 13208 B16R2.258 Clc1cccc(c1)NCc2csc(c2)Br 207a_100000185859_100000737087 [0,2,0,0,0,0|2,0,0]=4 13209 B16R2.258 Clc1cccc(c1)NCc2csc(c2)Br 270302a_100000185859_100000737087 [0,2,0,0,0,0|2,0,0]=4 13210 B16R2.258 Clc1cccc(c1)NCc2csc(c2)Cl 207a_100000185859_100009844934 [0,2,0,0,0,0|2,0,0]=4 13211 B16R2.258 Clc1cccc(c1)NCc2csc(c2)Cl 270302a_100000185859_100009844934 [0,2,0,0,0,0|2,0,0]=4 13212 B16R2.258 Clc1cccc(c1)NCc2csc(n2)Cl 34a_100000185859_100000024076 [0,2,0,0,0,0|1,0,0]=3 13213 B16R2.258 Clc1cccc(c1)NCc2ncc(s2)Br 270302a_100000185859_100000699580 [0,2,0,0,0,0|2,0,0]=4 13214 B16R2.258 Clc1cccc(c1)NCc2ncc(s2)Cl 270302a_100000185859_100000699884 [0,2,0,0,0,0|2,0,0]=4 13215 B16R2.258 Clc1cccc(c1)NCc2nsc(n2)Cl 34a_100000185859_100000043760 [0,2,0,0,0,0|2,0,0]=4 13216 B16R2.258 Clc1cccc(c1)OCc2csc(n2)Cl 34a_100000210295_100000024076 [0,2,0,0,0,0|2,0,0]=4 13217 B16R2.258 Clc1cccc(c1)OCc2csc(n2)Cl 7a_100000210295_100000024076 [0,2,0,0,0,0|2,0,0]=4 13218 B16R2.258 Clc1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_100000699651 [0,2,0,0,0,0|2,0,0]=4 13219 B16R2.258 Clc1cccc(c1)SCc2csc(n2)Cl 62a_100000699651_100000024076 [0,2,0,0,0,0|2,0,0]=4 13220 B16R2.258 Clc1cnc(s1)CNc2cccc(c2)Br 270302a_100000210019_100000699884 [0,2,0,0,0,0|2,0,0]=4 13221 B16R2.258 Clc1cnc(s1)CNc2cccc(c2)I 270302a_100000211102_100000699884 [0,2,0,0,0,0|2,0,0]=4 13222 B16R2.258 Clc1csc(c1)CNc2cccc(c2)Br 207a_100000210019_100000102487 [0,2,0,0,0,0|2,0,0]=4 13223 B16R2.258 Clc1csc(c1)CNc2cccc(c2)Br 270302a_100000210019_100000102487 [0,2,0,0,0,0|2,0,0]=4 13224 B16R2.258 Clc1csc(c1)CNc2cccc(c2)I 207a_100000211102_100000102487 [0,2,0,0,0,0|2,0,0]=4 13225 B16R2.258 Clc1csc(c1)CNc2cccc(c2)I 270302a_100000211102_100000102487 [0,2,0,0,0,0|2,0,0]=4 13226 B16R2.258 Clc1nc(cs1)CNc2cccc(c2)Br 34a_100000210019_100000024076 [0,2,0,0,0,0|1,0,0]=3 13227 B16R2.258 Clc1nc(cs1)CNc2cccc(c2)I 34a_100000211102_100000024076 [0,2,0,0,0,0|1,0,0]=3 13228 B16R2.258 Clc1nc(cs1)COc2cccc(c2)Br 34a_100000210342_100000024076 [0,2,0,0,0,0|2,0,0]=4 13229 B16R2.258 Clc1nc(cs1)COc2cccc(c2)Br 7a_100000210342_100000024076 [0,2,0,0,0,0|2,0,0]=4 13230 B16R2.258 Clc1nc(cs1)COc2cccc(c2)I 34a_100000211634_100000024076 [0,2,0,0,0,0|2,0,0]=4 13231 B16R2.258 Clc1nc(cs1)COc2cccc(c2)I 7a_100000211634_100000024076 [0,2,0,0,0,0|2,0,0]=4 13232 B16R2.258 Clc1nc(cs1)CSc2cccc(c2)Br 62a_100000024076_100000691529 [0,2,0,0,0,0|2,0,0]=4 13233 B16R2.258 Clc1nc(cs1)CSc2cccc(c2)Br 62a_100000691529_100000024076 [0,2,0,0,0,0|2,0,0]=4 13234 B16R2.258 Clc1nc(ns1)CNc2cccc(c2)Br 34a_100000210019_100000043760 [0,2,0,0,0,0|2,0,0]=4 13235 B16R2.258 Clc1nc(ns1)CNc2cccc(c2)I 34a_100000211102_100000043760 [0,2,0,0,0,0|2,0,0]=4 13236 B16R2.258 Clc1ncc(s1)CNc2cccc(c2)Br 34a_100000210019_100000058068 [0,2,0,0,0,0|1,0,1]=4 13237 B16R2.258 Clc1ncc(s1)CNc2cccc(c2)I 34a_100000211102_100000058068 [0,2,0,0,0,0|1,0,1]=4 13238 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Br 207a_100000210019_100000206001 [0,2,0,0,0,0|2,0,0]=4 13239 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Br 270302a_100000210019_100000206001 [0,2,0,0,0,0|2,0,0]=4 13240 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Br 34a_100000210019_100000744441 [0,2,0,0,0,0|2,0,0]=4 13241 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Cl 207a_100000185859_100000206001 [0,2,0,0,0,0|2,0,0]=4 13242 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Cl 270302a_100000185859_100000206001 [0,2,0,0,0,0|2,0,0]=4 13243 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)Cl 34a_100000185859_100000744441 [0,2,0,0,0,0|2,0,0]=4 13244 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)F 207a_100000210047_100000206001 [0,2,0,0,0,0|2,0,0]=4 13245 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)F 270302a_100000210047_100000206001 [0,2,0,0,0,0|2,0,0]=4 13246 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)F 34a_100000210047_100000744441 [0,2,0,0,0,0|2,0,0]=4 13247 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)I 207a_100000211102_100000206001 [0,2,0,0,0,0|2,0,0]=4 13248 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)I 270302a_100000211102_100000206001 [0,2,0,0,0,0|2,0,0]=4 13249 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)I 34a_100000211102_100000744441 [0,2,0,0,0,0|2,0,0]=4 13250 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)O 270302a_100000210217_100000206001 [0,2,0,0,0,0|2,0,0]=4 13251 B16R2.258 Cn1cc(cn1)CNc2cccc(c2)O 34a_100000210217_100000744441 [0,2,0,0,0,0|2,0,0]=4 13252 B16R2.258 Cn1cc(nn1)CNc2cccc(c2)Br 207a_100000210019_100000749909 [0,2,0,0,0,0|1,0,0]=3 13253 B16R2.258 Cn1cc(nn1)CNc2cccc(c2)Cl 207a_100000185859_100000749909 [0,2,0,0,0,0|1,0,0]=3 13254 B16R2.258 Cn1cc(nn1)CNc2cccc(c2)F 207a_100000210047_100000749909 [0,2,0,0,0,0|1,0,0]=3 13255 B16R2.258 Cn1cc(nn1)CNc2cccc(c2)I 207a_100000211102_100000749909 [0,2,0,0,0,0|1,0,0]=3 13256 B16R2.258 Cn1cc(nn1)COc2cccc(c2)Br 274090a_200000210301_100000172639 [0,2,0,0,0,0|2,0,0]=4 13257 B16R2.258 Cn1cc(nn1)COc2cccc(c2)F 274090a_200000210301_100000172650 [0,2,0,0,0,0|2,0,0]=4 13258 B16R2.258 Cn1cc(nn1)COc2cccc(c2)I 274090a_200000210301_100000172736 [0,2,0,0,0,0|2,0,0]=4 13259 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Br 207a_100000210019_100000750880 [0,2,0,0,0,0|2,0,0]=4 13260 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Br 270302a_100000210019_100000750880 [0,2,0,0,0,0|2,0,0]=4 13261 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Br 34a_100000210019_100000726502 [0,2,0,0,0,0|2,0,0]=4 13262 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Cl 207a_100000185859_100000750880 [0,2,0,0,0,0|2,0,0]=4 13263 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Cl 270302a_100000185859_100000750880 [0,2,0,0,0,0|2,0,0]=4 13264 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)Cl 34a_100000185859_100000726502 [0,2,0,0,0,0|2,0,0]=4 13265 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)F 207a_100000210047_100000750880 [0,2,0,0,0,0|2,0,0]=4 13266 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)F 270302a_100000210047_100000750880 [0,2,0,0,0,0|2,0,0]=4 13267 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)F 34a_100000210047_100000726502 [0,2,0,0,0,0|2,0,0]=4 13268 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)I 207a_100000211102_100000750880 [0,2,0,0,0,0|2,0,0]=4 13269 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)I 270302a_100000211102_100000750880 [0,2,0,0,0,0|2,0,0]=4 13270 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)I 34a_100000211102_100000726502 [0,2,0,0,0,0|2,0,0]=4 13271 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)O 270302a_100000210217_100000750880 [0,2,0,0,0,0|2,0,0]=4 13272 B16R2.258 Cn1ccc(n1)CNc2cccc(c2)O 34a_100000210217_100000726502 [0,2,0,0,0,0|2,0,0]=4 13273 B16R2.258 Cn1cnc(c1)C=Cc2cccc(c2)Cl 271570a_100102525933_100000040308 [0,2,0,0,0,0|1,0,1]=4 13274 B16R2.258 Cn1cnc(c1)C=Cc2cccc(c2)F 271570a_100102525537_100000040308 [0,2,0,0,0,0|1,0,1]=4 13275 B16R2.258 Cn1cnc(c1)CNc2c[n+](ccn2)[O-] 27a_100011834058_100009880115 [0,2,0,0,0,0|2,0,0]=4 13276 B16R2.258 Cn1cnc(c1)CNc2cc(ccn2)F 27a_100011834058_100000764206 [0,2,0,0,0,0|1,0,0]=3 13277 B16R2.258 Cn1cnc(c1)CNc2cc(ncn2)F 27a_100011834058_200009880791 [0,2,0,0,0,0|2,0,0]=4 13278 B16R2.258 Cn1cnc(c1)CNc2cc(ncn2)N 27a_100011834058_100000701291 [0,2,0,0,0,0|2,0,0]=4 13279 B16R2.258 Cn1cnc(c1)CNc2cc(ncn2)O 27a_100011834058_100000765262 [0,2,0,0,0,0|2,0,0]=4 13280 B16R2.258 Cn1cnc(c1)CNc2cc[nH]c(=O)c2 27a_100011834058_100000061649 [0,2,0,0,0,0|1,0,0]=3 13281 B16R2.258 Cn1cnc(c1)CNc2cc[nH]c(=O)n2 27a_100011834058_200000134032 [0,2,0,0,0,0|2,0,0]=4 13282 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)Br 207a_100000210019_100000684808 [0,2,0,0,0,0|0,0,0]=2 13283 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)Br 34a_100000210019_100000717665 [0,2,0,0,0,0|0,0,0]=2 13284 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)Cl 207a_100000185859_100000684808 [0,2,0,0,0,0|0,0,0]=2 13285 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)Cl 34a_100000185859_100000717665 [0,2,0,0,0,0|0,0,0]=2 13286 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)F 207a_100000210047_100000684808 [0,2,0,0,0,0|0,0,0]=2 13287 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)F 34a_100000210047_100000717665 [0,2,0,0,0,0|0,0,0]=2 13288 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)I 207a_100000211102_100000684808 [0,2,0,0,0,0|0,0,0]=2 13289 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)I 34a_100000211102_100000717665 [0,2,0,0,0,0|0,0,0]=2 13290 B16R2.258 Cn1cnc(c1)CNc2cccc(c2)O 34a_100000210217_100000717665 [0,2,0,0,0,0|0,0,0]=2 13291 B16R2.258 Cn1cnc(c1)CNc2cccc(n2)F 27a_100011834058_100009815982 [0,2,0,0,0,0|1,0,0]=3 13292 B16R2.258 Cn1cnc(c1)CNc2ccnc(c2)F 27a_100011834058_100009816116 [0,2,0,0,0,0|1,0,0]=3 13293 B16R2.258 Cn1cnc(c1)CNc2ccnc(n2)N 27a_100011834058_100000055538 [0,2,0,0,0,0|2,0,0]=4 13294 B16R2.258 Cn1cnc(c1)CNc2cncc(n2)Cl 27a_100011834058_100010892449 [0,2,0,0,0,0|2,0,0]=4 13295 B16R2.258 Cn1cnc(c1)CNc2cncc(n2)F 27a_100011834058_200009863489 [0,2,0,0,0,0|2,0,0]=4 13296 B16R2.258 Cn1cnc(c1)CNc2nccc(n2)N 27a_100011834058_100000757536 [0,2,0,0,0,0|2,0,0]=4 13297 B16R2.258 Cn1cnc(c1)CNc2nccc(n2)O 27a_100011834058_100011649813 [0,2,0,0,0,0|2,0,0]=4 13298 B16R2.258 Cn1cnc(c1)COc2cc[nH]c(=O)c2 34a_100000032262_100000717665 [0,2,0,0,0,0|2,0,0]=4 13299 B16R2.258 Cn1cnc(c1)COc2ccc[n+](c2)[O-] 34a_100000039713_100000717665 [0,2,0,0,0,0|2,0,0]=4 13300 B16R2.258 Cn1cnc(c1)COc2ccc[n+](c2)[O-] 7a_100000039713_100000717665 [0,2,0,0,0,0|2,0,0]=4 13301 B16R2.258 Cn1cnc(c1)COc2cccc(=O)[nH]2 34a_100000033347_100000717665 [0,2,0,0,0,0|2,0,0]=4 13302 B16R2.258 Cn1cnc(c1)COc2cccc(c2)Br 34a_100000210342_100000717665 [0,2,0,0,0,0|1,0,0]=3 13303 B16R2.258 Cn1cnc(c1)COc2cccc(c2)Br 7a_100000210342_100000717665 [0,2,0,0,0,0|1,0,0]=3 13304 B16R2.258 Cn1cnc(c1)COc2cccc(c2)Cl 34a_100000210295_100000717665 [0,2,0,0,0,0|1,0,0]=3 13305 B16R2.258 Cn1cnc(c1)COc2cccc(c2)Cl 7a_100000210295_100000717665 [0,2,0,0,0,0|1,0,0]=3 13306 B16R2.258 Cn1cnc(c1)COc2cccc(c2)F 34a_100000210426_100000717665 [0,2,0,0,0,0|1,0,0]=3 13307 B16R2.258 Cn1cnc(c1)COc2cccc(c2)F 7a_100000210426_100000717665 [0,2,0,0,0,0|1,0,0]=3 13308 B16R2.258 Cn1cnc(c1)COc2cccc(c2)I 34a_100000211634_100000717665 [0,2,0,0,0,0|1,0,0]=3 13309 B16R2.258 Cn1cnc(c1)COc2cccc(c2)I 7a_100000211634_100000717665 [0,2,0,0,0,0|1,0,0]=3 13310 B16R2.258 Cn1cnc(c1)COc2cccc(c2)N 34a_100000210217_100000717665 [0,2,0,0,0,0|1,0,0]=3 13311 B16R2.258 Cn1cnc(c1)COc2cccc(n2)F 34a_100011432558_100000717665 [0,2,0,0,0,0|2,0,0]=4 13312 B16R2.258 Cn1cnc(c1)COc2ccnc(c2)Cl 34a_100000762945_100000717665 [0,2,0,0,0,0|2,0,0]=4 13313 B16R2.258 Cn1cnc(c1)COc2ccnc(c2)F 34a_100000732698_100000717665 [0,2,0,0,0,0|2,0,0]=4 13314 B16R2.258 Cn1cnc(c1)COc2ccnc(c2)N 34a_100011834064_100000717665 [0,2,0,0,0,0|2,0,0]=4 13315 B16R2.258 Cn1cnc(c1)COc2cncc(c2)Br 34a_100000754920_100000717665 [0,2,0,0,0,0|2,0,0]=4 13316 B16R2.258 Cn1cnc(c1)COc2cncc(c2)Br 7a_100000754920_100000717665 [0,2,0,0,0,0|2,0,0]=4 13317 B16R2.258 Cn1cnc(c1)COc2cncc(c2)Cl 7a_100000032511_100000717665 [0,2,0,0,0,0|2,0,0]=4 13318 B16R2.258 Cn1cnc(c1)COc2cncc(c2)F 34a_100011830296_100000717665 [0,2,0,0,0,0|2,0,0]=4 13319 B16R2.258 Cn1cnc(c1)COc2cncc(c2)F 7a_100011830296_100000717665 [0,2,0,0,0,0|2,0,0]=4 13320 B16R2.258 Cn1cnc(c1)COc2cncc(c2)N 34a_100011997051_100000717665 [0,2,0,0,0,0|2,0,0]=4 13321 B16R2.258 Cn1cnc(c1)CSc2cc(=O)cc[nH]2 62a_100009817434_100000717665 [0,2,0,0,0,0|2,0,0]=4 13322 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)Cl 62a_100000717665_100010167805 [0,2,0,0,0,0|2,0,0]=4 13323 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)Cl 62a_100010167805_100000717665 [0,2,0,0,0,0|2,0,0]=4 13324 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)F 62a_100000717665_100000764206 [0,2,0,0,0,0|2,0,0]=4 13325 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)F 62a_100000764206_100000717665 [0,2,0,0,0,0|2,0,0]=4 13326 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)N 62a_100000717665_100009814236 [0,2,0,0,0,0|2,0,0]=4 13327 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)N 62a_100009814236_100000717665 [0,2,0,0,0,0|2,0,0]=4 13328 B16R2.258 Cn1cnc(c1)CSc2cc(ccn2)O 62a_100000717665_100000762945 [0,2,0,0,0,0|2,0,0]=4 13329 B16R2.258 Cn1cnc(c1)CSc2cc[nH]c(=O)c2 62a_100000717665_100009816521 [0,2,0,0,0,0|2,0,0]=4 13330 B16R2.258 Cn1cnc(c1)CSc2cc[nH]c(=O)c2 62a_100009816521_100000717665 [0,2,0,0,0,0|2,0,0]=4 13331 B16R2.258 Cn1cnc(c1)CSc2ccc[n+](c2)C 62a_100000717665_100009996589 [0,2,0,0,0,0|2,0,0]=4 13332 B16R2.258 Cn1cnc(c1)CSc2ccc[n+](c2)C 62a_100009996589_100000717665 [0,2,0,0,0,0|2,0,0]=4 13333 B16R2.258 Cn1cnc(c1)CSc2ccc[n+](c2)[O-] 62a_100000717665_100009815978 [0,2,0,0,0,0|2,0,0]=4 13334 B16R2.258 Cn1cnc(c1)CSc2cccc(=O)[nH]2 62a_100000717665_100000752884 [0,2,0,0,0,0|2,0,0]=4 13335 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)Br 62a_100000691529_100000717665 [0,2,0,0,0,0|1,0,0]=3 13336 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)Br 62a_100000717665_100000691529 [0,2,0,0,0,0|1,0,0]=3 13337 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)Cl 62a_100000699651_100000717665 [0,2,0,0,0,0|1,0,0]=3 13338 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)Cl 62a_100000717665_100000699651 [0,2,0,0,0,0|1,0,0]=3 13339 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)F 62a_100000685547_100000717665 [0,2,0,0,0,0|1,0,0]=3 13340 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)F 62a_100000717665_100000685547 [0,2,0,0,0,0|1,0,0]=3 13341 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)N 62a_100000210019_100000717665 [0,2,0,0,0,0|1,0,0]=3 13342 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)N 62a_100000717665_100000210019 [0,2,0,0,0,0|1,0,0]=3 13343 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)O 62a_100000717665_100000211634 [0,2,0,0,0,0|1,0,0]=3 13344 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)[S] 62a_100000717665_114929384022 [0,2,0,0,0,0|1,0,0]=3 13345 B16R2.258 Cn1cnc(c1)CSc2cccc(c2)[S] 62a_114929384022_100000717665 [0,2,0,0,0,0|1,0,0]=3 13346 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)Br 62a_100000684672_100000717665 [0,2,0,0,0,0|2,0,0]=4 13347 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)Br 62a_100000717665_100000684672 [0,2,0,0,0,0|2,0,0]=4 13348 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)Cl 62a_100000051397_100000717665 [0,2,0,0,0,0|2,0,0]=4 13349 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)Cl 62a_100000717665_100000051397 [0,2,0,0,0,0|2,0,0]=4 13350 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)F 62a_100000717665_100009815982 [0,2,0,0,0,0|2,0,0]=4 13351 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)F 62a_100009815982_100000717665 [0,2,0,0,0,0|2,0,0]=4 13352 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)N 62a_100000717665_100000740741 [0,2,0,0,0,0|2,0,0]=4 13353 B16R2.258 Cn1cnc(c1)CSc2cccc(n2)N 62a_100000740741_100000717665 [0,2,0,0,0,0|2,0,0]=4 13354 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)Br 62a_100000717665_100009814637 [0,2,0,0,0,0|2,0,0]=4 13355 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)Br 62a_100009814637_100000717665 [0,2,0,0,0,0|2,0,0]=4 13356 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)Cl 62a_100000035001_100000717665 [0,2,0,0,0,0|2,0,0]=4 13357 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)Cl 62a_100000717665_100000035001 [0,2,0,0,0,0|2,0,0]=4 13358 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)F 62a_100000717665_100009816116 [0,2,0,0,0,0|2,0,0]=4 13359 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)F 62a_100009816116_100000717665 [0,2,0,0,0,0|2,0,0]=4 13360 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)N 62a_100000049665_100000717665 [0,2,0,0,0,0|2,0,0]=4 13361 B16R2.258 Cn1cnc(c1)CSc2ccnc(c2)N 62a_100000717665_100000049665 [0,2,0,0,0,0|2,0,0]=4 13362 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)Br 62a_100000717665_100000728054 [0,2,0,0,0,0|2,0,0]=4 13363 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)Br 62a_100000728054_100000717665 [0,2,0,0,0,0|2,0,0]=4 13364 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)Cl 62a_100000049639_100000717665 [0,2,0,0,0,0|2,0,0]=4 13365 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)Cl 62a_100000717665_100000049639 [0,2,0,0,0,0|2,0,0]=4 13366 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)F 62a_100000717665_100000744099 [0,2,0,0,0,0|2,0,0]=4 13367 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)F 62a_100000744099_100000717665 [0,2,0,0,0,0|2,0,0]=4 13368 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)N 62a_100000687067_100000717665 [0,2,0,0,0,0|2,0,0]=4 13369 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)N 62a_100000717665_100000687067 [0,2,0,0,0,0|2,0,0]=4 13370 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)O 62a_100000717665_100000754920 [0,2,0,0,0,0|2,0,0]=4 13371 B16R2.258 Cn1cnc(c1)CSc2cncc(c2)O 62a_100000754920_100000717665 [0,2,0,0,0,0|2,0,0]=4 13372 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)Br 62a_100000040308_100000211773 [0,2,0,0,0,0|2,0,0]=4 13373 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)Br 62a_100000211773_100000040308 [0,2,0,0,0,0|2,0,0]=4 13374 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)Cl 62a_100000040308_100000187163 [0,2,0,0,0,0|2,0,0]=4 13375 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)Cl 62a_100000187163_100000040308 [0,2,0,0,0,0|2,0,0]=4 13376 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)F 62a_100000040308_100000230114 [0,2,0,0,0,0|2,0,0]=4 13377 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)F 62a_100000230114_100000040308 [0,2,0,0,0,0|2,0,0]=4 13378 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)I 62a_100000040308_100011218688 [0,2,0,0,0,0|2,0,0]=4 13379 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)I 62a_100011218688_100000040308 [0,2,0,0,0,0|2,0,0]=4 13380 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)O 62a_100000040308_100011660834 [0,2,0,0,0,0|2,0,0]=4 13381 B16R2.258 Cn1cnc(c1)SCc2cccc(c2)O 62a_100011660834_100000040308 [0,2,0,0,0,0|2,0,0]=4 13382 B16R2.258 Cn1cnc(n1)CNc2cc(ccn2)F 27a_100000695864_100000764206 [0,2,0,0,0,0|2,0,0]=4 13383 B16R2.258 Cn1cnc(n1)CNc2cc[nH]c(=O)c2 27a_100000695864_100000061649 [0,2,0,0,0,0|2,0,0]=4 13384 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)Br 207a_100000210019_100010630104 [0,2,0,0,0,0|1,0,0]=3 13385 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)Br 34a_100000210019_100016995526 [0,2,0,0,0,0|1,0,0]=3 13386 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)Cl 207a_100000185859_100010630104 [0,2,0,0,0,0|1,0,0]=3 13387 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)Cl 34a_100000185859_100016995526 [0,2,0,0,0,0|1,0,0]=3 13388 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)F 207a_100000210047_100010630104 [0,2,0,0,0,0|1,0,0]=3 13389 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)F 34a_100000210047_100016995526 [0,2,0,0,0,0|1,0,0]=3 13390 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)I 207a_100000211102_100010630104 [0,2,0,0,0,0|1,0,0]=3 13391 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)I 34a_100000211102_100016995526 [0,2,0,0,0,0|1,0,0]=3 13392 B16R2.258 Cn1cnc(n1)CNc2cccc(c2)O 34a_100000210217_100016995526 [0,2,0,0,0,0|1,0,0]=3 13393 B16R2.258 Cn1cnc(n1)CNc2cccc(n2)F 27a_100000695864_100009815982 [0,2,0,0,0,0|2,0,0]=4 13394 B16R2.258 Cn1cnc(n1)CNc2ccnc(c2)F 27a_100000695864_100009816116 [0,2,0,0,0,0|2,0,0]=4 13395 B16R2.258 Cn1cnc(n1)COc2cccc(c2)Br 34a_100000210342_100016995526 [0,2,0,0,0,0|2,0,0]=4 13396 B16R2.258 Cn1cnc(n1)COc2cccc(c2)Br 7a_100000210342_100016995526 [0,2,0,0,0,0|2,0,0]=4 13397 B16R2.258 Cn1cnc(n1)COc2cccc(c2)Cl 34a_100000210295_100016995526 [0,2,0,0,0,0|2,0,0]=4 13398 B16R2.258 Cn1cnc(n1)COc2cccc(c2)Cl 7a_100000210295_100016995526 [0,2,0,0,0,0|2,0,0]=4 13399 B16R2.258 Cn1cnc(n1)COc2cccc(c2)F 34a_100000210426_100016995526 [0,2,0,0,0,0|2,0,0]=4 13400 B16R2.258 Cn1cnc(n1)COc2cccc(c2)F 7a_100000210426_100016995526 [0,2,0,0,0,0|2,0,0]=4 13401 B16R2.258 Cn1cnc(n1)COc2cccc(c2)I 34a_100000211634_100016995526 [0,2,0,0,0,0|2,0,0]=4 13402 B16R2.258 Cn1cnc(n1)COc2cccc(c2)I 7a_100000211634_100016995526 [0,2,0,0,0,0|2,0,0]=4 13403 B16R2.258 Cn1cnc(n1)COc2cccc(c2)N 34a_100000210217_100016995526 [0,2,0,0,0,0|2,0,0]=4 13404 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)Br 62a_100000691529_100016995526 [0,2,0,0,0,0|2,0,0]=4 13405 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)Br 62a_100016995526_100000691529 [0,2,0,0,0,0|2,0,0]=4 13406 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)Cl 62a_100000699651_100016995526 [0,2,0,0,0,0|2,0,0]=4 13407 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)Cl 62a_100016995526_100000699651 [0,2,0,0,0,0|2,0,0]=4 13408 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)F 62a_100000685547_100016995526 [0,2,0,0,0,0|2,0,0]=4 13409 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)F 62a_100016995526_100000685547 [0,2,0,0,0,0|2,0,0]=4 13410 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)N 62a_100000210019_100016995526 [0,2,0,0,0,0|2,0,0]=4 13411 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)N 62a_100016995526_100000210019 [0,2,0,0,0,0|2,0,0]=4 13412 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)O 62a_100016995526_100000211634 [0,2,0,0,0,0|2,0,0]=4 13413 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)[S] 62a_100016995526_114929384022 [0,2,0,0,0,0|2,0,0]=4 13414 B16R2.258 Cn1cnc(n1)CSc2cccc(c2)[S] 62a_114929384022_100016995526 [0,2,0,0,0,0|2,0,0]=4 13415 B16R2.258 Fc1cccc(c1)NCc2cc(co2)Br 270302a_100000210047_100000747035 [0,2,0,0,0,0|2,0,0]=4 13416 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)Br 207a_100000210047_100000211722 [0,2,0,0,0,0|2,0,0]=4 13417 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)Br 270302a_100000210047_100000211722 [0,2,0,0,0,0|2,0,0]=4 13418 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)Br 34a_100000210047_100000746031 [0,2,0,0,0,0|2,0,0]=4 13419 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)Cl 207a_100000210047_100000102487 [0,2,0,0,0,0|2,0,0]=4 13420 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)Cl 270302a_100000210047_100000102487 [0,2,0,0,0,0|2,0,0]=4 13421 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)I 207a_100000210047_100010179861 [0,2,0,0,0,0|2,0,0]=4 13422 B16R2.258 Fc1cccc(c1)NCc2cc(cs2)I 270302a_100000210047_100010179861 [0,2,0,0,0,0|2,0,0]=4 13423 B16R2.258 Fc1cccc(c1)NCc2ccc(o2)Br 207a_100000210047_100000185145 [0,2,0,0,0,0|2,0,0]=4 13424 B16R2.258 Fc1cccc(c1)NCc2ccc(o2)Cl 207a_100000210047_100000188459 [0,2,0,0,0,0|2,0,0]=4 13425 B16R2.258 Fc1cccc(c1)NCc2ccc(o2)I 207a_100000210047_100000186757 [0,2,0,0,0,0|2,0,0]=4 13426 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Br 207a_100000210047_100000179771 [0,2,0,0,0,0|2,0,0]=4 13427 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Br 270302a_100000210047_100000179771 [0,2,0,0,0,0|2,0,0]=4 13428 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Br 34a_100000210047_100000708592 [0,2,0,0,0,0|2,0,0]=4 13429 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Cl 207a_100000210047_100000242774 [0,2,0,0,0,0|2,0,0]=4 13430 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Cl 270302a_100000210047_100000242774 [0,2,0,0,0,0|2,0,0]=4 13431 B16R2.258 Fc1cccc(c1)NCc2ccc(s2)Cl 34a_100000210047_100000185097 [0,2,0,0,0,0|2,0,0]=4 13432 B16R2.258 Fc1cccc(c1)NCc2cnc(s2)Br 34a_100000210047_100000717027 [0,2,0,0,0,0|1,0,1]=4 13433 B16R2.258 Fc1cccc(c1)NCc2cnc(s2)Cl 34a_100000210047_100000058068 [0,2,0,0,0,0|1,0,1]=4 13434 B16R2.258 Fc1cccc(c1)NCc2csc(c2)Br 207a_100000210047_100000737087 [0,2,0,0,0,0|2,0,0]=4 13435 B16R2.258 Fc1cccc(c1)NCc2csc(c2)Br 270302a_100000210047_100000737087 [0,2,0,0,0,0|2,0,0]=4 13436 B16R2.258 Fc1cccc(c1)NCc2csc(c2)Cl 207a_100000210047_100009844934 [0,2,0,0,0,0|2,0,0]=4 13437 B16R2.258 Fc1cccc(c1)NCc2csc(c2)Cl 270302a_100000210047_100009844934 [0,2,0,0,0,0|2,0,0]=4 13438 B16R2.258 Fc1cccc(c1)NCc2csc(n2)Cl 34a_100000210047_100000024076 [0,2,0,0,0,0|1,0,0]=3 13439 B16R2.258 Fc1cccc(c1)NCc2ncc(s2)Br 270302a_100000210047_100000699580 [0,2,0,0,0,0|2,0,0]=4 13440 B16R2.258 Fc1cccc(c1)NCc2ncc(s2)Cl 270302a_100000210047_100000699884 [0,2,0,0,0,0|2,0,0]=4 13441 B16R2.258 Fc1cccc(c1)NCc2nsc(n2)Cl 34a_100000210047_100000043760 [0,2,0,0,0,0|2,0,0]=4 13442 B16R2.258 Fc1cccc(c1)OCc2csc(n2)Cl 34a_100000210426_100000024076 [0,2,0,0,0,0|2,0,0]=4 13443 B16R2.258 Fc1cccc(c1)OCc2csc(n2)Cl 7a_100000210426_100000024076 [0,2,0,0,0,0|2,0,0]=4 13444 B16R2.258 Fc1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_100000685547 [0,2,0,0,0,0|2,0,0]=4 13445 B16R2.258 Fc1cccc(c1)SCc2csc(n2)Cl 62a_100000685547_100000024076 [0,2,0,0,0,0|2,0,0]=4 13446 B16R2.258 Ic1cccc(c1)NCc2cc(cs2)I 207a_100000211102_100010179861 [0,2,0,0,0,0|2,0,0]=4 13447 B16R2.258 Ic1cccc(c1)NCc2cc(cs2)I 270302a_100000211102_100010179861 [0,2,0,0,0,0|2,0,0]=4 13448 B16R2.258 Ic1cccc(c1)NCc2ccc(o2)I 207a_100000211102_100000186757 [0,2,0,0,0,0|2,0,0]=4 13449 B16R2.258 Nc1cccc(c1)OCc2csc(n2)Cl 34a_100000210217_100000024076 [0,2,0,0,0,0|2,0,0]=4 13450 B16R2.258 Nc1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_100000210019 [0,2,0,0,0,0|2,0,0]=4 13451 B16R2.258 Nc1cccc(c1)SCc2csc(n2)Cl 62a_100000210019_100000024076 [0,2,0,0,0,0|2,0,0]=4 13452 B16R2.258 Oc1cccc(c1)NCc2cc(co2)Br 270302a_100000210217_100000747035 [0,2,0,0,0,0|2,0,0]=4 13453 B16R2.258 Oc1cccc(c1)NCc2cc(cs2)Br 270302a_100000210217_100000211722 [0,2,0,0,0,0|2,0,0]=4 13454 B16R2.258 Oc1cccc(c1)NCc2cc(cs2)Br 34a_100000210217_100000746031 [0,2,0,0,0,0|2,0,0]=4 13455 B16R2.258 Oc1cccc(c1)NCc2cc(cs2)Cl 270302a_100000210217_100000102487 [0,2,0,0,0,0|2,0,0]=4 13456 B16R2.258 Oc1cccc(c1)NCc2cc(cs2)I 270302a_100000210217_100010179861 [0,2,0,0,0,0|2,0,0]=4 13457 B16R2.258 Oc1cccc(c1)NCc2ccc(s2)Br 270302a_100000210217_100000179771 [0,2,0,0,0,0|2,0,0]=4 13458 B16R2.258 Oc1cccc(c1)NCc2ccc(s2)Br 34a_100000210217_100000708592 [0,2,0,0,0,0|2,0,0]=4 13459 B16R2.258 Oc1cccc(c1)NCc2ccc(s2)Cl 270302a_100000210217_100000242774 [0,2,0,0,0,0|2,0,0]=4 13460 B16R2.258 Oc1cccc(c1)NCc2ccc(s2)Cl 34a_100000210217_100000185097 [0,2,0,0,0,0|2,0,0]=4 13461 B16R2.258 Oc1cccc(c1)NCc2cnc(s2)Br 34a_100000210217_100000717027 [0,2,0,0,0,0|1,0,1]=4 13462 B16R2.258 Oc1cccc(c1)NCc2cnc(s2)Cl 34a_100000210217_100000058068 [0,2,0,0,0,0|1,0,1]=4 13463 B16R2.258 Oc1cccc(c1)NCc2csc(c2)Br 270302a_100000210217_100000737087 [0,2,0,0,0,0|2,0,0]=4 13464 B16R2.258 Oc1cccc(c1)NCc2csc(c2)Cl 270302a_100000210217_100009844934 [0,2,0,0,0,0|2,0,0]=4 13465 B16R2.258 Oc1cccc(c1)NCc2csc(n2)Cl 34a_100000210217_100000024076 [0,2,0,0,0,0|1,0,0]=3 13466 B16R2.258 Oc1cccc(c1)NCc2ncc(s2)Br 270302a_100000210217_100000699580 [0,2,0,0,0,0|2,0,0]=4 13467 B16R2.258 Oc1cccc(c1)NCc2ncc(s2)Cl 270302a_100000210217_100000699884 [0,2,0,0,0,0|2,0,0]=4 13468 B16R2.258 Oc1cccc(c1)NCc2nsc(n2)Cl 34a_100000210217_100000043760 [0,2,0,0,0,0|2,0,0]=4 13469 B16R2.258 Oc1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_100000211634 [0,2,0,0,0,0|2,0,0]=4 13470 B16R2.258 [13CH3]n1cc(nn1)COc2cccc(c2)Br 274090a_200025704644_100000172639 [0,2,0,0,0,0|2,0,0]=4 13471 B16R2.258 [13CH3]n1cc(nn1)COc2cccc(c2)F 274090a_200025704644_100000172650 [0,2,0,0,0,0|2,0,0]=4 13472 B16R2.258 [13CH3]n1cc(nn1)COc2cccc(c2)I 274090a_200025704644_100000172736 [0,2,0,0,0,0|2,0,0]=4 13473 B16R2.258 [S]c1cccc(c1)SCc2csc(n2)Cl 62a_100000024076_114929384022 [0,2,0,0,0,0|2,0,0]=4 13474 B16R2.258 [S]c1cccc(c1)SCc2csc(n2)Cl 62a_114929384022_100000024076 [0,2,0,0,0,0|2,0,0]=4 13475 B16R2.2334 C=Cn1cc(cn1)CNc2ccccc2 207a_100000106764_100000117825 [0,2,0,0,0,0|2,0,0]=4 13476 B16R2.2334 C=Cn1cc(cn1)CNc2ccccc2 270302a_100000106764_100000117825 [0,2,0,0,0,0|2,0,0]=4 13477 B16R2.2334 CCc1ccc(o1)CNc2ccccc2 207a_100000106764_100000743199 [0,2,0,0,0,0|2,0,0]=4 13478 B16R2.2334 CCc1ccc(o1)CNc2ccccc2 270302a_100000106764_100000743199 [0,2,0,0,0,0|2,0,0]=4 13479 B16R2.2334 CCc1ccc(s1)CNc2ccccc2 207a_100000106764_100000746206 [0,2,0,0,0,0|2,0,0]=4 13480 B16R2.2334 CCc1ccc(s1)CNc2ccccc2 270302a_100000106764_100000746206 [0,2,0,0,0,0|2,0,0]=4 13481 B16R2.2334 CCc1nc(cs1)CNc2ccccc2 34a_100000106764_100020603300 [0,2,0,0,0,0|1,0,0]=3 13482 B16R2.2334 CCc1nc(cs1)COc2ccccc2 34a_100000210340_100020603300 [0,2,0,0,0,0|2,0,0]=4 13483 B16R2.2334 CCc1nc(cs1)COc2ccccc2 7a_100000210340_100020603300 [0,2,0,0,0,0|2,0,0]=4 13484 B16R2.2334 CCc1nc(cs1)CSc2ccccc2 62a_100000719477_100020603300 [0,2,0,0,0,0|2,0,0]=4 13485 B16R2.2334 CCc1nc(cs1)CSc2ccccc2 62a_100020603300_100000041952 [0,2,0,0,0,0|2,0,0]=4 13486 B16R2.2334 CCc1nc(n[nH]1)CNc2ccccc2 34a_100000106764_100000698245 [0,2,0,0,0,0|1,0,0]=3 13487 B16R2.2334 CCc1nc(n[nH]1)COc2ccccc2 34a_100000210340_100000698245 [0,2,0,0,0,0|2,0,0]=4 13488 B16R2.2334 CCc1nc(n[nH]1)COc2ccccc2 7a_100000210340_100000698245 [0,2,0,0,0,0|2,0,0]=4 13489 B16R2.2334 CCc1nc(n[nH]1)CSc2ccccc2 62a_100000698245_100000041952 [0,2,0,0,0,0|2,0,0]=4 13490 B16R2.2334 CCc1nc(n[nH]1)CSc2ccccc2 62a_100000719477_100000698245 [0,2,0,0,0,0|2,0,0]=4 13491 B16R2.2334 CCc1nc(no1)CNc2ccccc2 34a_100000106764_100000736014 [0,2,0,0,0,0|2,0,0]=4 13492 B16R2.2334 CCc1ncc(s1)CNc2ccccc2 207a_100000106764_200000743297 [0,2,0,0,0,0|1,0,1]=4 13493 B16R2.2334 CCc1noc(n1)CNc2ccccc2 34a_100000106764_100000735704 [0,2,0,0,0,0|1,0,1]=4 13494 B16R2.2334 CCn1cc(cn1)CNc2ccccc2 207a_100000106764_100000748207 [0,2,0,0,0,0|2,0,0]=4 13495 B16R2.2334 CCn1cc(cn1)CNc2ccccc2 270302a_100000106764_100000748207 [0,2,0,0,0,0|2,0,0]=4 13496 B16R2.2334 CCn1cc(nn1)CCc2ccccc2 274090a_100000204670_100000035266 [0,2,0,0,0,0|2,0,0]=4 13497 B16R2.2334 CCn1cc(nn1)COc2ccccc2 274090a_100000204670_100000172638 [0,2,0,0,0,0|2,0,0]=4 13498 B16R2.2334 CCn1cc(nn1)CSc2ccccc2 274090a_100000204670_200000172648 [0,2,0,0,0,0|2,0,0]=4 13499 B16R2.2334 CCn1ccc(n1)CNc2ccccc2 207a_100000106764_100000080357 [0,2,0,0,0,0|2,0,0]=4 13500 B16R2.2334 CCn1ccc(n1)CNc2ccccc2 270302a_100000106764_100000080357 [0,2,0,0,0,0|2,0,0]=4 13501 B16R2.2334 CCn1ccc(n1)CNc2ccccc2 34a_100000106764_100000094151 [0,2,0,0,0,0|2,0,0]=4 13502 B16R2.2334 CCn1cnc(c1)C#Cc2ccccc2 271570a_100000069678_100010368372 [0,2,0,0,0,0|1,0,1]=4 13503 B16R2.2334 CCn1cnc(c1)C=Cc2ccccc2 271570a_100102527694_100010368372 [0,2,0,0,0,0|1,0,1]=4 13504 B16R2.2334 CCn1cnc(c1)CNc2ccccc2 207a_100000106764_100012662273 [0,2,0,0,0,0|0,0,0]=2 13505 B16R2.2334 CCn1cnc(c1)SCc2ccccc2 62a_100000211182_100010368372 [0,2,0,0,0,0|2,0,0]=4 13506 B16R2.2334 CCn1cnc(c1)SCc2ccccc2 62a_100010368372_100015291786 [0,2,0,0,0,0|2,0,0]=4 13507 B16R2.2334 CSc1ccc(s1)CNc2ccccc2 207a_100000106764_100000720245 [0,2,0,0,0,0|2,0,0]=4 13508 B16R2.2334 FCn1cc(nn1)CCc2ccccc2 274090a_100015361967_100000035266 [0,2,0,0,0,0|2,0,0]=4 13509 B16R2.2334 FCn1cc(nn1)COc2ccccc2 274090a_100015361967_100000172638 [0,2,0,0,0,0|2,0,0]=4 13510 B16R2.2334 FCn1cc(nn1)CSc2ccccc2 274090a_100015361967_200000172648 [0,2,0,0,0,0|2,0,0]=4 13511 B16R2.2334 N#Cc1cc(c[nH]1)CNc2ccccc2 207a_100000106764_100000132793 [0,2,0,0,0,0|1,0,0]=3 13512 B16R2.2334 N#Cc1ccc(o1)CNc2ccccc2 34a_100000106764_100009822536 [0,2,0,0,0,0|2,0,0]=4 13513 B16R2.2334 N#Cc1ccc(s1)CNc2ccccc2 207a_100000106764_100000091605 [0,2,0,0,0,0|2,0,0]=4 13514 B16R2.2334 N#Cc1ccc(s1)CNc2ccccc2 270302a_100000106764_100000091605 [0,2,0,0,0,0|2,0,0]=4 13515 B16R2.2334 N#Cc1ccc(s1)CNc2ccccc2 34a_100000106764_100010188212 [0,2,0,0,0,0|2,0,0]=4 13516 B16R2.2334 O=Cc1cc(cs1)CNc2ccccc2 34a_100000106764_100000070824 [0,2,0,0,0,0|2,0,0]=4 13517 B16R2.2334 O=Cc1ccc(o1)CNc2ccccc2 34a_100000106764_200000079136 [0,2,0,0,0,0|2,0,0]=4 13518 B16R2.2334 OCc1ccc(o1)CNc2ccccc2 207a_100000106764_100000758743 [0,2,0,0,0,0|2,0,0]=4 13519 B16R2.2829 CC(Cc1cn(cn1)C)c2ccccc2 271570a_100000062452_100000040308 [0,2,0,0,0,0|1,0,0]=3 13520 B16R2.2829 CC(Cc1cn(nn1)C)c2ccccc2 271570a_100000062452_100000760339 [0,2,0,0,0,0|2,0,0]=4 13521 B16R2.2829 CC(Cc1csc(n1)N)c2ccccc2 271570a_100000062452_100011998049 [0,2,0,0,0,0|2,0,0]=4 13522 B16R2.2829 CC(Cc1n[nH]c(n1)N)c2ccccc2 271570a_100000062452_100015184587 [0,2,0,0,0,0|2,0,0]=4 13523 B16R2.2829 CC(Cc1ncn(n1)C)c2ccccc2 271570a_100000062452_100009819955 [0,2,0,0,0,0|2,0,0]=4 13524 B16R2.2829 CC(Sc1cn(cn1)C)c2ccccc2 62a_100000040308_100000230085 [0,2,0,0,0,0|2,0,0]=4 13525 B16R2.2829 CC(Sc1cn(cn1)C)c2ccccc2 62a_100000230085_100000040308 [0,2,0,0,0,0|2,0,0]=4 13526 B16R2.2829 CN(Cc1cc(cs1)Br)c2ccccc2 2230a_100000210012_100000746031 [0,2,0,0,0,0|2,0,0]=4 13527 B16R2.2829 CN(Cc1cc(cs1)Br)c2ccccc2 269982a_100000210012_100000746031 [0,2,0,0,0,0|2,0,0]=4 13528 B16R2.2829 CN(Cc1cc(cs1)Br)c2ccccc2 34a_100000210012_100000746031 [0,2,0,0,0,0|2,0,0]=4 13529 B16R2.2829 CN(Cc1ccc(s1)Br)c2ccccc2 2230a_100000210012_100000708592 [0,2,0,0,0,0|2,0,0]=4 13530 B16R2.2829 CN(Cc1ccc(s1)Br)c2ccccc2 269982a_100000210012_100000708592 [0,2,0,0,0,0|2,0,0]=4 13531 B16R2.2829 CN(Cc1ccc(s1)Br)c2ccccc2 34a_100000210012_100000708592 [0,2,0,0,0,0|2,0,0]=4 13532 B16R2.2829 CN(Cc1ccc(s1)Cl)c2ccccc2 2230a_100000210012_100000185097 [0,2,0,0,0,0|2,0,0]=4 13533 B16R2.2829 CN(Cc1ccc(s1)Cl)c2ccccc2 269982a_100000210012_100000185097 [0,2,0,0,0,0|2,0,0]=4 13534 B16R2.2829 CN(Cc1ccc(s1)Cl)c2ccccc2 34a_100000210012_100000185097 [0,2,0,0,0,0|2,0,0]=4 13535 B16R2.2829 CN(Cc1ccn(n1)C)c2ccccc2 2230a_100000210012_100000726502 [0,2,0,0,0,0|2,0,0]=4 13536 B16R2.2829 CN(Cc1ccn(n1)C)c2ccccc2 269982a_100000210012_100000726502 [0,2,0,0,0,0|2,0,0]=4 13537 B16R2.2829 CN(Cc1ccn(n1)C)c2ccccc2 34a_100000210012_100000726502 [0,2,0,0,0,0|2,0,0]=4 13538 B16R2.2829 CN(Cc1cn(cn1)C)c2ccccc2 2230a_100000210012_100000717665 [0,2,0,0,0,0|0,0,0]=2 13539 B16R2.2829 CN(Cc1cn(cn1)C)c2ccccc2 269982a_100000210012_100000717665 [0,2,0,0,0,0|0,0,0]=2 13540 B16R2.2829 CN(Cc1cn(cn1)C)c2ccccc2 34a_100000210012_100000717665 [0,2,0,0,0,0|0,0,0]=2 13541 B16R2.2829 CN(Cc1cn(nn1)C)c2ccccc2 274090a_200000210301_100000209185 [0,2,0,0,0,0|1,0,0]=3 13542 B16R2.2829 CN(Cc1cn(nn1)[13CH3])c2ccccc2 274090a_200025704644_100000209185 [0,2,0,0,0,0|1,0,0]=3 13543 B16R2.2829 CN(Cc1cnc(s1)Br)c2ccccc2 2230a_100000210012_100000717027 [0,2,0,0,0,0|1,0,1]=4 13544 B16R2.2829 CN(Cc1cnc(s1)Br)c2ccccc2 269982a_100000210012_100000717027 [0,2,0,0,0,0|1,0,1]=4 13545 B16R2.2829 CN(Cc1cnc(s1)Br)c2ccccc2 34a_100000210012_100000717027 [0,2,0,0,0,0|1,0,1]=4 13546 B16R2.2829 CN(Cc1cnc(s1)Cl)c2ccccc2 2230a_100000210012_100000058068 [0,2,0,0,0,0|1,0,1]=4 13547 B16R2.2829 CN(Cc1cnc(s1)Cl)c2ccccc2 269982a_100000210012_100000058068 [0,2,0,0,0,0|1,0,1]=4 13548 B16R2.2829 CN(Cc1cnc(s1)Cl)c2ccccc2 34a_100000210012_100000058068 [0,2,0,0,0,0|1,0,1]=4 13549 B16R2.2829 CN(Cc1cnn(c1)C)c2ccccc2 2230a_100000210012_100000744441 [0,2,0,0,0,0|2,0,0]=4 13550 B16R2.2829 CN(Cc1cnn(c1)C)c2ccccc2 269982a_100000210012_100000744441 [0,2,0,0,0,0|2,0,0]=4 13551 B16R2.2829 CN(Cc1cnn(c1)C)c2ccccc2 34a_100000210012_100000744441 [0,2,0,0,0,0|2,0,0]=4 13552 B16R2.2829 CN(Cc1csc(n1)Cl)c2ccccc2 2230a_100000210012_100000024076 [0,2,0,0,0,0|1,0,0]=3 13553 B16R2.2829 CN(Cc1csc(n1)Cl)c2ccccc2 269982a_100000210012_100000024076 [0,2,0,0,0,0|1,0,0]=3 13554 B16R2.2829 CN(Cc1csc(n1)Cl)c2ccccc2 34a_100000210012_100000024076 [0,2,0,0,0,0|1,0,0]=3 13555 B16R2.2829 CN(Cc1n[nH]c(=O)[nH]1)c2ccccc2 2230a_100000210012_100000754189 [0,2,0,0,0,0|1,0,1]=4 13556 B16R2.2829 CN(Cc1n[nH]c(=O)[nH]1)c2ccccc2 269982a_100000210012_100000754189 [0,2,0,0,0,0|1,0,1]=4 13557 B16R2.2829 CN(Cc1ncn(n1)C)c2ccccc2 2230a_100000210012_100016995526 [0,2,0,0,0,0|1,0,0]=3 13558 B16R2.2829 CN(Cc1ncn(n1)C)c2ccccc2 269982a_100000210012_100016995526 [0,2,0,0,0,0|1,0,0]=3 13559 B16R2.2829 CN(Cc1ncn(n1)C)c2ccccc2 34a_100000210012_100016995526 [0,2,0,0,0,0|1,0,0]=3 13560 B16R2.2829 CN(Cc1nsc(n1)Cl)c2ccccc2 2230a_100000210012_100000043760 [0,2,0,0,0,0|2,0,0]=4 13561 B16R2.2829 CN(Cc1nsc(n1)Cl)c2ccccc2 269982a_100000210012_100000043760 [0,2,0,0,0,0|2,0,0]=4 13562 B16R2.2829 CN(Cc1nsc(n1)Cl)c2ccccc2 34a_100000210012_100000043760 [0,2,0,0,0,0|2,0,0]=4 13563 B16R2.2829 Cc1cc(no1)CN(C)c2ccccc2 2230a_100000210012_100000199038 [0,2,0,0,0,0|2,0,0]=4 13564 B16R2.2829 Cc1cc(no1)CN(C)c2ccccc2 269982a_100000210012_100000199038 [0,2,0,0,0,0|2,0,0]=4 13565 B16R2.2829 Cc1cc(no1)CN(C)c2ccccc2 34a_100000210012_100000199038 [0,2,0,0,0,0|2,0,0]=4 13566 B16R2.2829 Cc1nc(c[nH]1)CC(C)c2ccccc2 271570a_100000062452_100009814057 [0,2,0,0,0,0|1,0,0]=3 13567 B16R2.2829 Cc1nc(c[nH]1)SC(C)c2ccccc2 62a_100000230085_100009814057 [0,2,0,0,0,0|2,0,0]=4 13568 B16R2.2829 Cc1nc(c[nH]1)SC(C)c2ccccc2 62a_100009814057_100000230085 [0,2,0,0,0,0|2,0,0]=4 13569 B16R2.2829 Cc1nc(cs1)CC(=O)c2ccccc2 1458a_100000185807_100015186478 [0,2,0,0,0,0|2,0,0]=4 13570 B16R2.2829 Cc1nc(cs1)CC(C)c2ccccc2 271570a_100000062452_100011934587 [0,2,0,0,0,0|2,0,0]=4 13571 B16R2.2829 Cc1nc(cs1)CN(C)c2ccccc2 2230a_100000210012_100015186478 [0,2,0,0,0,0|1,0,0]=3 13572 B16R2.2829 Cc1nc(cs1)CN(C)c2ccccc2 269982a_100000210012_100015186478 [0,2,0,0,0,0|1,0,0]=3 13573 B16R2.2829 Cc1nc(cs1)CN(C)c2ccccc2 34a_100000210012_100015186478 [0,2,0,0,0,0|1,0,0]=3 13574 B16R2.2829 Cc1nc(n[nH]1)CC(C)c2ccccc2 271570a_100000062452_100000732540 [0,2,0,0,0,0|2,0,0]=4 13575 B16R2.2829 Cc1nc(no1)CN(C)c2ccccc2 2230a_100000210012_100000231061 [0,2,0,0,0,0|2,0,0]=4 13576 B16R2.2829 Cc1nc(no1)CN(C)c2ccccc2 269982a_100000210012_100000231061 [0,2,0,0,0,0|2,0,0]=4 13577 B16R2.2829 Cc1nc(no1)CN(C)c2ccccc2 34a_100000210012_100000231061 [0,2,0,0,0,0|2,0,0]=4 13578 B16R2.2829 Cc1ncc(s1)CN(C)c2ccccc2 2230a_100000210012_100020635045 [0,2,0,0,0,0|1,0,1]=4 13579 B16R2.2829 Cc1ncc(s1)CN(C)c2ccccc2 269982a_100000210012_100020635045 [0,2,0,0,0,0|1,0,1]=4 13580 B16R2.2829 Cc1ncc(s1)CN(C)c2ccccc2 34a_100000210012_100020635045 [0,2,0,0,0,0|1,0,1]=4 13581 B16R2.2829 Cc1noc(n1)CN(C)c2ccccc2 2230a_100000210012_100000735555 [0,2,0,0,0,0|1,0,1]=4 13582 B16R2.2829 Cc1noc(n1)CN(C)c2ccccc2 269982a_100000210012_100000735555 [0,2,0,0,0,0|1,0,1]=4 13583 B16R2.2829 Cc1noc(n1)CN(C)c2ccccc2 270196a_100000212224_100000745425 [0,2,0,0,0,0|1,0,1]=4 13584 B16R2.2829 Cc1noc(n1)CN(C)c2ccccc2 34a_100000210012_100000735555 [0,2,0,0,0,0|1,0,1]=4 13585 B16R2.2829 Cn1cnc(c1)CC(=O)c2ccccc2 1458a_100000185807_100000717665 [0,2,0,0,0,0|1,0,0]=3 13586 B16R2.2829 Cn1cnc(n1)CC(=O)c2ccccc2 1458a_100000185807_100016995526 [0,2,0,0,0,0|2,0,0]=4 13587 B16R2.2829 O=C(Cc1csc(n1)Cl)c2ccccc2 1458a_100000185807_100000024076 [0,2,0,0,0,0|2,0,0]=4 13588 B16R2.2884 Brc1cc(oc1Br)CNc2ccccc2 207a_100000106764_100000188521 [0,2,0,0,0,0|2,0,0]=4 13589 B16R2.2884 Brc1cc(sc1Br)CNc2ccccc2 207a_100000106764_100000763650 [0,2,0,0,0,0|2,0,0]=4 13590 B16R2.2884 Brc1cc(sc1Br)CNc2ccccc2 270302a_100000106764_100000763650 [0,2,0,0,0,0|2,0,0]=4 13591 B16R2.2884 Cc1cc(nn1C)CNc2ccccc2 207a_100000106764_100000763638 [0,2,0,0,0,0|2,0,0]=4 13592 B16R2.2884 Cc1cc(nn1C)CNc2ccccc2 270302a_100000106764_100000763638 [0,2,0,0,0,0|2,0,0]=4 13593 B16R2.2884 Cc1cc(nn1C)CNc2ccccc2 34a_100000106764_100000761402 [0,2,0,0,0,0|2,0,0]=4 13594 B16R2.2884 Cc1cc(sc1Br)CNc2ccccc2 207a_100000106764_100000761930 [0,2,0,0,0,0|2,0,0]=4 13595 B16R2.2884 Cc1cc(sc1Br)CNc2ccccc2 270302a_100000106764_100000761930 [0,2,0,0,0,0|2,0,0]=4 13596 B16R2.2884 Cc1cc(sc1C)CNc2ccccc2 207a_100000106764_100011830369 [0,2,0,0,0,0|2,0,0]=4 13597 B16R2.2884 Cc1cc(sc1C)CNc2ccccc2 270302a_100000106764_100011830369 [0,2,0,0,0,0|2,0,0]=4 13598 B16R2.2884 Cc1nc(cn1C)C#Cc2ccccc2 271570a_100000069678_100000684932 [0,2,0,0,0,0|1,0,1]=4 13599 B16R2.2884 Cc1nc(cn1C)C=Cc2ccccc2 271570a_100102527694_100000684932 [0,2,0,0,0,0|1,0,1]=4 13600 B16R2.2884 Cc1nc(cn1C)SCc2ccccc2 62a_100000211182_100000684932 [0,2,0,0,0,0|2,0,0]=4 13601 B16R2.2884 Cc1nc(cn1C)SCc2ccccc2 62a_100000684932_100015291786 [0,2,0,0,0,0|2,0,0]=4 13602 B16R2.2884 Cc1nc(sc1C)CNc2ccccc2 207a_100000106764_100011775437 [0,2,0,0,0,0|2,0,0]=4 13603 B16R2.2884 Cc1nc(sc1C)CNc2ccccc2 34a_100000106764_100012347604 [0,2,0,0,0,0|2,0,0]=4 13604 B16R2.2884 Cc1sc(cc1Br)CNc2ccccc2 207a_100000106764_100000708457 [0,2,0,0,0,0|2,0,0]=4 13605 B16R2.2884 Cc1sc(cc1Br)CNc2ccccc2 270302a_100000106764_100000708457 [0,2,0,0,0,0|2,0,0]=4 13606 B16R2.2884 Cn1cc(nc1N)C#Cc2ccccc2 271570a_100000069678_100025756272 [0,2,0,0,0,0|1,0,1]=4 13607 B16R2.2884 Cn1cc(nc1N)C=Cc2ccccc2 271570a_100102527694_100025756272 [0,2,0,0,0,0|1,0,1]=4 13608 B16R2.2884 Cn1cc(nc1N)SCc2ccccc2 62a_100000211182_100025756272 [0,2,0,0,0,0|2,0,0]=4 13609 B16R2.2884 Cn1cc(nc1N)SCc2ccccc2 62a_100025756272_100015291786 [0,2,0,0,0,0|2,0,0]=4 13610 B16R2.11414 Brc1cc(cs1)CNc2ccccc2Br 207a_100000210017_100000737087 [0,2,0,0,0,0|2,0,0]=4 13611 B16R2.11414 Brc1cc(cs1)CNc2ccccc2I 207a_100000210053_100000737087 [0,2,0,0,0,0|2,0,0]=4 13612 B16R2.11414 Brc1ccc(o1)CNc2ccccc2Br 207a_100000210017_100000185145 [0,2,0,0,0,0|2,0,0]=4 13613 B16R2.11414 Brc1ccc(o1)CNc2ccccc2I 207a_100000210053_100000185145 [0,2,0,0,0,0|2,0,0]=4 13614 B16R2.11414 Brc1ccc(s1)CNc2ccccc2Br 207a_100000210017_100000179771 [0,2,0,0,0,0|2,0,0]=4 13615 B16R2.11414 Brc1ccc(s1)CNc2ccccc2Br 34a_100000210017_100000708592 [0,2,0,0,0,0|2,0,0]=4 13616 B16R2.11414 Brc1ccc(s1)CNc2ccccc2I 207a_100000210053_100000179771 [0,2,0,0,0,0|2,0,0]=4 13617 B16R2.11414 Brc1ccc(s1)CNc2ccccc2I 34a_100000210053_100000708592 [0,2,0,0,0,0|2,0,0]=4 13618 B16R2.11414 Brc1ccccc1NCc2cc(cs2)I 207a_100000210017_100010179861 [0,2,0,0,0,0|2,0,0]=4 13619 B16R2.11414 Brc1ccccc1NCc2ccc(o2)I 207a_100000210017_100000186757 [0,2,0,0,0,0|2,0,0]=4 13620 B16R2.11414 Brc1csc(c1)CNc2ccccc2Br 207a_100000210017_100000211722 [0,2,0,0,0,0|2,0,0]=4 13621 B16R2.11414 Brc1csc(c1)CNc2ccccc2Br 34a_100000210017_100000746031 [0,2,0,0,0,0|2,0,0]=4 13622 B16R2.11414 Brc1csc(c1)CNc2ccccc2I 207a_100000210053_100000211722 [0,2,0,0,0,0|2,0,0]=4 13623 B16R2.11414 Brc1csc(c1)CNc2ccccc2I 34a_100000210053_100000746031 [0,2,0,0,0,0|2,0,0]=4 13624 B16R2.11414 Brc1ncc(s1)CNc2ccccc2Br 34a_100000210017_100000717027 [0,2,0,0,0,0|1,0,1]=4 13625 B16R2.11414 Brc1ncc(s1)CNc2ccccc2I 34a_100000210053_100000717027 [0,2,0,0,0,0|1,0,1]=4 13626 B16R2.11414 Cc1c[nH]c(n1)CNc2ccccc2Br 207a_100000210017_100000082322 [0,2,0,0,0,0|2,0,0]=4 13627 B16R2.11414 Cc1c[nH]c(n1)CNc2ccccc2C 207a_100015192222_100000082322 [0,2,0,0,0,0|2,0,0]=4 13628 B16R2.11414 Cc1c[nH]c(n1)CNc2ccccc2Cl 207a_100000185783_100000082322 [0,2,0,0,0,0|2,0,0]=4 13629 B16R2.11414 Cc1c[nH]c(n1)CNc2ccccc2F 207a_100000210422_100000082322 [0,2,0,0,0,0|2,0,0]=4 13630 B16R2.11414 Cc1c[nH]c(n1)CNc2ccccc2I 207a_100000210053_100000082322 [0,2,0,0,0,0|2,0,0]=4 13631 B16R2.11414 Cc1cc(cs1)CNc2ccccc2Br 207a_100000210017_100011998532 [0,2,0,0,0,0|2,0,0]=4 13632 B16R2.11414 Cc1cc(cs1)CNc2ccccc2C 207a_100015192222_100011998532 [0,2,0,0,0,0|2,0,0]=4 13633 B16R2.11414 Cc1cc(cs1)CNc2ccccc2C 270302a_100015192222_100011998532 [0,2,0,0,0,0|2,0,0]=4 13634 B16R2.11414 Cc1cc(cs1)CNc2ccccc2Cl 207a_100000185783_100011998532 [0,2,0,0,0,0|2,0,0]=4 13635 B16R2.11414 Cc1cc(cs1)CNc2ccccc2F 207a_100000210422_100011998532 [0,2,0,0,0,0|2,0,0]=4 13636 B16R2.11414 Cc1cc(cs1)CNc2ccccc2I 207a_100000210053_100011998532 [0,2,0,0,0,0|2,0,0]=4 13637 B16R2.11414 Cc1cc(no1)CNc2ccccc2Br 207a_100000210017_100011217994 [0,2,0,0,0,0|2,0,0]=4 13638 B16R2.11414 Cc1cc(no1)CNc2ccccc2Br 34a_100000210017_100000199038 [0,2,0,0,0,0|2,0,0]=4 13639 B16R2.11414 Cc1cc(no1)CNc2ccccc2C 207a_100015192222_100011217994 [0,2,0,0,0,0|2,0,0]=4 13640 B16R2.11414 Cc1cc(no1)CNc2ccccc2C 34a_100015192222_100000199038 [0,2,0,0,0,0|2,0,0]=4 13641 B16R2.11414 Cc1cc(no1)CNc2ccccc2Cl 207a_100000185783_100011217994 [0,2,0,0,0,0|2,0,0]=4 13642 B16R2.11414 Cc1cc(no1)CNc2ccccc2Cl 34a_100000185783_100000199038 [0,2,0,0,0,0|2,0,0]=4 13643 B16R2.11414 Cc1cc(no1)CNc2ccccc2F 207a_100000210422_100011217994 [0,2,0,0,0,0|2,0,0]=4 13644 B16R2.11414 Cc1cc(no1)CNc2ccccc2F 34a_100000210422_100000199038 [0,2,0,0,0,0|2,0,0]=4 13645 B16R2.11414 Cc1cc(no1)CNc2ccccc2I 207a_100000210053_100011217994 [0,2,0,0,0,0|2,0,0]=4 13646 B16R2.11414 Cc1cc(no1)CNc2ccccc2I 34a_100000210053_100000199038 [0,2,0,0,0,0|2,0,0]=4 13647 B16R2.11414 Cc1cc(no1)CNc2ccccc2O 34a_100000185747_100000199038 [0,2,0,0,0,0|2,0,0]=4 13648 B16R2.11414 Cc1cc(ns1)CNc2ccccc2Br 207a_100000210017_200000100279 [0,2,0,0,0,0|2,0,0]=4 13649 B16R2.11414 Cc1cc(ns1)CNc2ccccc2C 207a_100015192222_200000100279 [0,2,0,0,0,0|2,0,0]=4 13650 B16R2.11414 Cc1cc(ns1)CNc2ccccc2C 270302a_100015192222_200000100279 [0,2,0,0,0,0|2,0,0]=4 13651 B16R2.11414 Cc1cc(ns1)CNc2ccccc2Cl 207a_100000185783_200000100279 [0,2,0,0,0,0|2,0,0]=4 13652 B16R2.11414 Cc1cc(ns1)CNc2ccccc2F 207a_100000210422_200000100279 [0,2,0,0,0,0|2,0,0]=4 13653 B16R2.11414 Cc1cc(ns1)CNc2ccccc2I 207a_100000210053_200000100279 [0,2,0,0,0,0|2,0,0]=4 13654 B16R2.11414 Cc1ccc(o1)CNc2ccccc2Br 207a_100000210017_100000183696 [0,2,0,0,0,0|2,0,0]=4 13655 B16R2.11414 Cc1ccc(o1)CNc2ccccc2C 207a_100015192222_100000183696 [0,2,0,0,0,0|2,0,0]=4 13656 B16R2.11414 Cc1ccc(o1)CNc2ccccc2C 270302a_100015192222_100000183696 [0,2,0,0,0,0|2,0,0]=4 13657 B16R2.11414 Cc1ccc(o1)CNc2ccccc2Cl 207a_100000185783_100000183696 [0,2,0,0,0,0|2,0,0]=4 13658 B16R2.11414 Cc1ccc(o1)CNc2ccccc2F 207a_100000210422_100000183696 [0,2,0,0,0,0|2,0,0]=4 13659 B16R2.11414 Cc1ccc(o1)CNc2ccccc2I 207a_100000210053_100000183696 [0,2,0,0,0,0|2,0,0]=4 13660 B16R2.11414 Cc1ccc(s1)CNc2ccccc2Br 207a_100000210017_100000211121 [0,2,0,0,0,0|2,0,0]=4 13661 B16R2.11414 Cc1ccc(s1)CNc2ccccc2C 207a_100015192222_100000211121 [0,2,0,0,0,0|2,0,0]=4 13662 B16R2.11414 Cc1ccc(s1)CNc2ccccc2C 270302a_100015192222_100000211121 [0,2,0,0,0,0|2,0,0]=4 13663 B16R2.11414 Cc1ccc(s1)CNc2ccccc2Cl 207a_100000185783_100000211121 [0,2,0,0,0,0|2,0,0]=4 13664 B16R2.11414 Cc1ccc(s1)CNc2ccccc2F 207a_100000210422_100000211121 [0,2,0,0,0,0|2,0,0]=4 13665 B16R2.11414 Cc1ccc(s1)CNc2ccccc2I 207a_100000210053_100000211121 [0,2,0,0,0,0|2,0,0]=4 13666 B16R2.11414 Cc1ccccc1CSc2cn(cn2)C 62a_100000040308_100000211839 [0,2,0,0,0,0|2,0,0]=4 13667 B16R2.11414 Cc1ccccc1CSc2cn(cn2)C 62a_100000211839_100000040308 [0,2,0,0,0,0|2,0,0]=4 13668 B16R2.11414 Cc1ccccc1NCc2cc(co2)Br 270302a_100015192222_100000747035 [0,2,0,0,0,0|2,0,0]=4 13669 B16R2.11414 Cc1ccccc1NCc2cc(cs2)Br 207a_100015192222_100000211722 [0,2,0,0,0,0|2,0,0]=4 13670 B16R2.11414 Cc1ccccc1NCc2cc(cs2)Br 270302a_100015192222_100000211722 [0,2,0,0,0,0|2,0,0]=4 13671 B16R2.11414 Cc1ccccc1NCc2cc(cs2)Br 34a_100015192222_100000746031 [0,2,0,0,0,0|2,0,0]=4 13672 B16R2.11414 Cc1ccccc1NCc2cc(cs2)Cl 207a_100015192222_100000102487 [0,2,0,0,0,0|2,0,0]=4 13673 B16R2.11414 Cc1ccccc1NCc2cc(cs2)Cl 270302a_100015192222_100000102487 [0,2,0,0,0,0|2,0,0]=4 13674 B16R2.11414 Cc1ccccc1NCc2cc(cs2)I 207a_100015192222_100010179861 [0,2,0,0,0,0|2,0,0]=4 13675 B16R2.11414 Cc1ccccc1NCc2cc(cs2)I 270302a_100015192222_100010179861 [0,2,0,0,0,0|2,0,0]=4 13676 B16R2.11414 Cc1ccccc1NCc2ccc(o2)Br 207a_100015192222_100000185145 [0,2,0,0,0,0|2,0,0]=4 13677 B16R2.11414 Cc1ccccc1NCc2ccc(o2)Cl 207a_100015192222_100000188459 [0,2,0,0,0,0|2,0,0]=4 13678 B16R2.11414 Cc1ccccc1NCc2ccc(o2)I 207a_100015192222_100000186757 [0,2,0,0,0,0|2,0,0]=4 13679 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Br 207a_100015192222_100000179771 [0,2,0,0,0,0|2,0,0]=4 13680 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Br 270302a_100015192222_100000179771 [0,2,0,0,0,0|2,0,0]=4 13681 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Br 34a_100015192222_100000708592 [0,2,0,0,0,0|2,0,0]=4 13682 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Cl 207a_100015192222_100000242774 [0,2,0,0,0,0|2,0,0]=4 13683 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Cl 270302a_100015192222_100000242774 [0,2,0,0,0,0|2,0,0]=4 13684 B16R2.11414 Cc1ccccc1NCc2ccc(s2)Cl 34a_100015192222_100000185097 [0,2,0,0,0,0|2,0,0]=4 13685 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 207a_100015192222_100000750880 [0,2,0,0,0,0|2,0,0]=4 13686 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 270302a_100015192222_100000750880 [0,2,0,0,0,0|2,0,0]=4 13687 B16R2.11414 Cc1ccccc1NCc2ccn(n2)C 34a_100015192222_100000726502 [0,2,0,0,0,0|2,0,0]=4 13688 B16R2.11414 Cc1ccccc1NCc2cn(cn2)C 207a_100015192222_100000684808 [0,2,0,0,0,0|0,0,0]=2 13689 B16R2.11414 Cc1ccccc1NCc2cn(cn2)C 34a_100015192222_100000717665 [0,2,0,0,0,0|0,0,0]=2 13690 B16R2.11414 Cc1ccccc1NCc2cn(nn2)C 207a_100015192222_100000749909 [0,2,0,0,0,0|1,0,0]=3 13691 B16R2.11414 Cc1ccccc1NCc2cnc(s2)Br 34a_100015192222_100000717027 [0,2,0,0,0,0|1,0,1]=4 13692 B16R2.11414 Cc1ccccc1NCc2cnc(s2)Cl 34a_100015192222_100000058068 [0,2,0,0,0,0|1,0,1]=4 13693 B16R2.11414 Cc1ccccc1NCc2cnn(c2)C 207a_100015192222_100000206001 [0,2,0,0,0,0|2,0,0]=4 13694 B16R2.11414 Cc1ccccc1NCc2cnn(c2)C 270302a_100015192222_100000206001 [0,2,0,0,0,0|2,0,0]=4 13695 B16R2.11414 Cc1ccccc1NCc2cnn(c2)C 34a_100015192222_100000744441 [0,2,0,0,0,0|2,0,0]=4 13696 B16R2.11414 Cc1ccccc1NCc2csc(c2)Br 207a_100015192222_100000737087 [0,2,0,0,0,0|2,0,0]=4 13697 B16R2.11414 Cc1ccccc1NCc2csc(c2)Br 270302a_100015192222_100000737087 [0,2,0,0,0,0|2,0,0]=4 13698 B16R2.11414 Cc1ccccc1NCc2csc(c2)Cl 207a_100015192222_100009844934 [0,2,0,0,0,0|2,0,0]=4 13699 B16R2.11414 Cc1ccccc1NCc2csc(c2)Cl 270302a_100015192222_100009844934 [0,2,0,0,0,0|2,0,0]=4 13700 B16R2.11414 Cc1ccccc1NCc2csc(n2)Cl 34a_100015192222_100000024076 [0,2,0,0,0,0|1,0,0]=3 13701 B16R2.11414 Cc1ccccc1NCc2ncc(s2)Br 270302a_100015192222_100000699580 [0,2,0,0,0,0|2,0,0]=4 13702 B16R2.11414 Cc1ccccc1NCc2ncc(s2)Cl 270302a_100015192222_100000699884 [0,2,0,0,0,0|2,0,0]=4 13703 B16R2.11414 Cc1ccccc1NCc2ncn(n2)C 207a_100015192222_100010630104 [0,2,0,0,0,0|1,0,0]=3 13704 B16R2.11414 Cc1ccccc1NCc2ncn(n2)C 34a_100015192222_100016995526 [0,2,0,0,0,0|1,0,0]=3 13705 B16R2.11414 Cc1ccccc1NCc2nsc(n2)Cl 34a_100015192222_100000043760 [0,2,0,0,0,0|2,0,0]=4 13706 B16R2.11414 Cc1ccccc1OCc2cn(cn2)C 34a_100000210338_100000717665 [0,2,0,0,0,0|1,0,0]=3 13707 B16R2.11414 Cc1ccccc1OCc2cn(cn2)C 7a_100000210338_100000717665 [0,2,0,0,0,0|1,0,0]=3 13708 B16R2.11414 Cc1ccccc1OCc2cn(nn2)C 274090a_200000210301_100000172636 [0,2,0,0,0,0|2,0,0]=4 13709 B16R2.11414 Cc1ccccc1OCc2cn(nn2)[13CH3] 274090a_200025704644_100000172636 [0,2,0,0,0,0|2,0,0]=4 13710 B16R2.11414 Cc1ccccc1OCc2csc(n2)Cl 34a_100000210338_100000024076 [0,2,0,0,0,0|2,0,0]=4 13711 B16R2.11414 Cc1ccccc1OCc2csc(n2)Cl 7a_100000210338_100000024076 [0,2,0,0,0,0|2,0,0]=4 13712 B16R2.11414 Cc1ccccc1OCc2ncn(n2)C 34a_100000210338_100016995526 [0,2,0,0,0,0|2,0,0]=4 13713 B16R2.11414 Cc1ccccc1OCc2ncn(n2)C 7a_100000210338_100016995526 [0,2,0,0,0,0|2,0,0]=4 13714 B16R2.11414 Cc1ccccc1SCc2cn(cn2)C 62a_100000210755_100000717665 [0,2,0,0,0,0|1,0,0]=3 13715 B16R2.11414 Cc1ccccc1SCc2cn(cn2)C 62a_100000717665_100000210755 [0,2,0,0,0,0|1,0,0]=3 13716 B16R2.11414 Cc1ccccc1SCc2csc(n2)Cl 62a_100000024076_100000210755 [0,2,0,0,0,0|2,0,0]=4 13717 B16R2.11414 Cc1ccccc1SCc2csc(n2)Cl 62a_100000210755_100000024076 [0,2,0,0,0,0|2,0,0]=4 13718 B16R2.11414 Cc1ccccc1SCc2ncn(n2)C 62a_100000210755_100016995526 [0,2,0,0,0,0|2,0,0]=4 13719 B16R2.11414 Cc1ccccc1SCc2ncn(n2)C 62a_100016995526_100000210755 [0,2,0,0,0,0|2,0,0]=4 13720 B16R2.11414 Cc1cccnc1SCc2cn(cn2)C 62a_100000717665_100000751373 [0,2,0,0,0,0|2,0,0]=4 13721 B16R2.11414 Cc1cccnc1SCc2cn(cn2)C 62a_100000751373_100000717665 [0,2,0,0,0,0|2,0,0]=4 13722 B16R2.11414 Cc1ccncc1OCc2cn(cn2)C 34a_100011997053_100000717665 [0,2,0,0,0,0|2,0,0]=4 13723 B16R2.11414 Cc1ccncc1OCc2cn(cn2)C 7a_100011997053_100000717665 [0,2,0,0,0,0|2,0,0]=4 13724 B16R2.11414 Cc1ccncc1SCc2cn(cn2)C 62a_100000717665_100000761580 [0,2,0,0,0,0|2,0,0]=4 13725 B16R2.11414 Cc1ccncc1SCc2cn(cn2)C 62a_100000761580_100000717665 [0,2,0,0,0,0|2,0,0]=4 13726 B16R2.11414 Cc1ccnnc1NCc2cn(cn2)C 27a_100011834058_100000089043 [0,2,0,0,0,0|2,0,0]=4 13727 B16R2.11414 Cc1cnc(s1)CNc2ccccc2Br 207a_100000210017_100011361622 [0,2,0,0,0,0|2,0,0]=4 13728 B16R2.11414 Cc1cnc(s1)CNc2ccccc2C 207a_100015192222_100011361622 [0,2,0,0,0,0|2,0,0]=4 13729 B16R2.11414 Cc1cnc(s1)CNc2ccccc2C 270302a_100015192222_100011361622 [0,2,0,0,0,0|2,0,0]=4 13730 B16R2.11414 Cc1cnc(s1)CNc2ccccc2Cl 207a_100000185783_100011361622 [0,2,0,0,0,0|2,0,0]=4 13731 B16R2.11414 Cc1cnc(s1)CNc2ccccc2F 207a_100000210422_100011361622 [0,2,0,0,0,0|2,0,0]=4 13732 B16R2.11414 Cc1cnc(s1)CNc2ccccc2I 207a_100000210053_100011361622 [0,2,0,0,0,0|2,0,0]=4 13733 B16R2.11414 Cc1cnccc1NCc2cn(cn2)C 27a_100011834058_100000765111 [0,2,0,0,0,0|1,0,0]=3 13734 B16R2.11414 Cc1cnccc1NCc2ncn(n2)C 27a_100000695864_100000765111 [0,2,0,0,0,0|2,0,0]=4 13735 B16R2.11414 Cc1cnccc1OCc2cn(cn2)C 34a_100000694293_100000717665 [0,2,0,0,0,0|2,0,0]=4 13736 B16R2.11414 Cc1cnccc1SCc2cn(cn2)C 62a_100000717665_100000765111 [0,2,0,0,0,0|2,0,0]=4 13737 B16R2.11414 Cc1cnccc1SCc2cn(cn2)C 62a_100000765111_100000717665 [0,2,0,0,0,0|2,0,0]=4 13738 B16R2.11414 Cc1cncnc1NCc2cn(cn2)C 27a_100011834058_100011998708 [0,2,0,0,0,0|2,0,0]=4 13739 B16R2.11414 Cc1csc(c1)CNc2ccccc2Br 207a_100000210017_100102525248 [0,2,0,0,0,0|2,0,0]=4 13740 B16R2.11414 Cc1csc(c1)CNc2ccccc2C 207a_100015192222_100102525248 [0,2,0,0,0,0|2,0,0]=4 13741 B16R2.11414 Cc1csc(c1)CNc2ccccc2C 270302a_100015192222_100102525248 [0,2,0,0,0,0|2,0,0]=4 13742 B16R2.11414 Cc1csc(c1)CNc2ccccc2Cl 207a_100000185783_100102525248 [0,2,0,0,0,0|2,0,0]=4 13743 B16R2.11414 Cc1csc(c1)CNc2ccccc2F 207a_100000210422_100102525248 [0,2,0,0,0,0|2,0,0]=4 13744 B16R2.11414 Cc1csc(c1)CNc2ccccc2I 207a_100000210053_100102525248 [0,2,0,0,0,0|2,0,0]=4 13745 B16R2.11414 Cc1csc(n1)CNc2ccccc2Br 207a_100000210017_100000756994 [0,2,0,0,0,0|2,0,0]=4 13746 B16R2.11414 Cc1csc(n1)CNc2ccccc2C 207a_100015192222_100000756994 [0,2,0,0,0,0|2,0,0]=4 13747 B16R2.11414 Cc1csc(n1)CNc2ccccc2Cl 207a_100000185783_100000756994 [0,2,0,0,0,0|2,0,0]=4 13748 B16R2.11414 Cc1csc(n1)CNc2ccccc2F 207a_100000210422_100000756994 [0,2,0,0,0,0|2,0,0]=4 13749 B16R2.11414 Cc1csc(n1)CNc2ccccc2I 207a_100000210053_100000756994 [0,2,0,0,0,0|2,0,0]=4 13750 B16R2.11414 Cc1nc(c[nH]1)C=Cc2ccccc2F 271570a_200102527919_100009814057 [0,2,0,0,0,0|1,0,1]=4 13751 B16R2.11414 Cc1nc(c[nH]1)CNc2ccccc2Br 207a_100000210017_100011219055 [0,2,0,0,0,0|0,0,0]=2 13752 B16R2.11414 Cc1nc(c[nH]1)CNc2ccccc2C 207a_100015192222_100011219055 [0,2,0,0,0,0|0,0,0]=2 13753 B16R2.11414 Cc1nc(c[nH]1)CNc2ccccc2Cl 207a_100000185783_100011219055 [0,2,0,0,0,0|0,0,0]=2 13754 B16R2.11414 Cc1nc(c[nH]1)CNc2ccccc2F 207a_100000210422_100011219055 [0,2,0,0,0,0|0,0,0]=2 13755 B16R2.11414 Cc1nc(c[nH]1)CNc2ccccc2I 207a_100000210053_100011219055 [0,2,0,0,0,0|0,0,0]=2 13756 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2Br 62a_100000184730_100009814057 [0,2,0,0,0,0|2,0,0]=4 13757 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2Br 62a_100009814057_100000184730 [0,2,0,0,0,0|2,0,0]=4 13758 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2C 62a_100000211839_100009814057 [0,2,0,0,0,0|2,0,0]=4 13759 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2C 62a_100009814057_100000211839 [0,2,0,0,0,0|2,0,0]=4 13760 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2Cl 62a_100000187162_100009814057 [0,2,0,0,0,0|2,0,0]=4 13761 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2Cl 62a_100009814057_100000187162 [0,2,0,0,0,0|2,0,0]=4 13762 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2F 62a_100000211605_100009814057 [0,2,0,0,0,0|2,0,0]=4 13763 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2F 62a_100009814057_100000211605 [0,2,0,0,0,0|2,0,0]=4 13764 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2I 62a_100009814057_100011216222 [0,2,0,0,0,0|2,0,0]=4 13765 B16R2.11414 Cc1nc(c[nH]1)SCc2ccccc2I 62a_100011216222_100009814057 [0,2,0,0,0,0|2,0,0]=4 13766 B16R2.11414 Cc1nc(co1)CNc2ccccc2Br 207a_100000210017_100011361629 [0,2,0,0,0,0|1,0,0]=3 13767 B16R2.11414 Cc1nc(co1)CNc2ccccc2C 207a_100015192222_100011361629 [0,2,0,0,0,0|1,0,0]=3 13768 B16R2.11414 Cc1nc(co1)CNc2ccccc2Cl 207a_100000185783_100011361629 [0,2,0,0,0,0|1,0,0]=3 13769 B16R2.11414 Cc1nc(co1)CNc2ccccc2F 207a_100000210422_100011361629 [0,2,0,0,0,0|1,0,0]=3 13770 B16R2.11414 Cc1nc(co1)CNc2ccccc2I 207a_100000210053_100011361629 [0,2,0,0,0,0|1,0,0]=3 13771 B16R2.11414 Cc1nc(cs1)CNc2ccccc2Br 207a_100000210017_100000203724 [0,2,0,0,0,0|1,0,0]=3 13772 B16R2.11414 Cc1nc(cs1)CNc2ccccc2Br 34a_100000210017_100015186478 [0,2,0,0,0,0|1,0,0]=3 13773 B16R2.11414 Cc1nc(cs1)CNc2ccccc2C 207a_100015192222_100000203724 [0,2,0,0,0,0|1,0,0]=3 13774 B16R2.11414 Cc1nc(cs1)CNc2ccccc2C 270302a_100015192222_100000203724 [0,2,0,0,0,0|1,0,0]=3 13775 B16R2.11414 Cc1nc(cs1)CNc2ccccc2C 34a_100015192222_100015186478 [0,2,0,0,0,0|1,0,0]=3 13776 B16R2.11414 Cc1nc(cs1)CNc2ccccc2Cl 207a_100000185783_100000203724 [0,2,0,0,0,0|1,0,0]=3 13777 B16R2.11414 Cc1nc(cs1)CNc2ccccc2Cl 34a_100000185783_100015186478 [0,2,0,0,0,0|1,0,0]=3 13778 B16R2.11414 Cc1nc(cs1)CNc2ccccc2F 207a_100000210422_100000203724 [0,2,0,0,0,0|1,0,0]=3 13779 B16R2.11414 Cc1nc(cs1)CNc2ccccc2F 34a_100000210422_100015186478 [0,2,0,0,0,0|1,0,0]=3 13780 B16R2.11414 Cc1nc(cs1)CNc2ccccc2I 207a_100000210053_100000203724 [0,2,0,0,0,0|1,0,0]=3 13781 B16R2.11414 Cc1nc(cs1)CNc2ccccc2I 34a_100000210053_100015186478 [0,2,0,0,0,0|1,0,0]=3 13782 B16R2.11414 Cc1nc(cs1)CNc2ccccc2O 34a_100000185747_100015186478 [0,2,0,0,0,0|1,0,0]=3 13783 B16R2.11414 Cc1nc(cs1)CNc2ccncc2Br 27a_100000707933_100000726257 [0,2,0,0,0,0|2,0,0]=4 13784 B16R2.11414 Cc1nc(cs1)CNc2ccncc2C 27a_100000707933_100000765111 [0,2,0,0,0,0|2,0,0]=4 13785 B16R2.11414 Cc1nc(cs1)CNc2ccncc2F 27a_100000707933_100000035921 [0,2,0,0,0,0|2,0,0]=4 13786 B16R2.11414 Cc1nc(cs1)CNc2ncccc2Br 27a_100000707933_100000696092 [0,2,0,0,0,0|2,0,0]=4 13787 B16R2.11414 Cc1nc(cs1)COc2ccccc2Br 34a_100000181306_100015186478 [0,2,0,0,0,0|2,0,0]=4 13788 B16R2.11414 Cc1nc(cs1)COc2ccccc2Br 7a_100000181306_100015186478 [0,2,0,0,0,0|2,0,0]=4 13789 B16R2.11414 Cc1nc(cs1)COc2ccccc2C 34a_100000210338_100015186478 [0,2,0,0,0,0|2,0,0]=4 13790 B16R2.11414 Cc1nc(cs1)COc2ccccc2C 7a_100000210338_100015186478 [0,2,0,0,0,0|2,0,0]=4 13791 B16R2.11414 Cc1nc(cs1)COc2ccccc2Cl 34a_100000210172_100015186478 [0,2,0,0,0,0|2,0,0]=4 13792 B16R2.11414 Cc1nc(cs1)COc2ccccc2Cl 7a_100000210172_100015186478 [0,2,0,0,0,0|2,0,0]=4 13793 B16R2.11414 Cc1nc(cs1)COc2ccccc2F 34a_100000210171_100015186478 [0,2,0,0,0,0|2,0,0]=4 13794 B16R2.11414 Cc1nc(cs1)COc2ccccc2F 7a_100000210171_100015186478 [0,2,0,0,0,0|2,0,0]=4 13795 B16R2.11414 Cc1nc(cs1)COc2ccccc2I 34a_100000739446_100015186478 [0,2,0,0,0,0|2,0,0]=4 13796 B16R2.11414 Cc1nc(cs1)COc2ccccc2I 7a_100000739446_100015186478 [0,2,0,0,0,0|2,0,0]=4 13797 B16R2.11414 Cc1nc(cs1)COc2ccccc2N 34a_100000185747_100015186478 [0,2,0,0,0,0|2,0,0]=4 13798 B16R2.11414 Cc1nc(cs1)COc2ccccc2N 7a_100000185747_100015186478 [0,2,0,0,0,0|2,0,0]=4 13799 B16R2.11414 Cc1nc(cs1)CSc2ccccc2Br 62a_100000695589_100015186478 [0,2,0,0,0,0|2,0,0]=4 13800 B16R2.11414 Cc1nc(cs1)CSc2ccccc2Br 62a_100015186478_100000695589 [0,2,0,0,0,0|2,0,0]=4 13801 B16R2.11414 Cc1nc(cs1)CSc2ccccc2C 62a_100000210755_100015186478 [0,2,0,0,0,0|2,0,0]=4 13802 B16R2.11414 Cc1nc(cs1)CSc2ccccc2C 62a_100015186478_100000210755 [0,2,0,0,0,0|2,0,0]=4 13803 B16R2.11414 Cc1nc(cs1)CSc2ccccc2Cl 62a_100000764095_100015186478 [0,2,0,0,0,0|2,0,0]=4 13804 B16R2.11414 Cc1nc(cs1)CSc2ccccc2Cl 62a_100015186478_100000764095 [0,2,0,0,0,0|2,0,0]=4 13805 B16R2.11414 Cc1nc(cs1)CSc2ccccc2F 62a_100011215700_100015186478 [0,2,0,0,0,0|2,0,0]=4 13806 B16R2.11414 Cc1nc(cs1)CSc2ccccc2F 62a_100015186478_100011215700 [0,2,0,0,0,0|2,0,0]=4 13807 B16R2.11414 Cc1nc(cs1)CSc2ccccc2N 62a_100000210017_100015186478 [0,2,0,0,0,0|2,0,0]=4 13808 B16R2.11414 Cc1nc(cs1)CSc2ccccc2N 62a_100015186478_100000210017 [0,2,0,0,0,0|2,0,0]=4 13809 B16R2.11414 Cc1nc(cs1)CSc2ccccc2O 62a_100000739446_100015186478 [0,2,0,0,0,0|2,0,0]=4 13810 B16R2.11414 Cc1nc(cs1)CSc2ccccc2O 62a_100015186478_100000739446 [0,2,0,0,0,0|2,0,0]=4 13811 B16R2.11414 Cc1nc(n[nH]1)CNc2ccncc2Br 27a_100000752542_100000726257 [0,2,0,0,0,0|2,0,0]=4 13812 B16R2.11414 Cc1nc(n[nH]1)CNc2ccncc2C 27a_100000752542_100000765111 [0,2,0,0,0,0|2,0,0]=4 13813 B16R2.11414 Cc1nc(n[nH]1)CNc2ccncc2F 27a_100000752542_100000035921 [0,2,0,0,0,0|2,0,0]=4 13814 B16R2.11414 Cc1nc(n[nH]1)CNc2ncccc2Br 27a_100000752542_100000696092 [0,2,0,0,0,0|2,0,0]=4 13815 B16R2.11414 Cc1nc(no1)CNc2ccccc2Br 34a_100000210017_100000231061 [0,2,0,0,0,0|2,0,0]=4 13816 B16R2.11414 Cc1nc(no1)CNc2ccccc2C 34a_100015192222_100000231061 [0,2,0,0,0,0|2,0,0]=4 13817 B16R2.11414 Cc1nc(no1)CNc2ccccc2Cl 34a_100000185783_100000231061 [0,2,0,0,0,0|2,0,0]=4 13818 B16R2.11414 Cc1nc(no1)CNc2ccccc2F 34a_100000210422_100000231061 [0,2,0,0,0,0|2,0,0]=4 13819 B16R2.11414 Cc1nc(no1)CNc2ccccc2I 34a_100000210053_100000231061 [0,2,0,0,0,0|2,0,0]=4 13820 B16R2.11414 Cc1nc(no1)CNc2ccccc2O 34a_100000185747_100000231061 [0,2,0,0,0,0|2,0,0]=4 13821 B16R2.11414 Cc1ncc(o1)CNc2ccccc2Br 207a_100000210017_100000084308 [0,2,0,0,0,0|1,0,1]=4 13822 B16R2.11414 Cc1ncc(o1)CNc2ccccc2C 207a_100015192222_100000084308 [0,2,0,0,0,0|1,0,1]=4 13823 B16R2.11414 Cc1ncc(o1)CNc2ccccc2C 270302a_100015192222_100000084308 [0,2,0,0,0,0|1,0,1]=4 13824 B16R2.11414 Cc1ncc(o1)CNc2ccccc2Cl 207a_100000185783_100000084308 [0,2,0,0,0,0|1,0,1]=4 13825 B16R2.11414 Cc1ncc(o1)CNc2ccccc2F 207a_100000210422_100000084308 [0,2,0,0,0,0|1,0,1]=4 13826 B16R2.11414 Cc1ncc(o1)CNc2ccccc2I 207a_100000210053_100000084308 [0,2,0,0,0,0|1,0,1]=4 13827 B16R2.11414 Cc1ncc(s1)CNc2ccccc2Br 207a_100000210017_100000740557 [0,2,0,0,0,0|1,0,1]=4 13828 B16R2.11414 Cc1ncc(s1)CNc2ccccc2Br 34a_100000210017_100020635045 [0,2,0,0,0,0|1,0,1]=4 13829 B16R2.11414 Cc1ncc(s1)CNc2ccccc2C 207a_100015192222_100000740557 [0,2,0,0,0,0|1,0,1]=4 13830 B16R2.11414 Cc1ncc(s1)CNc2ccccc2C 34a_100015192222_100020635045 [0,2,0,0,0,0|1,0,1]=4 13831 B16R2.11414 Cc1ncc(s1)CNc2ccccc2Cl 207a_100000185783_100000740557 [0,2,0,0,0,0|1,0,1]=4 13832 B16R2.11414 Cc1ncc(s1)CNc2ccccc2Cl 34a_100000185783_100020635045 [0,2,0,0,0,0|1,0,1]=4 13833 B16R2.11414 Cc1ncc(s1)CNc2ccccc2F 207a_100000210422_100000740557 [0,2,0,0,0,0|1,0,1]=4 13834 B16R2.11414 Cc1ncc(s1)CNc2ccccc2F 34a_100000210422_100020635045 [0,2,0,0,0,0|1,0,1]=4 13835 B16R2.11414 Cc1ncc(s1)CNc2ccccc2I 207a_100000210053_100000740557 [0,2,0,0,0,0|1,0,1]=4 13836 B16R2.11414 Cc1ncc(s1)CNc2ccccc2I 34a_100000210053_100020635045 [0,2,0,0,0,0|1,0,1]=4 13837 B16R2.11414 Cc1ncc(s1)CNc2ccccc2O 34a_100000185747_100020635045 [0,2,0,0,0,0|1,0,1]=4 13838 B16R2.11414 Cc1ncccc1OCc2cn(cn2)C 34a_100000745507_100000717665 [0,2,0,0,0,0|2,0,0]=4 13839 B16R2.11414 Cc1ncccc1OCc2cn(cn2)C 7a_100000745507_100000717665 [0,2,0,0,0,0|2,0,0]=4 13840 B16R2.11414 Cc1ncccc1SCc2cn(cn2)C 62a_100000717665_100000751574 [0,2,0,0,0,0|2,0,0]=4 13841 B16R2.11414 Cc1ncccc1SCc2cn(cn2)C 62a_100000751574_100000717665 [0,2,0,0,0,0|2,0,0]=4 13842 B16R2.11414 Cc1nccnc1NCc2cn(cn2)C 27a_100011834058_100011999405 [0,2,0,0,0,0|2,0,0]=4 13843 B16R2.11414 Cc1noc(n1)CNc2ccccc2Br 34a_100000210017_100000735555 [0,2,0,0,0,0|1,0,1]=4 13844 B16R2.11414 Cc1noc(n1)CNc2ccccc2C 34a_100015192222_100000735555 [0,2,0,0,0,0|1,0,1]=4 13845 B16R2.11414 Cc1noc(n1)CNc2ccccc2Cl 34a_100000185783_100000735555 [0,2,0,0,0,0|1,0,1]=4 13846 B16R2.11414 Cc1noc(n1)CNc2ccccc2F 34a_100000210422_100000735555 [0,2,0,0,0,0|1,0,1]=4 13847 B16R2.11414 Cc1noc(n1)CNc2ccccc2I 34a_100000210053_100000735555 [0,2,0,0,0,0|1,0,1]=4 13848 B16R2.11414 Cc1noc(n1)CNc2ccccc2O 34a_100000185747_100000735555 [0,2,0,0,0,0|1,0,1]=4 13849 B16R2.11414 Clc1cc(cs1)CNc2ccccc2Br 207a_100000210017_100009844934 [0,2,0,0,0,0|2,0,0]=4 13850 B16R2.11414 Clc1cc(cs1)CNc2ccccc2Cl 207a_100000185783_100009844934 [0,2,0,0,0,0|2,0,0]=4 13851 B16R2.11414 Clc1cc(cs1)CNc2ccccc2I 207a_100000210053_100009844934 [0,2,0,0,0,0|2,0,0]=4 13852 B16R2.11414 Clc1ccc(o1)CNc2ccccc2Br 207a_100000210017_100000188459 [0,2,0,0,0,0|2,0,0]=4 13853 B16R2.11414 Clc1ccc(o1)CNc2ccccc2Cl 207a_100000185783_100000188459 [0,2,0,0,0,0|2,0,0]=4 13854 B16R2.11414 Clc1ccc(o1)CNc2ccccc2I 207a_100000210053_100000188459 [0,2,0,0,0,0|2,0,0]=4 13855 B16R2.11414 Clc1ccc(s1)CNc2ccccc2Br 207a_100000210017_100000242774 [0,2,0,0,0,0|2,0,0]=4 13856 B16R2.11414 Clc1ccc(s1)CNc2ccccc2Br 34a_100000210017_100000185097 [0,2,0,0,0,0|2,0,0]=4 13857 B16R2.11414 Clc1ccc(s1)CNc2ccccc2Cl 207a_100000185783_100000242774 [0,2,0,0,0,0|2,0,0]=4 13858 B16R2.11414 Clc1ccc(s1)CNc2ccccc2Cl 34a_100000185783_100000185097 [0,2,0,0,0,0|2,0,0]=4 13859 B16R2.11414 Clc1ccc(s1)CNc2ccccc2I 207a_100000210053_100000242774 [0,2,0,0,0,0|2,0,0]=4 13860 B16R2.11414 Clc1ccc(s1)CNc2ccccc2I 34a_100000210053_100000185097 [0,2,0,0,0,0|2,0,0]=4 13861 B16R2.11414 Clc1ccccc1NCc2cc(cs2)Br 207a_100000185783_100000211722 [0,2,0,0,0,0|2,0,0]=4 13862 B16R2.11414 Clc1ccccc1NCc2cc(cs2)Br 34a_100000185783_100000746031 [0,2,0,0,0,0|2,0,0]=4 13863 B16R2.11414 Clc1ccccc1NCc2cc(cs2)I 207a_100000185783_100010179861 [0,2,0,0,0,0|2,0,0]=4 13864 B16R2.11414 Clc1ccccc1NCc2ccc(o2)Br 207a_100000185783_100000185145 [0,2,0,0,0,0|2,0,0]=4 13865 B16R2.11414 Clc1ccccc1NCc2ccc(o2)I 207a_100000185783_100000186757 [0,2,0,0,0,0|2,0,0]=4 13866 B16R2.11414 Clc1ccccc1NCc2ccc(s2)Br 207a_100000185783_100000179771 [0,2,0,0,0,0|2,0,0]=4 13867 B16R2.11414 Clc1ccccc1NCc2ccc(s2)Br 34a_100000185783_100000708592 [0,2,0,0,0,0|2,0,0]=4 13868 B16R2.11414 Clc1ccccc1NCc2cnc(s2)Br 34a_100000185783_100000717027 [0,2,0,0,0,0|1,0,1]=4 13869 B16R2.11414 Clc1ccccc1NCc2csc(c2)Br 207a_100000185783_100000737087 [0,2,0,0,0,0|2,0,0]=4 13870 B16R2.11414 Clc1csc(c1)CNc2ccccc2Br 207a_100000210017_100000102487 [0,2,0,0,0,0|2,0,0]=4 13871 B16R2.11414 Clc1csc(c1)CNc2ccccc2Cl 207a_100000185783_100000102487 [0,2,0,0,0,0|2,0,0]=4 13872 B16R2.11414 Clc1csc(c1)CNc2ccccc2I 207a_100000210053_100000102487 [0,2,0,0,0,0|2,0,0]=4 13873 B16R2.11414 Clc1nc(cs1)CNc2ccccc2Br 34a_100000210017_100000024076 [0,2,0,0,0,0|1,0,0]=3 13874 B16R2.11414 Clc1nc(cs1)CNc2ccccc2Cl 34a_100000185783_100000024076 [0,2,0,0,0,0|1,0,0]=3 13875 B16R2.11414 Clc1nc(cs1)CNc2ccccc2I 34a_100000210053_100000024076 [0,2,0,0,0,0|1,0,0]=3 13876 B16R2.11414 Clc1nc(cs1)COc2ccccc2Br 34a_100000181306_100000024076 [0,2,0,0,0,0|2,0,0]=4 13877 B16R2.11414 Clc1nc(cs1)COc2ccccc2Br 7a_100000181306_100000024076 [0,2,0,0,0,0|2,0,0]=4 13878 B16R2.11414 Clc1nc(cs1)COc2ccccc2Cl 34a_100000210172_100000024076 [0,2,0,0,0,0|2,0,0]=4 13879 B16R2.11414 Clc1nc(cs1)COc2ccccc2Cl 7a_100000210172_100000024076 [0,2,0,0,0,0|2,0,0]=4 13880 B16R2.11414 Clc1nc(cs1)COc2ccccc2I 34a_100000739446_100000024076 [0,2,0,0,0,0|2,0,0]=4 13881 B16R2.11414 Clc1nc(cs1)COc2ccccc2I 7a_100000739446_100000024076 [0,2,0,0,0,0|2,0,0]=4 13882 B16R2.11414 Clc1nc(cs1)CSc2ccccc2Br 62a_100000024076_100000695589 [0,2,0,0,0,0|2,0,0]=4 13883 B16R2.11414 Clc1nc(cs1)CSc2ccccc2Br 62a_100000695589_100000024076 [0,2,0,0,0,0|2,0,0]=4 13884 B16R2.11414 Clc1nc(cs1)CSc2ccccc2Cl 62a_100000024076_100000764095 [0,2,0,0,0,0|2,0,0]=4 13885 B16R2.11414 Clc1nc(cs1)CSc2ccccc2Cl 62a_100000764095_100000024076 [0,2,0,0,0,0|2,0,0]=4 13886 B16R2.11414 Clc1nc(ns1)CNc2ccccc2Br 34a_100000210017_100000043760 [0,2,0,0,0,0|2,0,0]=4 13887 B16R2.11414 Clc1nc(ns1)CNc2ccccc2Cl 34a_100000185783_100000043760 [0,2,0,0,0,0|2,0,0]=4 13888 B16R2.11414 Clc1nc(ns1)CNc2ccccc2I 34a_100000210053_100000043760 [0,2,0,0,0,0|2,0,0]=4 13889 B16R2.11414 Clc1ncc(s1)CNc2ccccc2Br 34a_100000210017_100000058068 [0,2,0,0,0,0|1,0,1]=4 13890 B16R2.11414 Clc1ncc(s1)CNc2ccccc2Cl 34a_100000185783_100000058068 [0,2,0,0,0,0|1,0,1]=4 13891 B16R2.11414 Clc1ncc(s1)CNc2ccccc2I 34a_100000210053_100000058068 [0,2,0,0,0,0|1,0,1]=4 13892 B16R2.11414 Cn1cc(cn1)CNc2ccccc2Br 207a_100000210017_100000206001 [0,2,0,0,0,0|2,0,0]=4 13893 B16R2.11414 Cn1cc(cn1)CNc2ccccc2Br 34a_100000210017_100000744441 [0,2,0,0,0,0|2,0,0]=4 13894 B16R2.11414 Cn1cc(cn1)CNc2ccccc2Cl 207a_100000185783_100000206001 [0,2,0,0,0,0|2,0,0]=4 13895 B16R2.11414 Cn1cc(cn1)CNc2ccccc2Cl 34a_100000185783_100000744441 [0,2,0,0,0,0|2,0,0]=4 13896 B16R2.11414 Cn1cc(cn1)CNc2ccccc2F 207a_100000210422_100000206001 [0,2,0,0,0,0|2,0,0]=4 13897 B16R2.11414 Cn1cc(cn1)CNc2ccccc2F 34a_100000210422_100000744441 [0,2,0,0,0,0|2,0,0]=4 13898 B16R2.11414 Cn1cc(cn1)CNc2ccccc2I 207a_100000210053_100000206001 [0,2,0,0,0,0|2,0,0]=4 13899 B16R2.11414 Cn1cc(cn1)CNc2ccccc2I 34a_100000210053_100000744441 [0,2,0,0,0,0|2,0,0]=4 13900 B16R2.11414 Cn1cc(cn1)CNc2ccccc2O 34a_100000185747_100000744441 [0,2,0,0,0,0|2,0,0]=4 13901 B16R2.11414 Cn1cc(nn1)CNc2ccccc2Br 207a_100000210017_100000749909 [0,2,0,0,0,0|1,0,0]=3 13902 B16R2.11414 Cn1cc(nn1)CNc2ccccc2Cl 207a_100000185783_100000749909 [0,2,0,0,0,0|1,0,0]=3 13903 B16R2.11414 Cn1cc(nn1)CNc2ccccc2F 207a_100000210422_100000749909 [0,2,0,0,0,0|1,0,0]=3 13904 B16R2.11414 Cn1cc(nn1)CNc2ccccc2I 207a_100000210053_100000749909 [0,2,0,0,0,0|1,0,0]=3 13905 B16R2.11414 Cn1cc(nn1)COc2ccccc2Br 274090a_200000210301_100000173974 [0,2,0,0,0,0|2,0,0]=4 13906 B16R2.11414 Cn1cc(nn1)COc2ccccc2Cl 274090a_200000210301_100000172630 [0,2,0,0,0,0|2,0,0]=4 13907 B16R2.11414 Cn1cc(nn1)COc2ccccc2F 274090a_200000210301_100000173115 [0,2,0,0,0,0|2,0,0]=4 13908 B16R2.11414 Cn1cc(nn1)COc2ccccc2N 274090a_200000210301_100000707309 [0,2,0,0,0,0|2,0,0]=4 13909 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Br 207a_100000210017_100000750880 [0,2,0,0,0,0|2,0,0]=4 13910 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Br 34a_100000210017_100000726502 [0,2,0,0,0,0|2,0,0]=4 13911 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Cl 207a_100000185783_100000750880 [0,2,0,0,0,0|2,0,0]=4 13912 B16R2.11414 Cn1ccc(n1)CNc2ccccc2Cl 34a_100000185783_100000726502 [0,2,0,0,0,0|2,0,0]=4 13913 B16R2.11414 Cn1ccc(n1)CNc2ccccc2F 207a_100000210422_100000750880 [0,2,0,0,0,0|2,0,0]=4 13914 B16R2.11414 Cn1ccc(n1)CNc2ccccc2F 34a_100000210422_100000726502 [0,2,0,0,0,0|2,0,0]=4 13915 B16R2.11414 Cn1ccc(n1)CNc2ccccc2I 207a_100000210053_100000750880 [0,2,0,0,0,0|2,0,0]=4 13916 B16R2.11414 Cn1ccc(n1)CNc2ccccc2I 34a_100000210053_100000726502 [0,2,0,0,0,0|2,0,0]=4 13917 B16R2.11414 Cn1ccc(n1)CNc2ccccc2O 34a_100000185747_100000726502 [0,2,0,0,0,0|2,0,0]=4 13918 B16R2.11414 Cn1cnc(c1)C=Cc2ccccc2F 271570a_200102527919_100000040308 [0,2,0,0,0,0|1,0,1]=4 13919 B16R2.11414 Cn1cnc(c1)CNc2ccccc2Br 207a_100000210017_100000684808 [0,2,0,0,0,0|0,0,0]=2 13920 B16R2.11414 Cn1cnc(c1)CNc2ccccc2Br 34a_100000210017_100000717665 [0,2,0,0,0,0|0,0,0]=2 13921 B16R2.11414 Cn1cnc(c1)CNc2ccccc2Cl 207a_100000185783_100000684808 [0,2,0,0,0,0|0,0,0]=2 13922 B16R2.11414 Cn1cnc(c1)CNc2ccccc2Cl 34a_100000185783_100000717665 [0,2,0,0,0,0|0,0,0]=2 13923 B16R2.11414 Cn1cnc(c1)CNc2ccccc2F 207a_100000210422_100000684808 [0,2,0,0,0,0|0,0,0]=2 13924 B16R2.11414 Cn1cnc(c1)CNc2ccccc2F 34a_100000210422_100000717665 [0,2,0,0,0,0|0,0,0]=2 13925 B16R2.11414 Cn1cnc(c1)CNc2ccccc2I 207a_100000210053_100000684808 [0,2,0,0,0,0|0,0,0]=2 13926 B16R2.11414 Cn1cnc(c1)CNc2ccccc2I 34a_100000210053_100000717665 [0,2,0,0,0,0|0,0,0]=2 13927 B16R2.11414 Cn1cnc(c1)CNc2ccccc2O 34a_100000185747_100000717665 [0,2,0,0,0,0|0,0,0]=2 13928 B16R2.11414 Cn1cnc(c1)CNc2ccn[nH]c2=O 27a_100011834058_100000087129 [0,2,0,0,0,0|2,0,0]=4 13929 B16R2.11414 Cn1cnc(c1)CNc2ccncc2Br 27a_100011834058_100000726257 [0,2,0,0,0,0|1,0,0]=3 13930 B16R2.11414 Cn1cnc(c1)CNc2ccncc2F 27a_100011834058_100000035921 [0,2,0,0,0,0|1,0,0]=3 13931 B16R2.11414 Cn1cnc(c1)CNc2ncccc2Br 27a_100011834058_100000696092 [0,2,0,0,0,0|1,0,0]=3 13932 B16R2.11414 Cn1cnc(c1)CNc2nccnc2F 27a_100011834058_200010125657 [0,2,0,0,0,0|2,0,0]=4 13933 B16R2.11414 Cn1cnc(c1)CNc2ncncc2F 27a_100011834058_100000069762 [0,2,0,0,0,0|2,0,0]=4 13934 B16R2.11414 Cn1cnc(c1)CNc2ncncc2N 27a_100011834058_100000709731 [0,2,0,0,0,0|2,0,0]=4 13935 B16R2.11414 Cn1cnc(c1)COc2cccc[n+]2[O-] 7a_100000211761_100000717665 [0,2,0,0,0,0|2,0,0]=4 13936 B16R2.11414 Cn1cnc(c1)COc2ccccc2Br 34a_100000181306_100000717665 [0,2,0,0,0,0|1,0,0]=3 13937 B16R2.11414 Cn1cnc(c1)COc2ccccc2Br 7a_100000181306_100000717665 [0,2,0,0,0,0|1,0,0]=3 13938 B16R2.11414 Cn1cnc(c1)COc2ccccc2Cl 34a_100000210172_100000717665 [0,2,0,0,0,0|1,0,0]=3 13939 B16R2.11414 Cn1cnc(c1)COc2ccccc2Cl 7a_100000210172_100000717665 [0,2,0,0,0,0|1,0,0]=3 13940 B16R2.11414 Cn1cnc(c1)COc2ccccc2F 34a_100000210171_100000717665 [0,2,0,0,0,0|1,0,0]=3 13941 B16R2.11414 Cn1cnc(c1)COc2ccccc2F 7a_100000210171_100000717665 [0,2,0,0,0,0|1,0,0]=3 13942 B16R2.11414 Cn1cnc(c1)COc2ccccc2I 34a_100000739446_100000717665 [0,2,0,0,0,0|1,0,0]=3 13943 B16R2.11414 Cn1cnc(c1)COc2ccccc2I 7a_100000739446_100000717665 [0,2,0,0,0,0|1,0,0]=3 13944 B16R2.11414 Cn1cnc(c1)COc2ccccc2N 34a_100000185747_100000717665 [0,2,0,0,0,0|1,0,0]=3 13945 B16R2.11414 Cn1cnc(c1)COc2ccccc2N 7a_100000185747_100000717665 [0,2,0,0,0,0|1,0,0]=3 13946 B16R2.11414 Cn1cnc(c1)COc2cccnc2Br 34a_100000744436_100000717665 [0,2,0,0,0,0|2,0,0]=4 13947 B16R2.11414 Cn1cnc(c1)COc2cccnc2Br 7a_100000744436_100000717665 [0,2,0,0,0,0|2,0,0]=4 13948 B16R2.11414 Cn1cnc(c1)COc2cccnc2Cl 34a_100000757616_100000717665 [0,2,0,0,0,0|2,0,0]=4 13949 B16R2.11414 Cn1cnc(c1)COc2cccnc2Cl 7a_100000757616_100000717665 [0,2,0,0,0,0|2,0,0]=4 13950 B16R2.11414 Cn1cnc(c1)COc2cccnc2F 34a_100000061740_100000717665 [0,2,0,0,0,0|2,0,0]=4 13951 B16R2.11414 Cn1cnc(c1)COc2cccnc2F 7a_100000061740_100000717665 [0,2,0,0,0,0|2,0,0]=4 13952 B16R2.11414 Cn1cnc(c1)COc2cccnc2I 34a_100000034122_100000717665 [0,2,0,0,0,0|2,0,0]=4 13953 B16R2.11414 Cn1cnc(c1)COc2cccnc2I 7a_100000034122_100000717665 [0,2,0,0,0,0|2,0,0]=4 13954 B16R2.11414 Cn1cnc(c1)COc2cccnc2N 34a_100000211975_100000717665 [0,2,0,0,0,0|2,0,0]=4 13955 B16R2.11414 Cn1cnc(c1)COc2cccnc2N 7a_100000211975_100000717665 [0,2,0,0,0,0|2,0,0]=4 13956 B16R2.11414 Cn1cnc(c1)COc2cccoc2=O 34a_100000077404_100000717665 [0,2,0,0,0,0|2,0,0]=4 13957 B16R2.11414 Cn1cnc(c1)COc2cccoc2=O 7a_100000077404_100000717665 [0,2,0,0,0,0|2,0,0]=4 13958 B16R2.11414 Cn1cnc(c1)COc2ccncc2Br 34a_100011996408_100000717665 [0,2,0,0,0,0|2,0,0]=4 13959 B16R2.11414 Cn1cnc(c1)COc2ccncc2Cl 34a_100011997054_100000717665 [0,2,0,0,0,0|2,0,0]=4 13960 B16R2.11414 Cn1cnc(c1)COc2ccncc2F 34a_200000081243_100000717665 [0,2,0,0,0,0|2,0,0]=4 13961 B16R2.11414 Cn1cnc(c1)COc2cnccc2Cl 34a_100011996695_100000717665 [0,2,0,0,0,0|2,0,0]=4 13962 B16R2.11414 Cn1cnc(c1)COc2cnccc2I 34a_100000050107_100000717665 [0,2,0,0,0,0|2,0,0]=4 13963 B16R2.11414 Cn1cnc(c1)COc2cnccc2N 34a_100000753702_100000717665 [0,2,0,0,0,0|2,0,0]=4 13964 B16R2.11414 Cn1cnc(c1)COc2coccc2=O 34a_100000060831_100000717665 [0,2,0,0,0,0|2,0,0]=4 13965 B16R2.11414 Cn1cnc(c1)COc2ncccc2Cl 34a_100011290957_100000717665 [0,2,0,0,0,0|2,0,0]=4 13966 B16R2.11414 Cn1cnc(c1)COc2ncccc2F 34a_100011219419_100000717665 [0,2,0,0,0,0|2,0,0]=4 13967 B16R2.11414 Cn1cnc(c1)COc2ncccc2N 34a_100000746358_100000717665 [0,2,0,0,0,0|2,0,0]=4 13968 B16R2.11414 Cn1cnc(c1)CSc2c[nH]ccc2=O 62a_100000717665_100009998708 [0,2,0,0,0,0|2,0,0]=4 13969 B16R2.11414 Cn1cnc(c1)CSc2c[nH]ccc2=O 62a_100009998708_100000717665 [0,2,0,0,0,0|2,0,0]=4 13970 B16R2.11414 Cn1cnc(c1)CSc2c[nH]ccc2=S 62a_100000717665_200012280681 [0,2,0,0,0,0|2,0,0]=4 13971 B16R2.11414 Cn1cnc(c1)CSc2c[nH]ccc2=S 62a_200012280681_100000717665 [0,2,0,0,0,0|2,0,0]=4 13972 B16R2.11414 Cn1cnc(c1)CSc2cccc[n+]2C 62a_100000717665_100000212160 [0,2,0,0,0,0|2,0,0]=4 13973 B16R2.11414 Cn1cnc(c1)CSc2cccc[n+]2[O-] 62a_100000717665_200000042595 [0,2,0,0,0,0|2,0,0]=4 13974 B16R2.11414 Cn1cnc(c1)CSc2ccccc2Br 62a_100000695589_100000717665 [0,2,0,0,0,0|1,0,0]=3 13975 B16R2.11414 Cn1cnc(c1)CSc2ccccc2Br 62a_100000717665_100000695589 [0,2,0,0,0,0|1,0,0]=3 13976 B16R2.11414 Cn1cnc(c1)CSc2ccccc2Cl 62a_100000717665_100000764095 [0,2,0,0,0,0|1,0,0]=3 13977 B16R2.11414 Cn1cnc(c1)CSc2ccccc2Cl 62a_100000764095_100000717665 [0,2,0,0,0,0|1,0,0]=3 13978 B16R2.11414 Cn1cnc(c1)CSc2ccccc2F 62a_100000717665_100011215700 [0,2,0,0,0,0|1,0,0]=3 13979 B16R2.11414 Cn1cnc(c1)CSc2ccccc2F 62a_100011215700_100000717665 [0,2,0,0,0,0|1,0,0]=3 13980 B16R2.11414 Cn1cnc(c1)CSc2ccccc2N 62a_100000210017_100000717665 [0,2,0,0,0,0|1,0,0]=3 13981 B16R2.11414 Cn1cnc(c1)CSc2ccccc2N 62a_100000717665_100000210017 [0,2,0,0,0,0|1,0,0]=3 13982 B16R2.11414 Cn1cnc(c1)CSc2ccccc2O 62a_100000717665_100000739446 [0,2,0,0,0,0|1,0,0]=3 13983 B16R2.11414 Cn1cnc(c1)CSc2ccccc2O 62a_100000739446_100000717665 [0,2,0,0,0,0|1,0,0]=3 13984 B16R2.11414 Cn1cnc(c1)CSc2cccnc2Br 62a_100000717665_100010202626 [0,2,0,0,0,0|2,0,0]=4 13985 B16R2.11414 Cn1cnc(c1)CSc2cccnc2Br 62a_100010202626_100000717665 [0,2,0,0,0,0|2,0,0]=4 13986 B16R2.11414 Cn1cnc(c1)CSc2cccnc2Cl 62a_100000036424_100000717665 [0,2,0,0,0,0|2,0,0]=4 13987 B16R2.11414 Cn1cnc(c1)CSc2cccnc2Cl 62a_100000717665_100000036424 [0,2,0,0,0,0|2,0,0]=4 13988 B16R2.11414 Cn1cnc(c1)CSc2cccnc2F 62a_100000717665_100009816115 [0,2,0,0,0,0|2,0,0]=4 13989 B16R2.11414 Cn1cnc(c1)CSc2cccnc2F 62a_100009816115_100000717665 [0,2,0,0,0,0|2,0,0]=4 13990 B16R2.11414 Cn1cnc(c1)CSc2cccnc2N 62a_100000045569_100000717665 [0,2,0,0,0,0|2,0,0]=4 13991 B16R2.11414 Cn1cnc(c1)CSc2cccnc2N 62a_100000717665_100000045569 [0,2,0,0,0,0|2,0,0]=4 13992 B16R2.11414 Cn1cnc(c1)CSc2cccnc2O 62a_100000717665_100000760158 [0,2,0,0,0,0|2,0,0]=4 13993 B16R2.11414 Cn1cnc(c1)CSc2cccnc2O 62a_100000760158_100000717665 [0,2,0,0,0,0|2,0,0]=4 13994 B16R2.11414 Cn1cnc(c1)CSc2ccncc2Br 62a_100000717665_100000726257 [0,2,0,0,0,0|2,0,0]=4 13995 B16R2.11414 Cn1cnc(c1)CSc2ccncc2Br 62a_100000726257_100000717665 [0,2,0,0,0,0|2,0,0]=4 13996 B16R2.11414 Cn1cnc(c1)CSc2ccncc2Cl 62a_100000708259_100000717665 [0,2,0,0,0,0|2,0,0]=4 13997 B16R2.11414 Cn1cnc(c1)CSc2ccncc2Cl 62a_100000717665_100000708259 [0,2,0,0,0,0|2,0,0]=4 13998 B16R2.11414 Cn1cnc(c1)CSc2ccncc2F 62a_100000047030_100000717665 [0,2,0,0,0,0|2,0,0]=4 13999 B16R2.11414 Cn1cnc(c1)CSc2ccncc2F 62a_100000717665_100000047030 [0,2,0,0,0,0|2,0,0]=4 14000 B16R2.11414 Cn1cnc(c1)CSc2ccncc2N 62a_100000717665_100000756074 [0,2,0,0,0,0|2,0,0]=4 14001 B16R2.11414 Cn1cnc(c1)CSc2ccncc2N 62a_100000756074_100000717665 [0,2,0,0,0,0|2,0,0]=4 14002 B16R2.11414 Cn1cnc(c1)CSc2ccncc2O 62a_100000717665_100009817591 [0,2,0,0,0,0|2,0,0]=4 14003 B16R2.11414 Cn1cnc(c1)CSc2ccncc2O 62a_100009817591_100000717665 [0,2,0,0,0,0|2,0,0]=4 14004 B16R2.11414 Cn1cnc(c1)CSc2cnccc2Br 62a_100000717665_100010138639 [0,2,0,0,0,0|2,0,0]=4 14005 B16R2.11414 Cn1cnc(c1)CSc2cnccc2Br 62a_100010138639_100000717665 [0,2,0,0,0,0|2,0,0]=4 14006 B16R2.11414 Cn1cnc(c1)CSc2cnccc2Cl 62a_100000717665_100009995489 [0,2,0,0,0,0|2,0,0]=4 14007 B16R2.11414 Cn1cnc(c1)CSc2cnccc2Cl 62a_100009995489_100000717665 [0,2,0,0,0,0|2,0,0]=4 14008 B16R2.11414 Cn1cnc(c1)CSc2cnccc2F 62a_100000717665_100009820683 [0,2,0,0,0,0|2,0,0]=4 14009 B16R2.11414 Cn1cnc(c1)CSc2cnccc2F 62a_100009820683_100000717665 [0,2,0,0,0,0|2,0,0]=4 14010 B16R2.11414 Cn1cnc(c1)CSc2cnccc2N 62a_100000047001_100000717665 [0,2,0,0,0,0|2,0,0]=4 14011 B16R2.11414 Cn1cnc(c1)CSc2cnccc2N 62a_100000717665_100000047001 [0,2,0,0,0,0|2,0,0]=4 14012 B16R2.11414 Cn1cnc(c1)CSc2ncccc2Br 62a_100000696092_100000717665 [0,2,0,0,0,0|2,0,0]=4 14013 B16R2.11414 Cn1cnc(c1)CSc2ncccc2Br 62a_100000717665_100000696092 [0,2,0,0,0,0|2,0,0]=4 14014 B16R2.11414 Cn1cnc(c1)CSc2ncccc2Cl 62a_100000717665_100011356963 [0,2,0,0,0,0|2,0,0]=4 14015 B16R2.11414 Cn1cnc(c1)CSc2ncccc2Cl 62a_100011356963_100000717665 [0,2,0,0,0,0|2,0,0]=4 14016 B16R2.11414 Cn1cnc(c1)CSc2ncccc2F 62a_100000685392_100000717665 [0,2,0,0,0,0|2,0,0]=4 14017 B16R2.11414 Cn1cnc(c1)CSc2ncccc2F 62a_100000717665_100000685392 [0,2,0,0,0,0|2,0,0]=4 14018 B16R2.11414 Cn1cnc(c1)CSc2ncccc2N 62a_100000688686_100000717665 [0,2,0,0,0,0|2,0,0]=4 14019 B16R2.11414 Cn1cnc(c1)CSc2ncccc2N 62a_100000717665_100000688686 [0,2,0,0,0,0|2,0,0]=4 14020 B16R2.11414 Cn1cnc(c1)CSc2ncccc2O 62a_100000034122_100000717665 [0,2,0,0,0,0|2,0,0]=4 14021 B16R2.11414 Cn1cnc(c1)CSc2ncccc2O 62a_100000717665_100000034122 [0,2,0,0,0,0|2,0,0]=4 14022 B16R2.11414 Cn1cnc(c1)SCc2ccccc2Br 62a_100000040308_100000184730 [0,2,0,0,0,0|2,0,0]=4 14023 B16R2.11414 Cn1cnc(c1)SCc2ccccc2Br 62a_100000184730_100000040308 [0,2,0,0,0,0|2,0,0]=4 14024 B16R2.11414 Cn1cnc(c1)SCc2ccccc2Cl 62a_100000040308_100000187162 [0,2,0,0,0,0|2,0,0]=4 14025 B16R2.11414 Cn1cnc(c1)SCc2ccccc2Cl 62a_100000187162_100000040308 [0,2,0,0,0,0|2,0,0]=4 14026 B16R2.11414 Cn1cnc(c1)SCc2ccccc2F 62a_100000040308_100000211605 [0,2,0,0,0,0|2,0,0]=4 14027 B16R2.11414 Cn1cnc(c1)SCc2ccccc2F 62a_100000211605_100000040308 [0,2,0,0,0,0|2,0,0]=4 14028 B16R2.11414 Cn1cnc(c1)SCc2ccccc2I 62a_100000040308_100011216222 [0,2,0,0,0,0|2,0,0]=4 14029 B16R2.11414 Cn1cnc(c1)SCc2ccccc2I 62a_100011216222_100000040308 [0,2,0,0,0,0|2,0,0]=4 14030 B16R2.11414 Cn1cnc(n1)CNc2ccccc2Br 207a_100000210017_100010630104 [0,2,0,0,0,0|1,0,0]=3 14031 B16R2.11414 Cn1cnc(n1)CNc2ccccc2Br 34a_100000210017_100016995526 [0,2,0,0,0,0|1,0,0]=3 14032 B16R2.11414 Cn1cnc(n1)CNc2ccccc2Cl 207a_100000185783_100010630104 [0,2,0,0,0,0|1,0,0]=3 14033 B16R2.11414 Cn1cnc(n1)CNc2ccccc2Cl 34a_100000185783_100016995526 [0,2,0,0,0,0|1,0,0]=3 14034 B16R2.11414 Cn1cnc(n1)CNc2ccccc2F 207a_100000210422_100010630104 [0,2,0,0,0,0|1,0,0]=3 14035 B16R2.11414 Cn1cnc(n1)CNc2ccccc2F 34a_100000210422_100016995526 [0,2,0,0,0,0|1,0,0]=3 14036 B16R2.11414 Cn1cnc(n1)CNc2ccccc2I 207a_100000210053_100010630104 [0,2,0,0,0,0|1,0,0]=3 14037 B16R2.11414 Cn1cnc(n1)CNc2ccccc2I 34a_100000210053_100016995526 [0,2,0,0,0,0|1,0,0]=3 14038 B16R2.11414 Cn1cnc(n1)CNc2ccccc2O 34a_100000185747_100016995526 [0,2,0,0,0,0|1,0,0]=3 14039 B16R2.11414 Cn1cnc(n1)CNc2ccncc2Br 27a_100000695864_100000726257 [0,2,0,0,0,0|2,0,0]=4 14040 B16R2.11414 Cn1cnc(n1)CNc2ccncc2F 27a_100000695864_100000035921 [0,2,0,0,0,0|2,0,0]=4 14041 B16R2.11414 Cn1cnc(n1)CNc2ncccc2Br 27a_100000695864_100000696092 [0,2,0,0,0,0|2,0,0]=4 14042 B16R2.11414 Cn1cnc(n1)COc2ccccc2Br 34a_100000181306_100016995526 [0,2,0,0,0,0|2,0,0]=4 14043 B16R2.11414 Cn1cnc(n1)COc2ccccc2Br 7a_100000181306_100016995526 [0,2,0,0,0,0|2,0,0]=4 14044 B16R2.11414 Cn1cnc(n1)COc2ccccc2Cl 34a_100000210172_100016995526 [0,2,0,0,0,0|2,0,0]=4 14045 B16R2.11414 Cn1cnc(n1)COc2ccccc2Cl 7a_100000210172_100016995526 [0,2,0,0,0,0|2,0,0]=4 14046 B16R2.11414 Cn1cnc(n1)COc2ccccc2F 34a_100000210171_100016995526 [0,2,0,0,0,0|2,0,0]=4 14047 B16R2.11414 Cn1cnc(n1)COc2ccccc2F 7a_100000210171_100016995526 [0,2,0,0,0,0|2,0,0]=4 14048 B16R2.11414 Cn1cnc(n1)COc2ccccc2I 34a_100000739446_100016995526 [0,2,0,0,0,0|2,0,0]=4 14049 B16R2.11414 Cn1cnc(n1)COc2ccccc2I 7a_100000739446_100016995526 [0,2,0,0,0,0|2,0,0]=4 14050 B16R2.11414 Cn1cnc(n1)COc2ccccc2N 34a_100000185747_100016995526 [0,2,0,0,0,0|2,0,0]=4 14051 B16R2.11414 Cn1cnc(n1)COc2ccccc2N 7a_100000185747_100016995526 [0,2,0,0,0,0|2,0,0]=4 14052 B16R2.11414 Cn1cnc(n1)CSc2ccccc2Br 62a_100000695589_100016995526 [0,2,0,0,0,0|2,0,0]=4 14053 B16R2.11414 Cn1cnc(n1)CSc2ccccc2Br 62a_100016995526_100000695589 [0,2,0,0,0,0|2,0,0]=4 14054 B16R2.11414 Cn1cnc(n1)CSc2ccccc2Cl 62a_100000764095_100016995526 [0,2,0,0,0,0|2,0,0]=4 14055 B16R2.11414 Cn1cnc(n1)CSc2ccccc2Cl 62a_100016995526_100000764095 [0,2,0,0,0,0|2,0,0]=4 14056 B16R2.11414 Cn1cnc(n1)CSc2ccccc2F 62a_100011215700_100016995526 [0,2,0,0,0,0|2,0,0]=4 14057 B16R2.11414 Cn1cnc(n1)CSc2ccccc2F 62a_100016995526_100011215700 [0,2,0,0,0,0|2,0,0]=4 14058 B16R2.11414 Cn1cnc(n1)CSc2ccccc2N 62a_100000210017_100016995526 [0,2,0,0,0,0|2,0,0]=4 14059 B16R2.11414 Cn1cnc(n1)CSc2ccccc2N 62a_100016995526_100000210017 [0,2,0,0,0,0|2,0,0]=4 14060 B16R2.11414 Cn1cnc(n1)CSc2ccccc2O 62a_100000739446_100016995526 [0,2,0,0,0,0|2,0,0]=4 14061 B16R2.11414 Cn1cnc(n1)CSc2ccccc2O 62a_100016995526_100000739446 [0,2,0,0,0,0|2,0,0]=4 14062 B16R2.11414 Fc1ccccc1NCc2cc(cs2)Br 207a_100000210422_100000211722 [0,2,0,0,0,0|2,0,0]=4 14063 B16R2.11414 Fc1ccccc1NCc2cc(cs2)Br 34a_100000210422_100000746031 [0,2,0,0,0,0|2,0,0]=4 14064 B16R2.11414 Fc1ccccc1NCc2cc(cs2)Cl 207a_100000210422_100000102487 [0,2,0,0,0,0|2,0,0]=4 14065 B16R2.11414 Fc1ccccc1NCc2cc(cs2)I 207a_100000210422_100010179861 [0,2,0,0,0,0|2,0,0]=4 14066 B16R2.11414 Fc1ccccc1NCc2ccc(o2)Br 207a_100000210422_100000185145 [0,2,0,0,0,0|2,0,0]=4 14067 B16R2.11414 Fc1ccccc1NCc2ccc(o2)Cl 207a_100000210422_100000188459 [0,2,0,0,0,0|2,0,0]=4 14068 B16R2.11414 Fc1ccccc1NCc2ccc(o2)I 207a_100000210422_100000186757 [0,2,0,0,0,0|2,0,0]=4 14069 B16R2.11414 Fc1ccccc1NCc2ccc(s2)Br 207a_100000210422_100000179771 [0,2,0,0,0,0|2,0,0]=4 14070 B16R2.11414 Fc1ccccc1NCc2ccc(s2)Br 34a_100000210422_100000708592 [0,2,0,0,0,0|2,0,0]=4 14071 B16R2.11414 Fc1ccccc1NCc2ccc(s2)Cl 207a_100000210422_100000242774 [0,2,0,0,0,0|2,0,0]=4 14072 B16R2.11414 Fc1ccccc1NCc2ccc(s2)Cl 34a_100000210422_100000185097 [0,2,0,0,0,0|2,0,0]=4 14073 B16R2.11414 Fc1ccccc1NCc2cnc(s2)Br 34a_100000210422_100000717027 [0,2,0,0,0,0|1,0,1]=4 14074 B16R2.11414 Fc1ccccc1NCc2cnc(s2)Cl 34a_100000210422_100000058068 [0,2,0,0,0,0|1,0,1]=4 14075 B16R2.11414 Fc1ccccc1NCc2csc(c2)Br 207a_100000210422_100000737087 [0,2,0,0,0,0|2,0,0]=4 14076 B16R2.11414 Fc1ccccc1NCc2csc(c2)Cl 207a_100000210422_100009844934 [0,2,0,0,0,0|2,0,0]=4 14077 B16R2.11414 Fc1ccccc1NCc2csc(n2)Cl 34a_100000210422_100000024076 [0,2,0,0,0,0|1,0,0]=3 14078 B16R2.11414 Fc1ccccc1NCc2nsc(n2)Cl 34a_100000210422_100000043760 [0,2,0,0,0,0|2,0,0]=4 14079 B16R2.11414 Fc1ccccc1OCc2csc(n2)Cl 34a_100000210171_100000024076 [0,2,0,0,0,0|2,0,0]=4 14080 B16R2.11414 Fc1ccccc1OCc2csc(n2)Cl 7a_100000210171_100000024076 [0,2,0,0,0,0|2,0,0]=4 14081 B16R2.11414 Fc1ccccc1SCc2csc(n2)Cl 62a_100000024076_100011215700 [0,2,0,0,0,0|2,0,0]=4 14082 B16R2.11414 Fc1ccccc1SCc2csc(n2)Cl 62a_100011215700_100000024076 [0,2,0,0,0,0|2,0,0]=4 14083 B16R2.11414 Ic1ccc(o1)CNc2ccccc2I 207a_100000210053_100000186757 [0,2,0,0,0,0|2,0,0]=4 14084 B16R2.11414 Ic1csc(c1)CNc2ccccc2I 207a_100000210053_100010179861 [0,2,0,0,0,0|2,0,0]=4 14085 B16R2.11414 Nc1ccccc1OCc2csc(n2)Cl 34a_100000185747_100000024076 [0,2,0,0,0,0|2,0,0]=4 14086 B16R2.11414 Nc1ccccc1OCc2csc(n2)Cl 7a_100000185747_100000024076 [0,2,0,0,0,0|2,0,0]=4 14087 B16R2.11414 Nc1ccccc1SCc2csc(n2)Cl 62a_100000024076_100000210017 [0,2,0,0,0,0|2,0,0]=4 14088 B16R2.11414 Nc1ccccc1SCc2csc(n2)Cl 62a_100000210017_100000024076 [0,2,0,0,0,0|2,0,0]=4 14089 B16R2.11414 Oc1ccccc1NCc2cc(cs2)Br 34a_100000185747_100000746031 [0,2,0,0,0,0|2,0,0]=4 14090 B16R2.11414 Oc1ccccc1NCc2ccc(s2)Br 34a_100000185747_100000708592 [0,2,0,0,0,0|2,0,0]=4 14091 B16R2.11414 Oc1ccccc1NCc2ccc(s2)Cl 34a_100000185747_100000185097 [0,2,0,0,0,0|2,0,0]=4 14092 B16R2.11414 Oc1ccccc1NCc2cnc(s2)Br 34a_100000185747_100000717027 [0,2,0,0,0,0|1,0,1]=4 14093 B16R2.11414 Oc1ccccc1NCc2cnc(s2)Cl 34a_100000185747_100000058068 [0,2,0,0,0,0|1,0,1]=4 14094 B16R2.11414 Oc1ccccc1NCc2csc(n2)Cl 34a_100000185747_100000024076 [0,2,0,0,0,0|1,0,0]=3 14095 B16R2.11414 Oc1ccccc1NCc2nsc(n2)Cl 34a_100000185747_100000043760 [0,2,0,0,0,0|2,0,0]=4 14096 B16R2.11414 Oc1ccccc1SCc2csc(n2)Cl 62a_100000024076_100000739446 [0,2,0,0,0,0|2,0,0]=4 14097 B16R2.11414 Oc1ccccc1SCc2csc(n2)Cl 62a_100000739446_100000024076 [0,2,0,0,0,0|2,0,0]=4 14098 B16R2.11414 [13CH3]n1cc(nn1)COc2ccccc2Br 274090a_200025704644_100000173974 [0,2,0,0,0,0|2,0,0]=4 14099 B16R2.11414 [13CH3]n1cc(nn1)COc2ccccc2Cl 274090a_200025704644_100000172630 [0,2,0,0,0,0|2,0,0]=4 14100 B16R2.11414 [13CH3]n1cc(nn1)COc2ccccc2F 274090a_200025704644_100000173115 [0,2,0,0,0,0|2,0,0]=4 14101 B16R2.11414 [13CH3]n1cc(nn1)COc2ccccc2N 274090a_200025704644_100000707309 [0,2,0,0,0,0|2,0,0]=4 14102 B16R2.1480 BrCc1ncccc1OCc2c[nH]cn2 34a_200020655725_100000707719 [0,2,0,0,0,0|2,0,0]=4 14103 B16R2.1480 C#Cc1ccccc1NCc2c[nH]cn2 34a_100011470550_100000707719 [0,2,0,0,0,0|0,0,0]=2 14104 B16R2.1480 C#Cc1ccccc1NCc2ccon2 34a_100011470550_100000234950 [0,2,0,0,0,0|2,0,0]=4 14105 B16R2.1480 C#Cc1ccccc1NCc2ccsc2 34a_100011470550_100011261437 [0,2,0,0,0,0|2,0,0]=4 14106 B16R2.1480 C#Cc1ccccc1NCc2cncs2 34a_100011470550_100015185245 [0,2,0,0,0,0|1,0,1]=4 14107 B16R2.1480 C#Cc1ccccc1NCc2cscn2 34a_100011470550_100000205941 [0,2,0,0,0,0|1,0,0]=3 14108 B16R2.1480 C#Cc1ccccc1NCc2ncc[nH]2 34a_100011470550_100016991755 [0,2,0,0,0,0|2,0,0]=4 14109 B16R2.1480 C#Cc1ccccc1NCc2ncco2 34a_100011470550_103436540062 [0,2,0,0,0,0|2,0,0]=4 14110 B16R2.1480 C#Cc1ccccc1NCc2nccs2 34a_100011470550_100015184050 [0,2,0,0,0,0|2,0,0]=4 14111 B16R2.1480 C#Cc1ccccc1NCc2ncon2 34a_100011470550_100000233494 [0,2,0,0,0,0|2,0,0]=4 14112 B16R2.1480 C#Cc1ccccc1NCn2cncn2 34a_100011470550_200020645497 [0,2,0,0,0,0|1,0,1]=4 14113 B16R2.1480 C#Cc1ccccc1OCc2c[nH]cn2 34a_200011470546_100000707719 [0,2,0,0,0,0|1,0,0]=3 14114 B16R2.1480 C#Cc1ccccc1OCc2cscn2 34a_200011470546_100000205941 [0,2,0,0,0,0|2,0,0]=4 14115 B16R2.1480 C#Cc1ccccc1OCc2cscn2 7a_200011470546_100000205941 [0,2,0,0,0,0|2,0,0]=4 14116 B16R2.1480 C=Cc1ccccc1NCc2c[nH]cn2 34a_100012022501_100000707719 [0,2,0,0,0,0|0,0,0]=2 14117 B16R2.1480 C=Cc1ccccc1NCc2cc[nH]n2 207a_100012022501_100000738523 [0,2,0,0,0,0|2,0,0]=4 14118 B16R2.1480 C=Cc1ccccc1NCc2ccco2 207a_100012022501_100000186105 [0,2,0,0,0,0|2,0,0]=4 14119 B16R2.1480 C=Cc1ccccc1NCc2cccs2 207a_100012022501_100000209959 [0,2,0,0,0,0|2,0,0]=4 14120 B16R2.1480 C=Cc1ccccc1NCc2ccoc2 207a_100012022501_100011215517 [0,2,0,0,0,0|2,0,0]=4 14121 B16R2.1480 C=Cc1ccccc1NCc2ccon2 34a_100012022501_100000234950 [0,2,0,0,0,0|2,0,0]=4 14122 B16R2.1480 C=Cc1ccccc1NCc2ccsc2 207a_100012022501_100000188534 [0,2,0,0,0,0|2,0,0]=4 14123 B16R2.1480 C=Cc1ccccc1NCc2ccsc2 34a_100012022501_100011261437 [0,2,0,0,0,0|2,0,0]=4 14124 B16R2.1480 C=Cc1ccccc1NCc2cn[nH]c2 207a_100012022501_100016992096 [0,2,0,0,0,0|2,0,0]=4 14125 B16R2.1480 C=Cc1ccccc1NCc2cnc[nH]2 207a_100012022501_100000742939 [0,2,0,0,0,0|0,0,2]=4 14126 B16R2.1480 C=Cc1ccccc1NCc2cncs2 207a_100012022501_100000749870 [0,2,0,0,0,0|1,0,1]=4 14127 B16R2.1480 C=Cc1ccccc1NCc2cncs2 34a_100012022501_100015185245 [0,2,0,0,0,0|1,0,1]=4 14128 B16R2.1480 C=Cc1ccccc1NCc2cscn2 207a_100012022501_100000743575 [0,2,0,0,0,0|1,0,0]=3 14129 B16R2.1480 C=Cc1ccccc1NCc2cscn2 34a_100012022501_100000205941 [0,2,0,0,0,0|1,0,0]=3 14130 B16R2.1480 C=Cc1ccccc1NCc2ncc[nH]2 207a_100012022501_100000743867 [0,2,0,0,0,0|2,0,0]=4 14131 B16R2.1480 C=Cc1ccccc1NCc2ncc[nH]2 34a_100012022501_100016991755 [0,2,0,0,0,0|2,0,0]=4 14132 B16R2.1480 C=Cc1ccccc1NCc2ncco2 34a_100012022501_103436540062 [0,2,0,0,0,0|2,0,0]=4 14133 B16R2.1480 C=Cc1ccccc1NCc2nccs2 207a_100012022501_100000750902 [0,2,0,0,0,0|2,0,0]=4 14134 B16R2.1480 C=Cc1ccccc1NCc2nccs2 34a_100012022501_100015184050 [0,2,0,0,0,0|2,0,0]=4 14135 B16R2.1480 C=Cc1ccccc1NCc2ncon2 34a_100012022501_100000233494 [0,2,0,0,0,0|2,0,0]=4 14136 B16R2.1480 C=Cc1ccccc1NCn2cncn2 34a_100012022501_200020645497 [0,2,0,0,0,0|1,0,1]=4 14137 B16R2.1480 C=Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011218376 [0,2,0,0,0,0|1,0,0]=3 14138 B16R2.1480 C=Cc1ccccc1SCc2c[nH]cn2 62a_100011218376_100000707719 [0,2,0,0,0,0|1,0,0]=3 14139 B16R2.1480 C=Cc1ccccc1SCc2cscn2 62a_100000205941_100011218376 [0,2,0,0,0,0|2,0,0]=4 14140 B16R2.1480 C=Cc1ccccc1SCc2cscn2 62a_100011218376_100000205941 [0,2,0,0,0,0|2,0,0]=4 14141 B16R2.1480 CCc1ccccc1NCc2c[nH]cn2 2230a_100000212081_100000707719 [0,2,0,0,0,0|0,0,0]=2 14142 B16R2.1480 CCc1ccccc1NCc2c[nH]cn2 34a_100000212081_100000707719 [0,2,0,0,0,0|0,0,0]=2 14143 B16R2.1480 CCc1ccccc1NCc2cc[nH]n2 207a_100000212081_100000738523 [0,2,0,0,0,0|2,0,0]=4 14144 B16R2.1480 CCc1ccccc1NCc2ccco2 207a_100000212081_100000186105 [0,2,0,0,0,0|2,0,0]=4 14145 B16R2.1480 CCc1ccccc1NCc2ccco2 270302a_100000212081_100000186105 [0,2,0,0,0,0|2,0,0]=4 14146 B16R2.1480 CCc1ccccc1NCc2cccs2 207a_100000212081_100000209959 [0,2,0,0,0,0|2,0,0]=4 14147 B16R2.1480 CCc1ccccc1NCc2cccs2 270302a_100000212081_100000209959 [0,2,0,0,0,0|2,0,0]=4 14148 B16R2.1480 CCc1ccccc1NCc2ccoc2 207a_100000212081_100011215517 [0,2,0,0,0,0|2,0,0]=4 14149 B16R2.1480 CCc1ccccc1NCc2ccon2 2230a_100000212081_100000234950 [0,2,0,0,0,0|2,0,0]=4 14150 B16R2.1480 CCc1ccccc1NCc2ccon2 34a_100000212081_100000234950 [0,2,0,0,0,0|2,0,0]=4 14151 B16R2.1480 CCc1ccccc1NCc2ccon2 7a_100000212081_100000234950 [0,2,0,0,0,0|2,0,0]=4 14152 B16R2.1480 CCc1ccccc1NCc2ccsc2 207a_100000212081_100000188534 [0,2,0,0,0,0|2,0,0]=4 14153 B16R2.1480 CCc1ccccc1NCc2ccsc2 2230a_100000212081_100011261437 [0,2,0,0,0,0|2,0,0]=4 14154 B16R2.1480 CCc1ccccc1NCc2ccsc2 270302a_100000212081_100000188534 [0,2,0,0,0,0|2,0,0]=4 14155 B16R2.1480 CCc1ccccc1NCc2ccsc2 34a_100000212081_100011261437 [0,2,0,0,0,0|2,0,0]=4 14156 B16R2.1480 CCc1ccccc1NCc2ccsc2 7a_100000212081_100011261437 [0,2,0,0,0,0|2,0,0]=4 14157 B16R2.1480 CCc1ccccc1NCc2cn[nH]c2 207a_100000212081_100016992096 [0,2,0,0,0,0|2,0,0]=4 14158 B16R2.1480 CCc1ccccc1NCc2cn[nH]c2 270302a_100000212081_100016992096 [0,2,0,0,0,0|2,0,0]=4 14159 B16R2.1480 CCc1ccccc1NCc2cnc[nH]2 207a_100000212081_100000742939 [0,2,0,0,0,0|0,0,2]=4 14160 B16R2.1480 CCc1ccccc1NCc2cncs2 207a_100000212081_100000749870 [0,2,0,0,0,0|1,0,1]=4 14161 B16R2.1480 CCc1ccccc1NCc2cncs2 2230a_100000212081_100015185245 [0,2,0,0,0,0|1,0,1]=4 14162 B16R2.1480 CCc1ccccc1NCc2cncs2 270302a_100000212081_100000749870 [0,2,0,0,0,0|1,0,1]=4 14163 B16R2.1480 CCc1ccccc1NCc2cncs2 34a_100000212081_100015185245 [0,2,0,0,0,0|1,0,1]=4 14164 B16R2.1480 CCc1ccccc1NCc2cncs2 7a_100000212081_100015185245 [0,2,0,0,0,0|1,0,1]=4 14165 B16R2.1480 CCc1ccccc1NCc2cscn2 207a_100000212081_100000743575 [0,2,0,0,0,0|1,0,0]=3 14166 B16R2.1480 CCc1ccccc1NCc2cscn2 2230a_100000212081_100000205941 [0,2,0,0,0,0|1,0,0]=3 14167 B16R2.1480 CCc1ccccc1NCc2cscn2 270302a_100000212081_100000743575 [0,2,0,0,0,0|1,0,0]=3 14168 B16R2.1480 CCc1ccccc1NCc2cscn2 34a_100000212081_100000205941 [0,2,0,0,0,0|1,0,0]=3 14169 B16R2.1480 CCc1ccccc1NCc2cscn2 7a_100000212081_100000205941 [0,2,0,0,0,0|1,0,0]=3 14170 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 207a_100000212081_100000743867 [0,2,0,0,0,0|2,0,0]=4 14171 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 2230a_100000212081_100016991755 [0,2,0,0,0,0|2,0,0]=4 14172 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 34a_100000212081_100016991755 [0,2,0,0,0,0|2,0,0]=4 14173 B16R2.1480 CCc1ccccc1NCc2ncc[nH]2 7a_100000212081_100000753453 [0,2,0,0,0,0|2,0,0]=4 14174 B16R2.1480 CCc1ccccc1NCc2ncco2 2230a_100000212081_103436540062 [0,2,0,0,0,0|2,0,0]=4 14175 B16R2.1480 CCc1ccccc1NCc2ncco2 34a_100000212081_103436540062 [0,2,0,0,0,0|2,0,0]=4 14176 B16R2.1480 CCc1ccccc1NCc2ncco2 7a_100000212081_103436540062 [0,2,0,0,0,0|2,0,0]=4 14177 B16R2.1480 CCc1ccccc1NCc2nccs2 207a_100000212081_100000750902 [0,2,0,0,0,0|2,0,0]=4 14178 B16R2.1480 CCc1ccccc1NCc2nccs2 2230a_100000212081_100015184050 [0,2,0,0,0,0|2,0,0]=4 14179 B16R2.1480 CCc1ccccc1NCc2nccs2 270302a_100000212081_100000750902 [0,2,0,0,0,0|2,0,0]=4 14180 B16R2.1480 CCc1ccccc1NCc2nccs2 34a_100000212081_100015184050 [0,2,0,0,0,0|2,0,0]=4 14181 B16R2.1480 CCc1ccccc1NCc2nccs2 7a_100000212081_100015184050 [0,2,0,0,0,0|2,0,0]=4 14182 B16R2.1480 CCc1ccccc1NCc2ncon2 34a_100000212081_100000233494 [0,2,0,0,0,0|2,0,0]=4 14183 B16R2.1480 CCc1ccccc1NCn2cncn2 2230a_100000212081_200020645497 [0,2,0,0,0,0|1,0,1]=4 14184 B16R2.1480 CCc1ccccc1NCn2cncn2 34a_100000212081_200020645497 [0,2,0,0,0,0|1,0,1]=4 14185 B16R2.1480 CCc1ccccc1NCn2cncn2 7a_100000212081_200020645497 [0,2,0,0,0,0|1,0,1]=4 14186 B16R2.1480 CCc1ccccc1OCc2c[nH]cn2 34a_100000210936_100000707719 [0,2,0,0,0,0|1,0,0]=3 14187 B16R2.1480 CCc1ccccc1OCc2cscn2 34a_100000210936_100000205941 [0,2,0,0,0,0|2,0,0]=4 14188 B16R2.1480 CCc1ccccc1OCc2cscn2 7a_100000210936_100000205941 [0,2,0,0,0,0|2,0,0]=4 14189 B16R2.1480 CCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011215823 [0,2,0,0,0,0|1,0,0]=3 14190 B16R2.1480 CCc1ccccc1SCc2c[nH]cn2 62a_100011215823_100000707719 [0,2,0,0,0,0|1,0,0]=3 14191 B16R2.1480 CCc1ccccc1SCc2cscn2 62a_100000205941_100011215823 [0,2,0,0,0,0|2,0,0]=4 14192 B16R2.1480 CCc1ccccc1SCc2cscn2 62a_100011215823_100000205941 [0,2,0,0,0,0|2,0,0]=4 14193 B16R2.1480 CCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009819861 [0,2,0,0,0,0|2,0,0]=4 14194 B16R2.1480 CCc1ccncc1SCc2c[nH]cn2 62a_100009819861_100000707719 [0,2,0,0,0,0|2,0,0]=4 14195 B16R2.1480 CCc1cnccc1SCc2c[nH]cn2 62a_100000707719_100025704421 [0,2,0,0,0,0|2,0,0]=4 14196 B16R2.1480 CCc1cnccc1SCc2c[nH]cn2 62a_100025704421_100000707719 [0,2,0,0,0,0|2,0,0]=4 14197 B16R2.1480 CCc1cncnc1NCc2c[nH]cn2 27a_100000758547_200000100055 [0,2,0,0,0,0|2,0,0]=4 14198 B16R2.1480 CCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100009877225 [0,2,0,0,0,0|2,0,0]=4 14199 B16R2.1480 CCc1ncccc1SCc2c[nH]cn2 62a_100009877225_100000707719 [0,2,0,0,0,0|2,0,0]=4 14200 B16R2.1480 CCc1nccnc1NCc2c[nH]cn2 27a_100000758547_100011995844 [0,2,0,0,0,0|2,0,0]=4 14201 B16R2.1480 CCc1ncncc1NCc2c[nH]cn2 27a_100000758547_100009816992 [0,2,0,0,0,0|2,0,0]=4 14202 B16R2.1480 CNc1ccccc1OCc2c[nH]cn2 34a_100000033821_100000707719 [0,2,0,0,0,0|1,0,0]=3 14203 B16R2.1480 CNc1ccccc1OCc2cscn2 34a_100000033821_100000205941 [0,2,0,0,0,0|2,0,0]=4 14204 B16R2.1480 CNc1ccccc1SCc2c[nH]cn2 62a_100000707719_100020606079 [0,2,0,0,0,0|1,0,0]=3 14205 B16R2.1480 CNc1ccccc1SCc2c[nH]cn2 62a_100020606079_100000707719 [0,2,0,0,0,0|1,0,0]=3 14206 B16R2.1480 CNc1ccccc1SCc2cscn2 62a_100000205941_100020606079 [0,2,0,0,0,0|2,0,0]=4 14207 B16R2.1480 CNc1ccccc1SCc2cscn2 62a_100020606079_100000205941 [0,2,0,0,0,0|2,0,0]=4 14208 B16R2.1480 CNc1cccnc1SCc2c[nH]cn2 62a_100000707719_200011806188 [0,2,0,0,0,0|2,0,0]=4 14209 B16R2.1480 CNc1ccncc1SCc2c[nH]cn2 62a_100000707719_100010069531 [0,2,0,0,0,0|2,0,0]=4 14210 B16R2.1480 CNc1ccncc1SCc2c[nH]cn2 62a_100010069531_100000707719 [0,2,0,0,0,0|2,0,0]=4 14211 B16R2.1480 CNc1ncccc1SCc2c[nH]cn2 62a_100000700899_100000707719 [0,2,0,0,0,0|2,0,0]=4 14212 B16R2.1480 CNc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000700899 [0,2,0,0,0,0|2,0,0]=4 14213 B16R2.1480 COc1ccccc1CSc2c[nH]cn2 62a_100000210004_100000756875 [0,2,0,0,0,0|2,0,0]=4 14214 B16R2.1480 COc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000210004 [0,2,0,0,0,0|2,0,0]=4 14215 B16R2.1480 COc1ccccc1NCc2c[nH]cn2 34a_100000210025_100000707719 [0,2,0,0,0,0|0,0,0]=2 14216 B16R2.1480 COc1ccccc1NCc2cc[nH]n2 207a_100000210025_100000738523 [0,2,0,0,0,0|2,0,0]=4 14217 B16R2.1480 COc1ccccc1NCc2ccco2 207a_100000210025_100000186105 [0,2,0,0,0,0|2,0,0]=4 14218 B16R2.1480 COc1ccccc1NCc2ccco2 270302a_100000210025_100000186105 [0,2,0,0,0,0|2,0,0]=4 14219 B16R2.1480 COc1ccccc1NCc2cccs2 207a_100000210025_100000209959 [0,2,0,0,0,0|2,0,0]=4 14220 B16R2.1480 COc1ccccc1NCc2cccs2 270302a_100000210025_100000209959 [0,2,0,0,0,0|2,0,0]=4 14221 B16R2.1480 COc1ccccc1NCc2ccoc2 207a_100000210025_100011215517 [0,2,0,0,0,0|2,0,0]=4 14222 B16R2.1480 COc1ccccc1NCc2ccon2 34a_100000210025_100000234950 [0,2,0,0,0,0|2,0,0]=4 14223 B16R2.1480 COc1ccccc1NCc2ccsc2 207a_100000210025_100000188534 [0,2,0,0,0,0|2,0,0]=4 14224 B16R2.1480 COc1ccccc1NCc2ccsc2 270302a_100000210025_100000188534 [0,2,0,0,0,0|2,0,0]=4 14225 B16R2.1480 COc1ccccc1NCc2ccsc2 34a_100000210025_100011261437 [0,2,0,0,0,0|2,0,0]=4 14226 B16R2.1480 COc1ccccc1NCc2cn[nH]c2 207a_100000210025_100016992096 [0,2,0,0,0,0|2,0,0]=4 14227 B16R2.1480 COc1ccccc1NCc2cn[nH]c2 270302a_100000210025_100016992096 [0,2,0,0,0,0|2,0,0]=4 14228 B16R2.1480 COc1ccccc1NCc2cnc[nH]2 207a_100000210025_100000742939 [0,2,0,0,0,0|0,0,2]=4 14229 B16R2.1480 COc1ccccc1NCc2cncs2 207a_100000210025_100000749870 [0,2,0,0,0,0|1,0,1]=4 14230 B16R2.1480 COc1ccccc1NCc2cncs2 270302a_100000210025_100000749870 [0,2,0,0,0,0|1,0,1]=4 14231 B16R2.1480 COc1ccccc1NCc2cncs2 34a_100000210025_100015185245 [0,2,0,0,0,0|1,0,1]=4 14232 B16R2.1480 COc1ccccc1NCc2cscn2 207a_100000210025_100000743575 [0,2,0,0,0,0|1,0,0]=3 14233 B16R2.1480 COc1ccccc1NCc2cscn2 270302a_100000210025_100000743575 [0,2,0,0,0,0|1,0,0]=3 14234 B16R2.1480 COc1ccccc1NCc2cscn2 34a_100000210025_100000205941 [0,2,0,0,0,0|1,0,0]=3 14235 B16R2.1480 COc1ccccc1NCc2ncc[nH]2 207a_100000210025_100000743867 [0,2,0,0,0,0|2,0,0]=4 14236 B16R2.1480 COc1ccccc1NCc2ncc[nH]2 34a_100000210025_100016991755 [0,2,0,0,0,0|2,0,0]=4 14237 B16R2.1480 COc1ccccc1NCc2ncco2 34a_100000210025_103436540062 [0,2,0,0,0,0|2,0,0]=4 14238 B16R2.1480 COc1ccccc1NCc2nccs2 207a_100000210025_100000750902 [0,2,0,0,0,0|2,0,0]=4 14239 B16R2.1480 COc1ccccc1NCc2nccs2 270302a_100000210025_100000750902 [0,2,0,0,0,0|2,0,0]=4 14240 B16R2.1480 COc1ccccc1NCc2nccs2 34a_100000210025_100015184050 [0,2,0,0,0,0|2,0,0]=4 14241 B16R2.1480 COc1ccccc1NCc2ncon2 34a_100000210025_100000233494 [0,2,0,0,0,0|2,0,0]=4 14242 B16R2.1480 COc1ccccc1NCn2cncn2 34a_100000210025_200020645497 [0,2,0,0,0,0|1,0,1]=4 14243 B16R2.1480 COc1ccccc1OCc2c[nH]cn2 34a_100000210385_100000707719 [0,2,0,0,0,0|1,0,0]=3 14244 B16R2.1480 COc1ccccc1OCc2cscn2 34a_100000210385_100000205941 [0,2,0,0,0,0|2,0,0]=4 14245 B16R2.1480 COc1ccccc1SCc2c[nH]cn2 62a_100000210334_100000707719 [0,2,0,0,0,0|1,0,0]=3 14246 B16R2.1480 COc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210334 [0,2,0,0,0,0|1,0,0]=3 14247 B16R2.1480 COc1ccccc1SCc2cscn2 62a_100000205941_100000210334 [0,2,0,0,0,0|2,0,0]=4 14248 B16R2.1480 COc1ccccc1SCc2cscn2 62a_100000210334_100000205941 [0,2,0,0,0,0|2,0,0]=4 14249 B16R2.1480 COc1cccnc1OCc2c[nH]cn2 34a_100025773188_100000707719 [0,2,0,0,0,0|2,0,0]=4 14250 B16R2.1480 COc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000690851 [0,2,0,0,0,0|2,0,0]=4 14251 B16R2.1480 COc1cccnc1SCc2c[nH]cn2 62a_100000767102_100000707719 [0,2,0,0,0,0|2,0,0]=4 14252 B16R2.1480 COc1ccncc1OCc2c[nH]cn2 34a_100000101186_100000707719 [0,2,0,0,0,0|2,0,0]=4 14253 B16R2.1480 COc1ccncc1SCc2c[nH]cn2 62a_100000707719_100011997281 [0,2,0,0,0,0|2,0,0]=4 14254 B16R2.1480 COc1ccncc1SCc2c[nH]cn2 62a_100011997281_100000707719 [0,2,0,0,0,0|2,0,0]=4 14255 B16R2.1480 COc1cnccc1SCc2c[nH]cn2 62a_100000707719_100016988167 [0,2,0,0,0,0|2,0,0]=4 14256 B16R2.1480 COc1cnccc1SCc2c[nH]cn2 62a_100016988167_100000707719 [0,2,0,0,0,0|2,0,0]=4 14257 B16R2.1480 COc1cncnc1NCc2c[nH]cn2 27a_100000758547_100012001275 [0,2,0,0,0,0|2,0,0]=4 14258 B16R2.1480 COc1ncccc1OCc2c[nH]cn2 34a_100000698397_100000707719 [0,2,0,0,0,0|2,0,0]=4 14259 B16R2.1480 COc1ncccc1SCc2c[nH]cn2 62a_100000047025_100000707719 [0,2,0,0,0,0|2,0,0]=4 14260 B16R2.1480 COc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000047025 [0,2,0,0,0,0|2,0,0]=4 14261 B16R2.1480 COc1nccnc1NCc2c[nH]cn2 27a_100000758547_100009858322 [0,2,0,0,0,0|2,0,0]=4 14262 B16R2.1480 CSc1ccccc1CSc2c[nH]cn2 62a_100000699184_100000756875 [0,2,0,0,0,0|2,0,0]=4 14263 B16R2.1480 CSc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000699184 [0,2,0,0,0,0|2,0,0]=4 14264 B16R2.1480 CSc1ccccc1NCc2c[nH]cn2 34a_100000211160_100000707719 [0,2,0,0,0,0|0,0,0]=2 14265 B16R2.1480 CSc1ccccc1NCc2cc[nH]n2 207a_100000211160_100000738523 [0,2,0,0,0,0|2,0,0]=4 14266 B16R2.1480 CSc1ccccc1NCc2ccco2 207a_100000211160_100000186105 [0,2,0,0,0,0|2,0,0]=4 14267 B16R2.1480 CSc1ccccc1NCc2ccco2 270302a_100000211160_100000186105 [0,2,0,0,0,0|2,0,0]=4 14268 B16R2.1480 CSc1ccccc1NCc2cccs2 207a_100000211160_100000209959 [0,2,0,0,0,0|2,0,0]=4 14269 B16R2.1480 CSc1ccccc1NCc2cccs2 270302a_100000211160_100000209959 [0,2,0,0,0,0|2,0,0]=4 14270 B16R2.1480 CSc1ccccc1NCc2ccoc2 207a_100000211160_100011215517 [0,2,0,0,0,0|2,0,0]=4 14271 B16R2.1480 CSc1ccccc1NCc2ccon2 34a_100000211160_100000234950 [0,2,0,0,0,0|2,0,0]=4 14272 B16R2.1480 CSc1ccccc1NCc2ccsc2 207a_100000211160_100000188534 [0,2,0,0,0,0|2,0,0]=4 14273 B16R2.1480 CSc1ccccc1NCc2ccsc2 270302a_100000211160_100000188534 [0,2,0,0,0,0|2,0,0]=4 14274 B16R2.1480 CSc1ccccc1NCc2ccsc2 34a_100000211160_100011261437 [0,2,0,0,0,0|2,0,0]=4 14275 B16R2.1480 CSc1ccccc1NCc2cn[nH]c2 207a_100000211160_100016992096 [0,2,0,0,0,0|2,0,0]=4 14276 B16R2.1480 CSc1ccccc1NCc2cn[nH]c2 270302a_100000211160_100016992096 [0,2,0,0,0,0|2,0,0]=4 14277 B16R2.1480 CSc1ccccc1NCc2cnc[nH]2 207a_100000211160_100000742939 [0,2,0,0,0,0|0,0,2]=4 14278 B16R2.1480 CSc1ccccc1NCc2cncs2 207a_100000211160_100000749870 [0,2,0,0,0,0|1,0,1]=4 14279 B16R2.1480 CSc1ccccc1NCc2cncs2 270302a_100000211160_100000749870 [0,2,0,0,0,0|1,0,1]=4 14280 B16R2.1480 CSc1ccccc1NCc2cncs2 34a_100000211160_100015185245 [0,2,0,0,0,0|1,0,1]=4 14281 B16R2.1480 CSc1ccccc1NCc2cscn2 207a_100000211160_100000743575 [0,2,0,0,0,0|1,0,0]=3 14282 B16R2.1480 CSc1ccccc1NCc2cscn2 270302a_100000211160_100000743575 [0,2,0,0,0,0|1,0,0]=3 14283 B16R2.1480 CSc1ccccc1NCc2cscn2 34a_100000211160_100000205941 [0,2,0,0,0,0|1,0,0]=3 14284 B16R2.1480 CSc1ccccc1NCc2ncc[nH]2 207a_100000211160_100000743867 [0,2,0,0,0,0|2,0,0]=4 14285 B16R2.1480 CSc1ccccc1NCc2ncc[nH]2 34a_100000211160_100016991755 [0,2,0,0,0,0|2,0,0]=4 14286 B16R2.1480 CSc1ccccc1NCc2ncco2 34a_100000211160_103436540062 [0,2,0,0,0,0|2,0,0]=4 14287 B16R2.1480 CSc1ccccc1NCc2nccs2 207a_100000211160_100000750902 [0,2,0,0,0,0|2,0,0]=4 14288 B16R2.1480 CSc1ccccc1NCc2nccs2 270302a_100000211160_100000750902 [0,2,0,0,0,0|2,0,0]=4 14289 B16R2.1480 CSc1ccccc1NCc2nccs2 34a_100000211160_100015184050 [0,2,0,0,0,0|2,0,0]=4 14290 B16R2.1480 CSc1ccccc1NCc2ncon2 34a_100000211160_100000233494 [0,2,0,0,0,0|2,0,0]=4 14291 B16R2.1480 CSc1ccccc1NCn2cncn2 34a_100000211160_200020645497 [0,2,0,0,0,0|1,0,1]=4 14292 B16R2.1480 CSc1ccccc1OCc2c[nH]cn2 34a_100011216402_100000707719 [0,2,0,0,0,0|1,0,0]=3 14293 B16R2.1480 CSc1ccccc1OCc2cscn2 34a_100011216402_100000205941 [0,2,0,0,0,0|2,0,0]=4 14294 B16R2.1480 CSc1ccccc1SCc2c[nH]cn2 62a_100000707719_100011217816 [0,2,0,0,0,0|1,0,0]=3 14295 B16R2.1480 CSc1ccccc1SCc2c[nH]cn2 62a_100011217816_100000707719 [0,2,0,0,0,0|1,0,0]=3 14296 B16R2.1480 CSc1ccccc1SCc2cscn2 62a_100000205941_100011217816 [0,2,0,0,0,0|2,0,0]=4 14297 B16R2.1480 CSc1ccccc1SCc2cscn2 62a_100011217816_100000205941 [0,2,0,0,0,0|2,0,0]=4 14298 B16R2.1480 CSc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011465278 [0,2,0,0,0,0|2,0,0]=4 14299 B16R2.1480 CSc1ncccc1SCc2c[nH]cn2 62a_100011465278_100000707719 [0,2,0,0,0,0|2,0,0]=4 14300 B16R2.1480 N#Cc1ccccc1CSc2c[nH]cn2 62a_100000186380_100000756875 [0,2,0,0,0,0|2,0,0]=4 14301 B16R2.1480 N#Cc1ccccc1CSc2c[nH]cn2 62a_100000756875_100000181865 [0,2,0,0,0,0|2,0,0]=4 14302 B16R2.1480 N#Cc1ccccc1NCc2c[nH]cn2 34a_100000211148_100000707719 [0,2,0,0,0,0|0,0,0]=2 14303 B16R2.1480 N#Cc1ccccc1NCc2ccco2 270302a_100000211148_100000186105 [0,2,0,0,0,0|2,0,0]=4 14304 B16R2.1480 N#Cc1ccccc1NCc2cccs2 270302a_100000211148_100000209959 [0,2,0,0,0,0|2,0,0]=4 14305 B16R2.1480 N#Cc1ccccc1NCc2ccon2 34a_100000211148_100000234950 [0,2,0,0,0,0|2,0,0]=4 14306 B16R2.1480 N#Cc1ccccc1NCc2ccsc2 270302a_100000211148_100000188534 [0,2,0,0,0,0|2,0,0]=4 14307 B16R2.1480 N#Cc1ccccc1NCc2ccsc2 34a_100000211148_100011261437 [0,2,0,0,0,0|2,0,0]=4 14308 B16R2.1480 N#Cc1ccccc1NCc2cn[nH]c2 270302a_100000211148_100016992096 [0,2,0,0,0,0|2,0,0]=4 14309 B16R2.1480 N#Cc1ccccc1NCc2cncs2 270302a_100000211148_100000749870 [0,2,0,0,0,0|1,0,1]=4 14310 B16R2.1480 N#Cc1ccccc1NCc2cncs2 34a_100000211148_100015185245 [0,2,0,0,0,0|1,0,1]=4 14311 B16R2.1480 N#Cc1ccccc1NCc2cscn2 270302a_100000211148_100000743575 [0,2,0,0,0,0|1,0,0]=3 14312 B16R2.1480 N#Cc1ccccc1NCc2cscn2 34a_100000211148_100000205941 [0,2,0,0,0,0|1,0,0]=3 14313 B16R2.1480 N#Cc1ccccc1NCc2ncc[nH]2 34a_100000211148_100016991755 [0,2,0,0,0,0|2,0,0]=4 14314 B16R2.1480 N#Cc1ccccc1NCc2ncco2 34a_100000211148_103436540062 [0,2,0,0,0,0|2,0,0]=4 14315 B16R2.1480 N#Cc1ccccc1NCc2nccs2 270302a_100000211148_100000750902 [0,2,0,0,0,0|2,0,0]=4 14316 B16R2.1480 N#Cc1ccccc1NCc2nccs2 34a_100000211148_100015184050 [0,2,0,0,0,0|2,0,0]=4 14317 B16R2.1480 N#Cc1ccccc1NCc2ncon2 34a_100000211148_100000233494 [0,2,0,0,0,0|2,0,0]=4 14318 B16R2.1480 N#Cc1ccccc1NCn2cncn2 34a_100000211148_200020645497 [0,2,0,0,0,0|1,0,1]=4 14319 B16R2.1480 N#Cc1ccccc1OCc2c[nH]cn2 34a_100000211048_100000707719 [0,2,0,0,0,0|1,0,0]=3 14320 B16R2.1480 N#Cc1ccccc1OCc2cscn2 34a_100000211048_100000205941 [0,2,0,0,0,0|2,0,0]=4 14321 B16R2.1480 N#Cc1ccccc1OCc2cscn2 7a_100000211048_100000205941 [0,2,0,0,0,0|2,0,0]=4 14322 B16R2.1480 N#Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000188569 [0,2,0,0,0,0|1,0,0]=3 14323 B16R2.1480 N#Cc1ccccc1SCc2cscn2 62a_100000205941_100000188569 [0,2,0,0,0,0|2,0,0]=4 14324 B16R2.1480 N#Cc1cccnc1NCc2c[nH]cn2 27a_100000758547_100000211984 [0,2,0,0,0,0|1,0,0]=3 14325 B16R2.1480 N#Cc1cccnc1NCc2c[nH]nn2 27a_100020620823_100000211984 [0,2,0,0,0,0|2,0,0]=4 14326 B16R2.1480 N#Cc1cccnc1NCc2cocn2 27a_100015188801_100000211984 [0,2,0,0,0,0|2,0,0]=4 14327 B16R2.1480 N#Cc1cccnc1NCc2cscn2 27a_100015185402_100000211984 [0,2,0,0,0,0|2,0,0]=4 14328 B16R2.1480 N#Cc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000211984 [0,2,0,0,0,0|2,0,0]=4 14329 B16R2.1480 N#Cc1ccncc1NCc2c[nH]cn2 27a_100000758547_100000684818 [0,2,0,0,0,0|1,0,0]=3 14330 B16R2.1480 N#Cc1ccncc1NCc2c[nH]nn2 27a_100020620823_100000684818 [0,2,0,0,0,0|2,0,0]=4 14331 B16R2.1480 N#Cc1ccncc1NCc2cocn2 27a_100015188801_100000684818 [0,2,0,0,0,0|2,0,0]=4 14332 B16R2.1480 N#Cc1ccncc1NCc2cscn2 27a_100015185402_100000684818 [0,2,0,0,0,0|2,0,0]=4 14333 B16R2.1480 N#Cc1ccncc1SCc2c[nH]cn2 62a_100000707719_100000684818 [0,2,0,0,0,0|2,0,0]=4 14334 B16R2.1480 N#Cc1ccnnc1NCc2c[nH]cn2 27a_100000758547_100000100742 [0,2,0,0,0,0|2,0,0]=4 14335 B16R2.1480 N#Cc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000687039 [0,2,0,0,0,0|1,0,0]=3 14336 B16R2.1480 N#Cc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000687039 [0,2,0,0,0,0|2,0,0]=4 14337 B16R2.1480 N#Cc1cnccc1NCc2cocn2 27a_100015188801_100000687039 [0,2,0,0,0,0|2,0,0]=4 14338 B16R2.1480 N#Cc1cnccc1NCc2cscn2 27a_100015185402_100000687039 [0,2,0,0,0,0|2,0,0]=4 14339 B16R2.1480 N#Cc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000687039 [0,2,0,0,0,0|2,0,0]=4 14340 B16R2.1480 N#Cc1cncnc1NCc2c[nH]cn2 27a_100000758547_100000687955 [0,2,0,0,0,0|2,0,0]=4 14341 B16R2.1480 N#Cc1ncccc1OCc2c[nH]cn2 34a_100000722750_100000707719 [0,2,0,0,0,0|2,0,0]=4 14342 B16R2.1480 N#Cc1ncccc1SCc2c[nH]cn2 62a_100000707719_100000685805 [0,2,0,0,0,0|2,0,0]=4 14343 B16R2.1480 N#Cc1nccnc1NCc2c[nH]cn2 27a_100000758547_100000040484 [0,2,0,0,0,0|2,0,0]=4 14344 B16R2.1480 N#Cc1ncncc1NCc2c[nH]cn2 27a_100000758547_100012001395 [0,2,0,0,0,0|2,0,0]=4 14345 B16R2.1480 NCc1ccccc1OCc2c[nH]cn2 34a_100000185550_100000707719 [0,2,0,0,0,0|1,0,0]=3 14346 B16R2.1480 NCc1ccccc1OCc2cscn2 34a_100000185550_100000205941 [0,2,0,0,0,0|2,0,0]=4 14347 B16R2.1480 NCc1ccccc1SCc2c[nH]cn2 62a_100000689332_100000707719 [0,2,0,0,0,0|1,0,0]=3 14348 B16R2.1480 NCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000689332 [0,2,0,0,0,0|1,0,0]=3 14349 B16R2.1480 NCc1ccccc1SCc2cscn2 62a_100000205941_100000689332 [0,2,0,0,0,0|2,0,0]=4 14350 B16R2.1480 NCc1ccccc1SCc2cscn2 62a_100000689332_100000205941 [0,2,0,0,0,0|2,0,0]=4 14351 B16R2.1480 NCc1cccnc1SCc2c[nH]cn2 62a_100000707719_100015189234 [0,2,0,0,0,0|2,0,0]=4 14352 B16R2.1480 NCc1cccnc1SCc2c[nH]cn2 62a_100015189234_100000707719 [0,2,0,0,0,0|2,0,0]=4 14353 B16R2.1480 NCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100020640021 [0,2,0,0,0,0|2,0,0]=4 14354 B16R2.1480 NCc1ccncc1SCc2c[nH]cn2 62a_100020640021_100000707719 [0,2,0,0,0,0|2,0,0]=4 14355 B16R2.1480 NCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100020591323 [0,2,0,0,0,0|2,0,0]=4 14356 B16R2.1480 NCc1ncccc1SCc2c[nH]cn2 62a_100020591323_100000707719 [0,2,0,0,0,0|2,0,0]=4 14357 B16R2.1480 NNc1ccccc1SCc2c[nH]cn2 62a_100000241748_100000707719 [0,2,0,0,0,0|1,0,0]=3 14358 B16R2.1480 NNc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000241748 [0,2,0,0,0,0|1,0,0]=3 14359 B16R2.1480 NNc1ccccc1SCc2cscn2 62a_100000205941_100000241748 [0,2,0,0,0,0|2,0,0]=4 14360 B16R2.1480 NNc1ccccc1SCc2cscn2 62a_100000241748_100000205941 [0,2,0,0,0,0|2,0,0]=4 14361 B16R2.1480 NNc1ccncc1SCc2c[nH]cn2 62a_100000707719_100013404636 [0,2,0,0,0,0|2,0,0]=4 14362 B16R2.1480 NNc1ccncc1SCc2c[nH]cn2 62a_100013404636_100000707719 [0,2,0,0,0,0|2,0,0]=4 14363 B16R2.1480 NNc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011464834 [0,2,0,0,0,0|2,0,0]=4 14364 B16R2.1480 NNc1ncccc1SCc2c[nH]cn2 62a_100011464834_100000707719 [0,2,0,0,0,0|2,0,0]=4 14365 B16R2.1480 O=Cc1ccccc1CSc2c[nH]cn2 62a_100000756875_200009853537 [0,2,0,0,0,0|2,0,0]=4 14366 B16R2.1480 O=Cc1ccccc1CSc2c[nH]cn2 62a_200009853537_100000756875 [0,2,0,0,0,0|2,0,0]=4 14367 B16R2.1480 O=Cc1ccccc1SCc2c[nH]cn2 62a_100000210073_100000707719 [0,2,0,0,0,0|1,0,0]=3 14368 B16R2.1480 O=Cc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000210073 [0,2,0,0,0,0|1,0,0]=3 14369 B16R2.1480 O=Cc1ccccc1SCc2cscn2 62a_100000205941_100000210073 [0,2,0,0,0,0|2,0,0]=4 14370 B16R2.1480 O=Cc1ccccc1SCc2cscn2 62a_100000210073_100000205941 [0,2,0,0,0,0|2,0,0]=4 14371 B16R2.1480 O=Cc1cccnc1SCc2c[nH]cn2 62a_100000707719_100009816751 [0,2,0,0,0,0|2,0,0]=4 14372 B16R2.1480 O=Cc1cccnc1SCc2c[nH]cn2 62a_100009816751_100000707719 [0,2,0,0,0,0|2,0,0]=4 14373 B16R2.1480 O=Cc1ccncc1SCc2c[nH]cn2 62a_100000707719_100011934409 [0,2,0,0,0,0|2,0,0]=4 14374 B16R2.1480 O=Cc1ccncc1SCc2c[nH]cn2 62a_100011934409_100000707719 [0,2,0,0,0,0|2,0,0]=4 14375 B16R2.1480 O=Cc1cnccc1SCc2c[nH]cn2 62a_100000050567_100000707719 [0,2,0,0,0,0|2,0,0]=4 14376 B16R2.1480 O=Cc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000050567 [0,2,0,0,0,0|2,0,0]=4 14377 B16R2.1480 O=Cc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011934733 [0,2,0,0,0,0|2,0,0]=4 14378 B16R2.1480 O=Cc1ncccc1SCc2c[nH]cn2 62a_100011934733_100000707719 [0,2,0,0,0,0|2,0,0]=4 14379 B16R2.1480 OCc1ccccc1CSc2c[nH]cn2 62a_100000756875_100009816955 [0,2,0,0,0,0|2,0,0]=4 14380 B16R2.1480 OCc1ccccc1CSc2c[nH]cn2 62a_100009816955_100000756875 [0,2,0,0,0,0|2,0,0]=4 14381 B16R2.1480 OCc1ccccc1NCc2c[nH]cn2 34a_100000212039_100000707719 [0,2,0,0,0,0|0,0,0]=2 14382 B16R2.1480 OCc1ccccc1NCc2cc[nH]n2 207a_100000212039_100000738523 [0,2,0,0,0,0|2,0,0]=4 14383 B16R2.1480 OCc1ccccc1NCc2ccco2 207a_100000212039_100000186105 [0,2,0,0,0,0|2,0,0]=4 14384 B16R2.1480 OCc1ccccc1NCc2ccco2 270302a_100000212039_100000186105 [0,2,0,0,0,0|2,0,0]=4 14385 B16R2.1480 OCc1ccccc1NCc2cccs2 207a_100000212039_100000209959 [0,2,0,0,0,0|2,0,0]=4 14386 B16R2.1480 OCc1ccccc1NCc2cccs2 270302a_100000212039_100000209959 [0,2,0,0,0,0|2,0,0]=4 14387 B16R2.1480 OCc1ccccc1NCc2ccoc2 207a_100000212039_100011215517 [0,2,0,0,0,0|2,0,0]=4 14388 B16R2.1480 OCc1ccccc1NCc2ccon2 34a_100000212039_100000234950 [0,2,0,0,0,0|2,0,0]=4 14389 B16R2.1480 OCc1ccccc1NCc2ccsc2 207a_100000212039_100000188534 [0,2,0,0,0,0|2,0,0]=4 14390 B16R2.1480 OCc1ccccc1NCc2ccsc2 270302a_100000212039_100000188534 [0,2,0,0,0,0|2,0,0]=4 14391 B16R2.1480 OCc1ccccc1NCc2ccsc2 34a_100000212039_100011261437 [0,2,0,0,0,0|2,0,0]=4 14392 B16R2.1480 OCc1ccccc1NCc2cn[nH]c2 207a_100000212039_100016992096 [0,2,0,0,0,0|2,0,0]=4 14393 B16R2.1480 OCc1ccccc1NCc2cn[nH]c2 270302a_100000212039_100016992096 [0,2,0,0,0,0|2,0,0]=4 14394 B16R2.1480 OCc1ccccc1NCc2cnc[nH]2 207a_100000212039_100000742939 [0,2,0,0,0,0|0,0,2]=4 14395 B16R2.1480 OCc1ccccc1NCc2cncs2 207a_100000212039_100000749870 [0,2,0,0,0,0|1,0,1]=4 14396 B16R2.1480 OCc1ccccc1NCc2cncs2 270302a_100000212039_100000749870 [0,2,0,0,0,0|1,0,1]=4 14397 B16R2.1480 OCc1ccccc1NCc2cncs2 34a_100000212039_100015185245 [0,2,0,0,0,0|1,0,1]=4 14398 B16R2.1480 OCc1ccccc1NCc2cscn2 207a_100000212039_100000743575 [0,2,0,0,0,0|1,0,0]=3 14399 B16R2.1480 OCc1ccccc1NCc2cscn2 270302a_100000212039_100000743575 [0,2,0,0,0,0|1,0,0]=3 14400 B16R2.1480 OCc1ccccc1NCc2cscn2 34a_100000212039_100000205941 [0,2,0,0,0,0|1,0,0]=3 14401 B16R2.1480 OCc1ccccc1NCc2ncc[nH]2 207a_100000212039_100000743867 [0,2,0,0,0,0|2,0,0]=4 14402 B16R2.1480 OCc1ccccc1NCc2ncc[nH]2 34a_100000212039_100016991755 [0,2,0,0,0,0|2,0,0]=4 14403 B16R2.1480 OCc1ccccc1NCc2ncco2 34a_100000212039_103436540062 [0,2,0,0,0,0|2,0,0]=4 14404 B16R2.1480 OCc1ccccc1NCc2nccs2 207a_100000212039_100000750902 [0,2,0,0,0,0|2,0,0]=4 14405 B16R2.1480 OCc1ccccc1NCc2nccs2 270302a_100000212039_100000750902 [0,2,0,0,0,0|2,0,0]=4 14406 B16R2.1480 OCc1ccccc1NCc2nccs2 34a_100000212039_100015184050 [0,2,0,0,0,0|2,0,0]=4 14407 B16R2.1480 OCc1ccccc1NCc2ncon2 34a_100000212039_100000233494 [0,2,0,0,0,0|2,0,0]=4 14408 B16R2.1480 OCc1ccccc1NCn2cncn2 34a_100000212039_200020645497 [0,2,0,0,0,0|1,0,1]=4 14409 B16R2.1480 OCc1ccccc1OCc2c[nH]cn2 34a_100011216872_100000707719 [0,2,0,0,0,0|1,0,0]=3 14410 B16R2.1480 OCc1ccccc1OCc2cscn2 34a_100011216872_100000205941 [0,2,0,0,0,0|2,0,0]=4 14411 B16R2.1480 OCc1ccccc1SCc2c[nH]cn2 62a_100000187465_100000707719 [0,2,0,0,0,0|1,0,0]=3 14412 B16R2.1480 OCc1ccccc1SCc2c[nH]cn2 62a_100000707719_100000187465 [0,2,0,0,0,0|1,0,0]=3 14413 B16R2.1480 OCc1ccccc1SCc2cscn2 62a_100000187465_100000205941 [0,2,0,0,0,0|2,0,0]=4 14414 B16R2.1480 OCc1ccccc1SCc2cscn2 62a_100000205941_100000187465 [0,2,0,0,0,0|2,0,0]=4 14415 B16R2.1480 OCc1cccnc1SCc2c[nH]cn2 62a_100000707719_100000748726 [0,2,0,0,0,0|2,0,0]=4 14416 B16R2.1480 OCc1cccnc1SCc2c[nH]cn2 62a_100000748726_100000707719 [0,2,0,0,0,0|2,0,0]=4 14417 B16R2.1480 OCc1ccncc1OCc2c[nH]cn2 34a_100000078615_100000707719 [0,2,0,0,0,0|2,0,0]=4 14418 B16R2.1480 OCc1ccncc1SCc2c[nH]cn2 62a_100000707719_100009873359 [0,2,0,0,0,0|2,0,0]=4 14419 B16R2.1480 OCc1ccncc1SCc2c[nH]cn2 62a_100009873359_100000707719 [0,2,0,0,0,0|2,0,0]=4 14420 B16R2.1480 OCc1cnccc1NCc2c[nH]cn2 27a_100000758547_100000117392 [0,2,0,0,0,0|1,0,0]=3 14421 B16R2.1480 OCc1cnccc1NCc2c[nH]nn2 27a_100020620823_100000117392 [0,2,0,0,0,0|2,0,0]=4 14422 B16R2.1480 OCc1cnccc1NCc2cocn2 27a_100015188801_100000117392 [0,2,0,0,0,0|2,0,0]=4 14423 B16R2.1480 OCc1cnccc1NCc2cscn2 27a_100015185402_100000117392 [0,2,0,0,0,0|2,0,0]=4 14424 B16R2.1480 OCc1cnccc1SCc2c[nH]cn2 62a_100000117392_100000707719 [0,2,0,0,0,0|2,0,0]=4 14425 B16R2.1480 OCc1cnccc1SCc2c[nH]cn2 62a_100000707719_100000117392 [0,2,0,0,0,0|2,0,0]=4 14426 B16R2.1480 OCc1ncccc1OCc2c[nH]cn2 34a_100000731849_100000707719 [0,2,0,0,0,0|2,0,0]=4 14427 B16R2.1480 OCc1ncccc1SCc2c[nH]cn2 62a_100000707719_100011996772 [0,2,0,0,0,0|2,0,0]=4 14428 B16R2.1480 OCc1ncccc1SCc2c[nH]cn2 62a_100011996772_100000707719 [0,2,0,0,0,0|2,0,0]=4 14429 B16R2.2925 Brc1c(cccc1CSc2c[nH]cn2)I 62a_100000756875_100010254545 [0,2,0,0,0,0|2,0,0]=4 14430 B16R2.2925 Brc1c(cccc1CSc2c[nH]cn2)I 62a_100010254545_100000756875 [0,2,0,0,0,0|2,0,0]=4 14431 B16R2.2925 Brc1c(cccc1OCc2c[nH]cn2)I 34a_100010187914_100000707719 [0,2,0,0,0,0|1,0,0]=3 14432 B16R2.2925 Brc1c(cccc1OCc2cscn2)I 34a_100010187914_100000205941 [0,2,0,0,0,0|2,0,0]=4 14433 B16R2.2925 Brc1c(cccc1OCc2cscn2)I 7a_100010187914_100000205941 [0,2,0,0,0,0|2,0,0]=4 14434 B16R2.2925 Brc1cccc(c1Br)OCc2c[nH]cn2 34a_100010187966_100000707719 [0,2,0,0,0,0|1,0,0]=3 14435 B16R2.2925 Brc1cccc(c1Br)OCc2cscn2 34a_100010187966_100000205941 [0,2,0,0,0,0|2,0,0]=4 14436 B16R2.2925 Brc1cccc(c1Br)OCc2cscn2 7a_100010187966_100000205941 [0,2,0,0,0,0|2,0,0]=4 14437 B16R2.2925 Brc1cccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100010175083 [0,2,0,0,0,0|1,0,0]=3 14438 B16R2.2925 Brc1cccc(c1Br)SCc2c[nH]cn2 62a_100010175083_100000707719 [0,2,0,0,0,0|1,0,0]=3 14439 B16R2.2925 Brc1cccc(c1Br)SCc2cscn2 62a_100000205941_100010175083 [0,2,0,0,0,0|2,0,0]=4 14440 B16R2.2925 Brc1cccc(c1Br)SCc2cscn2 62a_100010175083_100000205941 [0,2,0,0,0,0|2,0,0]=4 14441 B16R2.2925 Brc1cccc(c1I)NCc2c[nH]cn2 34a_100020590159_100000707719 [0,2,0,0,0,0|0,0,0]=2 14442 B16R2.2925 Brc1cccc(c1I)NCc2ccon2 34a_100020590159_100000234950 [0,2,0,0,0,0|2,0,0]=4 14443 B16R2.2925 Brc1cccc(c1I)NCc2ccsc2 34a_100020590159_100011261437 [0,2,0,0,0,0|2,0,0]=4 14444 B16R2.2925 Brc1cccc(c1I)NCc2cncs2 34a_100020590159_100015185245 [0,2,0,0,0,0|1,0,1]=4 14445 B16R2.2925 Brc1cccc(c1I)NCc2cscn2 34a_100020590159_100000205941 [0,2,0,0,0,0|1,0,0]=3 14446 B16R2.2925 Brc1cccc(c1I)NCc2ncc[nH]2 34a_100020590159_100016991755 [0,2,0,0,0,0|2,0,0]=4 14447 B16R2.2925 Brc1cccc(c1I)NCc2ncco2 34a_100020590159_103436540062 [0,2,0,0,0,0|2,0,0]=4 14448 B16R2.2925 Brc1cccc(c1I)NCc2nccs2 34a_100020590159_100015184050 [0,2,0,0,0,0|2,0,0]=4 14449 B16R2.2925 Brc1cccc(c1I)NCc2ncon2 34a_100020590159_100000233494 [0,2,0,0,0,0|2,0,0]=4 14450 B16R2.2925 Brc1cccc(c1I)NCn2cncn2 34a_100020590159_200020645497 [0,2,0,0,0,0|1,0,1]=4 14451 B16R2.2925 Brc1cccc(c1I)OCc2c[nH]cn2 34a_100010187912_100000707719 [0,2,0,0,0,0|1,0,0]=3 14452 B16R2.2925 Brc1cccc(c1I)OCc2cscn2 34a_100010187912_100000205941 [0,2,0,0,0,0|2,0,0]=4 14453 B16R2.2925 Brc1cccc(c1I)OCc2cscn2 7a_100010187912_100000205941 [0,2,0,0,0,0|2,0,0]=4 14454 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)Br 62a_100000694682_100000756875 [0,2,0,0,0,0|2,0,0]=4 14455 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)Br 62a_100000756875_100000694682 [0,2,0,0,0,0|2,0,0]=4 14456 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)Cl 62a_100000756875_100012186920 [0,2,0,0,0,0|2,0,0]=4 14457 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)Cl 62a_100012186920_100000756875 [0,2,0,0,0,0|2,0,0]=4 14458 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)F 62a_100000756875_100009813626 [0,2,0,0,0,0|2,0,0]=4 14459 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)F 62a_100009813626_100000756875 [0,2,0,0,0,0|2,0,0]=4 14460 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)I 62a_100000756875_100010150147 [0,2,0,0,0,0|2,0,0]=4 14461 B16R2.2925 Cc1c(cccc1CSc2c[nH]cn2)I 62a_100010150147_100000756875 [0,2,0,0,0,0|2,0,0]=4 14462 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)Br 34a_100000750434_100000707719 [0,2,0,0,0,0|0,0,0]=2 14463 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)Cl 2230a_100000210441_100000707719 [0,2,0,0,0,0|0,0,0]=2 14464 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)Cl 34a_100000210441_100000707719 [0,2,0,0,0,0|0,0,0]=2 14465 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)F 34a_100000745574_100000707719 [0,2,0,0,0,0|0,0,0]=2 14466 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)I 34a_100000761887_100000707719 [0,2,0,0,0,0|0,0,0]=2 14467 B16R2.2925 Cc1c(cccc1NCc2c[nH]cn2)O 34a_100011216573_100000707719 [0,2,0,0,0,0|0,0,0]=2 14468 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)Br 207a_100000750434_100000738523 [0,2,0,0,0,0|2,0,0]=4 14469 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)Cl 207a_100000210441_100000738523 [0,2,0,0,0,0|2,0,0]=4 14470 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)F 207a_100000745574_100000738523 [0,2,0,0,0,0|2,0,0]=4 14471 B16R2.2925 Cc1c(cccc1NCc2cc[nH]n2)I 207a_100000761887_100000738523 [0,2,0,0,0,0|2,0,0]=4 14472 B16R2.2925 Cc1c(cccc1NCc2ccco2)Br 207a_100000750434_100000186105 [0,2,0,0,0,0|2,0,0]=4 14473 B16R2.2925 Cc1c(cccc1NCc2ccco2)Br 270302a_100000750434_100000186105 [0,2,0,0,0,0|2,0,0]=4 14474 B16R2.2925 Cc1c(cccc1NCc2ccco2)Cl 207a_100000210441_100000186105 [0,2,0,0,0,0|2,0,0]=4 14475 B16R2.2925 Cc1c(cccc1NCc2ccco2)Cl 270302a_100000210441_100000186105 [0,2,0,0,0,0|2,0,0]=4 14476 B16R2.2925 Cc1c(cccc1NCc2ccco2)F 207a_100000745574_100000186105 [0,2,0,0,0,0|2,0,0]=4 14477 B16R2.2925 Cc1c(cccc1NCc2ccco2)F 270302a_100000745574_100000186105 [0,2,0,0,0,0|2,0,0]=4 14478 B16R2.2925 Cc1c(cccc1NCc2ccco2)I 207a_100000761887_100000186105 [0,2,0,0,0,0|2,0,0]=4 14479 B16R2.2925 Cc1c(cccc1NCc2ccco2)I 270302a_100000761887_100000186105 [0,2,0,0,0,0|2,0,0]=4 14480 B16R2.2925 Cc1c(cccc1NCc2ccco2)O 270302a_100011216573_100000186105 [0,2,0,0,0,0|2,0,0]=4 14481 B16R2.2925 Cc1c(cccc1NCc2cccs2)Br 207a_100000750434_100000209959 [0,2,0,0,0,0|2,0,0]=4 14482 B16R2.2925 Cc1c(cccc1NCc2cccs2)Br 270302a_100000750434_100000209959 [0,2,0,0,0,0|2,0,0]=4 14483 B16R2.2925 Cc1c(cccc1NCc2cccs2)Cl 207a_100000210441_100000209959 [0,2,0,0,0,0|2,0,0]=4 14484 B16R2.2925 Cc1c(cccc1NCc2cccs2)Cl 270302a_100000210441_100000209959 [0,2,0,0,0,0|2,0,0]=4 14485 B16R2.2925 Cc1c(cccc1NCc2cccs2)F 207a_100000745574_100000209959 [0,2,0,0,0,0|2,0,0]=4 14486 B16R2.2925 Cc1c(cccc1NCc2cccs2)F 270302a_100000745574_100000209959 [0,2,0,0,0,0|2,0,0]=4 14487 B16R2.2925 Cc1c(cccc1NCc2cccs2)I 207a_100000761887_100000209959 [0,2,0,0,0,0|2,0,0]=4 14488 B16R2.2925 Cc1c(cccc1NCc2cccs2)I 270302a_100000761887_100000209959 [0,2,0,0,0,0|2,0,0]=4 14489 B16R2.2925 Cc1c(cccc1NCc2cccs2)O 270302a_100011216573_100000209959 [0,2,0,0,0,0|2,0,0]=4 14490 B16R2.2925 Cc1c(cccc1NCc2ccoc2)Br 207a_100000750434_100011215517 [0,2,0,0,0,0|2,0,0]=4 14491 B16R2.2925 Cc1c(cccc1NCc2ccoc2)Cl 207a_100000210441_100011215517 [0,2,0,0,0,0|2,0,0]=4 14492 B16R2.2925 Cc1c(cccc1NCc2ccoc2)F 207a_100000745574_100011215517 [0,2,0,0,0,0|2,0,0]=4 14493 B16R2.2925 Cc1c(cccc1NCc2ccoc2)I 207a_100000761887_100011215517 [0,2,0,0,0,0|2,0,0]=4 14494 B16R2.2925 Cc1c(cccc1NCc2ccon2)Br 34a_100000750434_100000234950 [0,2,0,0,0,0|2,0,0]=4 14495 B16R2.2925 Cc1c(cccc1NCc2ccon2)Cl 2230a_100000210441_100000234950 [0,2,0,0,0,0|2,0,0]=4 14496 B16R2.2925 Cc1c(cccc1NCc2ccon2)Cl 34a_100000210441_100000234950 [0,2,0,0,0,0|2,0,0]=4 14497 B16R2.2925 Cc1c(cccc1NCc2ccon2)Cl 7a_100000210441_100000234950 [0,2,0,0,0,0|2,0,0]=4 14498 B16R2.2925 Cc1c(cccc1NCc2ccon2)F 34a_100000745574_100000234950 [0,2,0,0,0,0|2,0,0]=4 14499 B16R2.2925 Cc1c(cccc1NCc2ccon2)F 7a_100000745574_100000234950 [0,2,0,0,0,0|2,0,0]=4 14500 B16R2.2925 Cc1c(cccc1NCc2ccon2)I 34a_100000761887_100000234950 [0,2,0,0,0,0|2,0,0]=4 14501 B16R2.2925 Cc1c(cccc1NCc2ccon2)O 34a_100011216573_100000234950 [0,2,0,0,0,0|2,0,0]=4 14502 B16R2.2925 Cc1c(cccc1NCc2ccon2)O 7a_100011216573_100000234950 [0,2,0,0,0,0|2,0,0]=4 14503 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Br 207a_100000750434_100000188534 [0,2,0,0,0,0|2,0,0]=4 14504 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Br 270302a_100000750434_100000188534 [0,2,0,0,0,0|2,0,0]=4 14505 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Br 34a_100000750434_100011261437 [0,2,0,0,0,0|2,0,0]=4 14506 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Cl 207a_100000210441_100000188534 [0,2,0,0,0,0|2,0,0]=4 14507 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Cl 2230a_100000210441_100011261437 [0,2,0,0,0,0|2,0,0]=4 14508 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Cl 270302a_100000210441_100000188534 [0,2,0,0,0,0|2,0,0]=4 14509 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Cl 34a_100000210441_100011261437 [0,2,0,0,0,0|2,0,0]=4 14510 B16R2.2925 Cc1c(cccc1NCc2ccsc2)Cl 7a_100000210441_100011261437 [0,2,0,0,0,0|2,0,0]=4 14511 B16R2.2925 Cc1c(cccc1NCc2ccsc2)F 207a_100000745574_100000188534 [0,2,0,0,0,0|2,0,0]=4 14512 B16R2.2925 Cc1c(cccc1NCc2ccsc2)F 270302a_100000745574_100000188534 [0,2,0,0,0,0|2,0,0]=4 14513 B16R2.2925 Cc1c(cccc1NCc2ccsc2)F 34a_100000745574_100011261437 [0,2,0,0,0,0|2,0,0]=4 14514 B16R2.2925 Cc1c(cccc1NCc2ccsc2)F 7a_100000745574_100011261437 [0,2,0,0,0,0|2,0,0]=4 14515 B16R2.2925 Cc1c(cccc1NCc2ccsc2)I 207a_100000761887_100000188534 [0,2,0,0,0,0|2,0,0]=4 14516 B16R2.2925 Cc1c(cccc1NCc2ccsc2)I 270302a_100000761887_100000188534 [0,2,0,0,0,0|2,0,0]=4 14517 B16R2.2925 Cc1c(cccc1NCc2ccsc2)I 34a_100000761887_100011261437 [0,2,0,0,0,0|2,0,0]=4 14518 B16R2.2925 Cc1c(cccc1NCc2ccsc2)O 270302a_100011216573_100000188534 [0,2,0,0,0,0|2,0,0]=4 14519 B16R2.2925 Cc1c(cccc1NCc2ccsc2)O 34a_100011216573_100011261437 [0,2,0,0,0,0|2,0,0]=4 14520 B16R2.2925 Cc1c(cccc1NCc2ccsc2)O 7a_100011216573_100011261437 [0,2,0,0,0,0|2,0,0]=4 14521 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)Br 207a_100000750434_100016992096 [0,2,0,0,0,0|2,0,0]=4 14522 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)Br 270302a_100000750434_100016992096 [0,2,0,0,0,0|2,0,0]=4 14523 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)Cl 207a_100000210441_100016992096 [0,2,0,0,0,0|2,0,0]=4 14524 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)Cl 270302a_100000210441_100016992096 [0,2,0,0,0,0|2,0,0]=4 14525 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)F 207a_100000745574_100016992096 [0,2,0,0,0,0|2,0,0]=4 14526 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)F 270302a_100000745574_100016992096 [0,2,0,0,0,0|2,0,0]=4 14527 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)I 207a_100000761887_100016992096 [0,2,0,0,0,0|2,0,0]=4 14528 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)I 270302a_100000761887_100016992096 [0,2,0,0,0,0|2,0,0]=4 14529 B16R2.2925 Cc1c(cccc1NCc2cn[nH]c2)O 270302a_100011216573_100016992096 [0,2,0,0,0,0|2,0,0]=4 14530 B16R2.2925 Cc1c(cccc1NCc2cnc[nH]2)Br 207a_100000750434_100000742939 [0,2,0,0,0,0|0,0,2]=4 14531 B16R2.2925 Cc1c(cccc1NCc2cnc[nH]2)Cl 207a_100000210441_100000742939 [0,2,0,0,0,0|0,0,2]=4 14532 B16R2.2925 Cc1c(cccc1NCc2cnc[nH]2)F 207a_100000745574_100000742939 [0,2,0,0,0,0|0,0,2]=4 14533 B16R2.2925 Cc1c(cccc1NCc2cnc[nH]2)I 207a_100000761887_100000742939 [0,2,0,0,0,0|0,0,2]=4 14534 B16R2.2925 Cc1c(cccc1NCc2cncs2)Br 207a_100000750434_100000749870 [0,2,0,0,0,0|1,0,1]=4 14535 B16R2.2925 Cc1c(cccc1NCc2cncs2)Br 270302a_100000750434_100000749870 [0,2,0,0,0,0|1,0,1]=4 14536 B16R2.2925 Cc1c(cccc1NCc2cncs2)Br 34a_100000750434_100015185245 [0,2,0,0,0,0|1,0,1]=4 14537 B16R2.2925 Cc1c(cccc1NCc2cncs2)Cl 207a_100000210441_100000749870 [0,2,0,0,0,0|1,0,1]=4 14538 B16R2.2925 Cc1c(cccc1NCc2cncs2)Cl 2230a_100000210441_100015185245 [0,2,0,0,0,0|1,0,1]=4 14539 B16R2.2925 Cc1c(cccc1NCc2cncs2)Cl 270302a_100000210441_100000749870 [0,2,0,0,0,0|1,0,1]=4 14540 B16R2.2925 Cc1c(cccc1NCc2cncs2)Cl 34a_100000210441_100015185245 [0,2,0,0,0,0|1,0,1]=4 14541 B16R2.2925 Cc1c(cccc1NCc2cncs2)Cl 7a_100000210441_100015185245 [0,2,0,0,0,0|1,0,1]=4 14542 B16R2.2925 Cc1c(cccc1NCc2cncs2)F 207a_100000745574_100000749870 [0,2,0,0,0,0|1,0,1]=4 14543 B16R2.2925 Cc1c(cccc1NCc2cncs2)F 270302a_100000745574_100000749870 [0,2,0,0,0,0|1,0,1]=4 14544 B16R2.2925 Cc1c(cccc1NCc2cncs2)F 34a_100000745574_100015185245 [0,2,0,0,0,0|1,0,1]=4 14545 B16R2.2925 Cc1c(cccc1NCc2cncs2)F 7a_100000745574_100015185245 [0,2,0,0,0,0|1,0,1]=4 14546 B16R2.2925 Cc1c(cccc1NCc2cncs2)I 207a_100000761887_100000749870 [0,2,0,0,0,0|1,0,1]=4 14547 B16R2.2925 Cc1c(cccc1NCc2cncs2)I 270302a_100000761887_100000749870 [0,2,0,0,0,0|1,0,1]=4 14548 B16R2.2925 Cc1c(cccc1NCc2cncs2)I 34a_100000761887_100015185245 [0,2,0,0,0,0|1,0,1]=4 14549 B16R2.2925 Cc1c(cccc1NCc2cncs2)O 270302a_100011216573_100000749870 [0,2,0,0,0,0|1,0,1]=4 14550 B16R2.2925 Cc1c(cccc1NCc2cncs2)O 34a_100011216573_100015185245 [0,2,0,0,0,0|1,0,1]=4 14551 B16R2.2925 Cc1c(cccc1NCc2cncs2)O 7a_100011216573_100015185245 [0,2,0,0,0,0|1,0,1]=4 14552 B16R2.2925 Cc1c(cccc1NCc2cscn2)Br 207a_100000750434_100000743575 [0,2,0,0,0,0|1,0,0]=3 14553 B16R2.2925 Cc1c(cccc1NCc2cscn2)Br 270302a_100000750434_100000743575 [0,2,0,0,0,0|1,0,0]=3 14554 B16R2.2925 Cc1c(cccc1NCc2cscn2)Br 34a_100000750434_100000205941 [0,2,0,0,0,0|1,0,0]=3 14555 B16R2.2925 Cc1c(cccc1NCc2cscn2)Cl 207a_100000210441_100000743575 [0,2,0,0,0,0|1,0,0]=3 14556 B16R2.2925 Cc1c(cccc1NCc2cscn2)Cl 2230a_100000210441_100000205941 [0,2,0,0,0,0|1,0,0]=3 14557 B16R2.2925 Cc1c(cccc1NCc2cscn2)Cl 270302a_100000210441_100000743575 [0,2,0,0,0,0|1,0,0]=3 14558 B16R2.2925 Cc1c(cccc1NCc2cscn2)Cl 34a_100000210441_100000205941 [0,2,0,0,0,0|1,0,0]=3 14559 B16R2.2925 Cc1c(cccc1NCc2cscn2)Cl 7a_100000210441_100000205941 [0,2,0,0,0,0|1,0,0]=3 14560 B16R2.2925 Cc1c(cccc1NCc2cscn2)F 207a_100000745574_100000743575 [0,2,0,0,0,0|1,0,0]=3 14561 B16R2.2925 Cc1c(cccc1NCc2cscn2)F 270302a_100000745574_100000743575 [0,2,0,0,0,0|1,0,0]=3 14562 B16R2.2925 Cc1c(cccc1NCc2cscn2)F 34a_100000745574_100000205941 [0,2,0,0,0,0|1,0,0]=3 14563 B16R2.2925 Cc1c(cccc1NCc2cscn2)F 7a_100000745574_100000205941 [0,2,0,0,0,0|1,0,0]=3 14564 B16R2.2925 Cc1c(cccc1NCc2cscn2)I 207a_100000761887_100000743575 [0,2,0,0,0,0|1,0,0]=3 14565 B16R2.2925 Cc1c(cccc1NCc2cscn2)I 270302a_100000761887_100000743575 [0,2,0,0,0,0|1,0,0]=3 14566 B16R2.2925 Cc1c(cccc1NCc2cscn2)I 34a_100000761887_100000205941 [0,2,0,0,0,0|1,0,0]=3 14567 B16R2.2925 Cc1c(cccc1NCc2cscn2)O 270302a_100011216573_100000743575 [0,2,0,0,0,0|1,0,0]=3 14568 B16R2.2925 Cc1c(cccc1NCc2cscn2)O 34a_100011216573_100000205941 [0,2,0,0,0,0|1,0,0]=3 14569 B16R2.2925 Cc1c(cccc1NCc2cscn2)O 7a_100011216573_100000205941 [0,2,0,0,0,0|1,0,0]=3 14570 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Br 207a_100000750434_100000743867 [0,2,0,0,0,0|2,0,0]=4 14571 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Br 34a_100000750434_100016991755 [0,2,0,0,0,0|2,0,0]=4 14572 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Cl 207a_100000210441_100000743867 [0,2,0,0,0,0|2,0,0]=4 14573 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Cl 2230a_100000210441_100016991755 [0,2,0,0,0,0|2,0,0]=4 14574 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Cl 34a_100000210441_100016991755 [0,2,0,0,0,0|2,0,0]=4 14575 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)Cl 7a_100000210441_100000753453 [0,2,0,0,0,0|2,0,0]=4 14576 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)F 207a_100000745574_100000743867 [0,2,0,0,0,0|2,0,0]=4 14577 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)F 34a_100000745574_100016991755 [0,2,0,0,0,0|2,0,0]=4 14578 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)F 7a_100000745574_100000753453 [0,2,0,0,0,0|2,0,0]=4 14579 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)I 207a_100000761887_100000743867 [0,2,0,0,0,0|2,0,0]=4 14580 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)I 34a_100000761887_100016991755 [0,2,0,0,0,0|2,0,0]=4 14581 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)O 34a_100011216573_100016991755 [0,2,0,0,0,0|2,0,0]=4 14582 B16R2.2925 Cc1c(cccc1NCc2ncc[nH]2)O 7a_100011216573_100000753453 [0,2,0,0,0,0|2,0,0]=4 14583 B16R2.2925 Cc1c(cccc1NCc2ncco2)Br 34a_100000750434_103436540062 [0,2,0,0,0,0|2,0,0]=4 14584 B16R2.2925 Cc1c(cccc1NCc2ncco2)Cl 2230a_100000210441_103436540062 [0,2,0,0,0,0|2,0,0]=4 14585 B16R2.2925 Cc1c(cccc1NCc2ncco2)Cl 34a_100000210441_103436540062 [0,2,0,0,0,0|2,0,0]=4 14586 B16R2.2925 Cc1c(cccc1NCc2ncco2)Cl 7a_100000210441_103436540062 [0,2,0,0,0,0|2,0,0]=4 14587 B16R2.2925 Cc1c(cccc1NCc2ncco2)F 34a_100000745574_103436540062 [0,2,0,0,0,0|2,0,0]=4 14588 B16R2.2925 Cc1c(cccc1NCc2ncco2)F 7a_100000745574_103436540062 [0,2,0,0,0,0|2,0,0]=4 14589 B16R2.2925 Cc1c(cccc1NCc2ncco2)I 34a_100000761887_103436540062 [0,2,0,0,0,0|2,0,0]=4 14590 B16R2.2925 Cc1c(cccc1NCc2ncco2)O 34a_100011216573_103436540062 [0,2,0,0,0,0|2,0,0]=4 14591 B16R2.2925 Cc1c(cccc1NCc2ncco2)O 7a_100011216573_103436540062 [0,2,0,0,0,0|2,0,0]=4 14592 B16R2.2925 Cc1c(cccc1NCc2nccs2)Br 207a_100000750434_100000750902 [0,2,0,0,0,0|2,0,0]=4 14593 B16R2.2925 Cc1c(cccc1NCc2nccs2)Br 270302a_100000750434_100000750902 [0,2,0,0,0,0|2,0,0]=4 14594 B16R2.2925 Cc1c(cccc1NCc2nccs2)Br 34a_100000750434_100015184050 [0,2,0,0,0,0|2,0,0]=4 14595 B16R2.2925 Cc1c(cccc1NCc2nccs2)Cl 207a_100000210441_100000750902 [0,2,0,0,0,0|2,0,0]=4 14596 B16R2.2925 Cc1c(cccc1NCc2nccs2)Cl 2230a_100000210441_100015184050 [0,2,0,0,0,0|2,0,0]=4 14597 B16R2.2925 Cc1c(cccc1NCc2nccs2)Cl 270302a_100000210441_100000750902 [0,2,0,0,0,0|2,0,0]=4 14598 B16R2.2925 Cc1c(cccc1NCc2nccs2)Cl 34a_100000210441_100015184050 [0,2,0,0,0,0|2,0,0]=4 14599 B16R2.2925 Cc1c(cccc1NCc2nccs2)Cl 7a_100000210441_100015184050 [0,2,0,0,0,0|2,0,0]=4 14600 B16R2.2925 Cc1c(cccc1NCc2nccs2)F 207a_100000745574_100000750902 [0,2,0,0,0,0|2,0,0]=4 14601 B16R2.2925 Cc1c(cccc1NCc2nccs2)F 270302a_100000745574_100000750902 [0,2,0,0,0,0|2,0,0]=4 14602 B16R2.2925 Cc1c(cccc1NCc2nccs2)F 34a_100000745574_100015184050 [0,2,0,0,0,0|2,0,0]=4 14603 B16R2.2925 Cc1c(cccc1NCc2nccs2)F 7a_100000745574_100015184050 [0,2,0,0,0,0|2,0,0]=4 14604 B16R2.2925 Cc1c(cccc1NCc2nccs2)I 207a_100000761887_100000750902 [0,2,0,0,0,0|2,0,0]=4 14605 B16R2.2925 Cc1c(cccc1NCc2nccs2)I 270302a_100000761887_100000750902 [0,2,0,0,0,0|2,0,0]=4 14606 B16R2.2925 Cc1c(cccc1NCc2nccs2)I 34a_100000761887_100015184050 [0,2,0,0,0,0|2,0,0]=4 14607 B16R2.2925 Cc1c(cccc1NCc2nccs2)O 270302a_100011216573_100000750902 [0,2,0,0,0,0|2,0,0]=4 14608 B16R2.2925 Cc1c(cccc1NCc2nccs2)O 34a_100011216573_100015184050 [0,2,0,0,0,0|2,0,0]=4 14609 B16R2.2925 Cc1c(cccc1NCc2nccs2)O 7a_100011216573_100015184050 [0,2,0,0,0,0|2,0,0]=4 14610 B16R2.2925 Cc1c(cccc1NCc2ncon2)Br 34a_100000750434_100000233494 [0,2,0,0,0,0|2,0,0]=4 14611 B16R2.2925 Cc1c(cccc1NCc2ncon2)Cl 34a_100000210441_100000233494 [0,2,0,0,0,0|2,0,0]=4 14612 B16R2.2925 Cc1c(cccc1NCc2ncon2)F 34a_100000745574_100000233494 [0,2,0,0,0,0|2,0,0]=4 14613 B16R2.2925 Cc1c(cccc1NCc2ncon2)I 34a_100000761887_100000233494 [0,2,0,0,0,0|2,0,0]=4 14614 B16R2.2925 Cc1c(cccc1NCc2ncon2)O 34a_100011216573_100000233494 [0,2,0,0,0,0|2,0,0]=4 14615 B16R2.2925 Cc1c(cccc1NCn2cncn2)Br 34a_100000750434_200020645497 [0,2,0,0,0,0|1,0,1]=4 14616 B16R2.2925 Cc1c(cccc1NCn2cncn2)Cl 2230a_100000210441_200020645497 [0,2,0,0,0,0|1,0,1]=4 14617 B16R2.2925 Cc1c(cccc1NCn2cncn2)Cl 34a_100000210441_200020645497 [0,2,0,0,0,0|1,0,1]=4 14618 B16R2.2925 Cc1c(cccc1NCn2cncn2)Cl 7a_100000210441_200020645497 [0,2,0,0,0,0|1,0,1]=4 14619 B16R2.2925 Cc1c(cccc1NCn2cncn2)F 34a_100000745574_200020645497 [0,2,0,0,0,0|1,0,1]=4 14620 B16R2.2925 Cc1c(cccc1NCn2cncn2)F 7a_100000745574_200020645497 [0,2,0,0,0,0|1,0,1]=4 14621 B16R2.2925 Cc1c(cccc1NCn2cncn2)I 34a_100000761887_200020645497 [0,2,0,0,0,0|1,0,1]=4 14622 B16R2.2925 Cc1c(cccc1NCn2cncn2)O 34a_100011216573_200020645497 [0,2,0,0,0,0|1,0,1]=4 14623 B16R2.2925 Cc1c(cccc1NCn2cncn2)O 7a_100011216573_200020645497 [0,2,0,0,0,0|1,0,1]=4 14624 B16R2.2925 Cc1c(cccc1OCc2c[nH]cn2)Br 34a_100012002258_100000707719 [0,2,0,0,0,0|1,0,0]=3 14625 B16R2.2925 Cc1c(cccc1OCc2c[nH]cn2)Cl 34a_100011265684_100000707719 [0,2,0,0,0,0|1,0,0]=3 14626 B16R2.2925 Cc1c(cccc1OCc2c[nH]cn2)F 34a_100011217231_100000707719 [0,2,0,0,0,0|1,0,0]=3 14627 B16R2.2925 Cc1c(cccc1OCc2c[nH]cn2)N 34a_100011216573_100000707719 [0,2,0,0,0,0|1,0,0]=3 14628 B16R2.2925 Cc1c(cccc1OCc2cscn2)Br 34a_100012002258_100000205941 [0,2,0,0,0,0|2,0,0]=4 14629 B16R2.2925 Cc1c(cccc1OCc2cscn2)Br 7a_100012002258_100000205941 [0,2,0,0,0,0|2,0,0]=4 14630 B16R2.2925 Cc1c(cccc1OCc2cscn2)Cl 34a_100011265684_100000205941 [0,2,0,0,0,0|2,0,0]=4 14631 B16R2.2925 Cc1c(cccc1OCc2cscn2)Cl 7a_100011265684_100000205941 [0,2,0,0,0,0|2,0,0]=4 14632 B16R2.2925 Cc1c(cccc1OCc2cscn2)F 34a_100011217231_100000205941 [0,2,0,0,0,0|2,0,0]=4 14633 B16R2.2925 Cc1c(cccc1OCc2cscn2)F 7a_100011217231_100000205941 [0,2,0,0,0,0|2,0,0]=4 14634 B16R2.2925 Cc1c(cccc1OCc2cscn2)N 34a_100011216573_100000205941 [0,2,0,0,0,0|2,0,0]=4 14635 B16R2.2925 Cc1c(cccc1OCc2cscn2)N 7a_100011216573_100000205941 [0,2,0,0,0,0|2,0,0]=4 14636 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100012353703 [0,2,0,0,0,0|1,0,0]=3 14637 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)Br 62a_100012353703_100000707719 [0,2,0,0,0,0|1,0,0]=3 14638 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000707719_100000726075 [0,2,0,0,0,0|1,0,0]=3 14639 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000726075_100000707719 [0,2,0,0,0,0|1,0,0]=3 14640 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100011216893 [0,2,0,0,0,0|1,0,0]=3 14641 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)F 62a_100011216893_100000707719 [0,2,0,0,0,0|1,0,0]=3 14642 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)N 62a_100000707719_100000761887 [0,2,0,0,0,0|1,0,0]=3 14643 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)N 62a_100000761887_100000707719 [0,2,0,0,0,0|1,0,0]=3 14644 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)O 62a_100000707719_100012002258 [0,2,0,0,0,0|1,0,0]=3 14645 B16R2.2925 Cc1c(cccc1SCc2c[nH]cn2)O 62a_100012002258_100000707719 [0,2,0,0,0,0|1,0,0]=3 14646 B16R2.2925 Cc1c(cccc1SCc2cscn2)Br 62a_100000205941_100012353703 [0,2,0,0,0,0|2,0,0]=4 14647 B16R2.2925 Cc1c(cccc1SCc2cscn2)Br 62a_100012353703_100000205941 [0,2,0,0,0,0|2,0,0]=4 14648 B16R2.2925 Cc1c(cccc1SCc2cscn2)Cl 62a_100000205941_100000726075 [0,2,0,0,0,0|2,0,0]=4 14649 B16R2.2925 Cc1c(cccc1SCc2cscn2)Cl 62a_100000726075_100000205941 [0,2,0,0,0,0|2,0,0]=4 14650 B16R2.2925 Cc1c(cccc1SCc2cscn2)F 62a_100000205941_100011216893 [0,2,0,0,0,0|2,0,0]=4 14651 B16R2.2925 Cc1c(cccc1SCc2cscn2)F 62a_100011216893_100000205941 [0,2,0,0,0,0|2,0,0]=4 14652 B16R2.2925 Cc1c(cccc1SCc2cscn2)N 62a_100000205941_100000761887 [0,2,0,0,0,0|2,0,0]=4 14653 B16R2.2925 Cc1c(cccc1SCc2cscn2)N 62a_100000761887_100000205941 [0,2,0,0,0,0|2,0,0]=4 14654 B16R2.2925 Cc1c(cccc1SCc2cscn2)O 62a_100000205941_100012002258 [0,2,0,0,0,0|2,0,0]=4 14655 B16R2.2925 Cc1c(cccc1SCc2cscn2)O 62a_100012002258_100000205941 [0,2,0,0,0,0|2,0,0]=4 14656 B16R2.2925 Cc1c(ccnc1Cl)SCc2c[nH]cn2 62a_100000047055_100000707719 [0,2,0,0,0,0|2,0,0]=4 14657 B16R2.2925 Cc1c(ccnc1Cl)SCc2c[nH]cn2 62a_100000707719_100000047055 [0,2,0,0,0,0|2,0,0]=4 14658 B16R2.2925 Cc1c(ccnc1F)NCc2c[nH]cn2 27a_100000758547_100010006593 [0,2,0,0,0,0|1,0,0]=3 14659 B16R2.2925 Cc1c(ccnc1F)NCc2c[nH]nn2 27a_100020620823_100010006593 [0,2,0,0,0,0|2,0,0]=4 14660 B16R2.2925 Cc1c(ccnc1F)NCc2cocn2 27a_100015188801_100010006593 [0,2,0,0,0,0|2,0,0]=4 14661 B16R2.2925 Cc1c(ccnc1F)NCc2cscn2 27a_100015185402_100010006593 [0,2,0,0,0,0|2,0,0]=4 14662 B16R2.2925 Cc1c(ccnc1F)SCc2c[nH]cn2 62a_100000707719_100010006593 [0,2,0,0,0,0|2,0,0]=4 14663 B16R2.2925 Cc1c(ccnc1F)SCc2c[nH]cn2 62a_100010006593_100000707719 [0,2,0,0,0,0|2,0,0]=4 14664 B16R2.2925 Cc1c(ccnc1N)SCc2c[nH]cn2 62a_100000707719_100009865460 [0,2,0,0,0,0|2,0,0]=4 14665 B16R2.2925 Cc1c(ccnc1N)SCc2c[nH]cn2 62a_100009865460_100000707719 [0,2,0,0,0,0|2,0,0]=4 14666 B16R2.2925 Cc1c(ccnc1NCc2c[nH]cn2)F 27a_100000758547_100009846374 [0,2,0,0,0,0|1,0,0]=3 14667 B16R2.2925 Cc1c(ccnc1NCc2c[nH]nn2)F 27a_100020620823_100009846374 [0,2,0,0,0,0|2,0,0]=4 14668 B16R2.2925 Cc1c(ccnc1NCc2cocn2)F 27a_100015188801_100009846374 [0,2,0,0,0,0|2,0,0]=4 14669 B16R2.2925 Cc1c(ccnc1NCc2cscn2)F 27a_100015185402_100009846374 [0,2,0,0,0,0|2,0,0]=4 14670 B16R2.2925 Cc1c(ccnc1O)SCc2c[nH]cn2 62a_100000707719_100009858498 [0,2,0,0,0,0|2,0,0]=4 14671 B16R2.2925 Cc1c(ccnc1O)SCc2c[nH]cn2 62a_100009858498_100000707719 [0,2,0,0,0,0|2,0,0]=4 14672 B16R2.2925 Cc1c(ccnc1OCc2c[nH]cn2)Br 34a_100009858498_100000707719 [0,2,0,0,0,0|2,0,0]=4 14673 B16R2.2925 Cc1c(ccnc1SCc2c[nH]cn2)F 62a_100000707719_100009846374 [0,2,0,0,0,0|2,0,0]=4 14674 B16R2.2925 Cc1c(ccnc1SCc2c[nH]cn2)F 62a_100009846374_100000707719 [0,2,0,0,0,0|2,0,0]=4 14675 B16R2.2925 Cc1c(ccnc1SCc2c[nH]cn2)N 62a_100000690622_100000707719 [0,2,0,0,0,0|2,0,0]=4 14676 B16R2.2925 Cc1c(ccnc1SCc2c[nH]cn2)N 62a_100000707719_100000690622 [0,2,0,0,0,0|2,0,0]=4 14677 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)Br 62a_100000707719_100010109657 [0,2,0,0,0,0|2,0,0]=4 14678 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)Br 62a_100010109657_100000707719 [0,2,0,0,0,0|2,0,0]=4 14679 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)F 62a_100000707719_100009881546 [0,2,0,0,0,0|2,0,0]=4 14680 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)F 62a_100009881546_100000707719 [0,2,0,0,0,0|2,0,0]=4 14681 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)N 62a_100000707719_100011998293 [0,2,0,0,0,0|2,0,0]=4 14682 B16R2.2925 Cc1c(cncc1SCc2c[nH]cn2)N 62a_100011998293_100000707719 [0,2,0,0,0,0|2,0,0]=4 14683 B16R2.2925 Cc1c(ncnc1NCc2c[nH]cn2)N 27a_100000758547_100011913465 [0,2,0,0,0,0|2,0,0]=4 14684 B16R2.2925 Cc1c(ncnc1NCc2c[nH]cn2)O 27a_100000758547_100011912821 [0,2,0,0,0,0|2,0,0]=4 14685 B16R2.2925 Cc1cccc(c1Br)CSc2c[nH]cn2 62a_100000756875_200012349612 [0,2,0,0,0,0|2,0,0]=4 14686 B16R2.2925 Cc1cccc(c1Br)CSc2c[nH]cn2 62a_200012349612_100000756875 [0,2,0,0,0,0|2,0,0]=4 14687 B16R2.2925 Cc1cccc(c1Br)NCc2c[nH]cn2 34a_100000684715_100000707719 [0,2,0,0,0,0|0,0,0]=2 14688 B16R2.2925 Cc1cccc(c1Br)NCc2ccon2 34a_100000684715_100000234950 [0,2,0,0,0,0|2,0,0]=4 14689 B16R2.2925 Cc1cccc(c1Br)NCc2ccsc2 34a_100000684715_100011261437 [0,2,0,0,0,0|2,0,0]=4 14690 B16R2.2925 Cc1cccc(c1Br)NCc2cncs2 34a_100000684715_100015185245 [0,2,0,0,0,0|1,0,1]=4 14691 B16R2.2925 Cc1cccc(c1Br)NCc2cscn2 34a_100000684715_100000205941 [0,2,0,0,0,0|1,0,0]=3 14692 B16R2.2925 Cc1cccc(c1Br)NCc2ncc[nH]2 34a_100000684715_100016991755 [0,2,0,0,0,0|2,0,0]=4 14693 B16R2.2925 Cc1cccc(c1Br)NCc2ncco2 34a_100000684715_103436540062 [0,2,0,0,0,0|2,0,0]=4 14694 B16R2.2925 Cc1cccc(c1Br)NCc2nccs2 34a_100000684715_100015184050 [0,2,0,0,0,0|2,0,0]=4 14695 B16R2.2925 Cc1cccc(c1Br)NCc2ncon2 34a_100000684715_100000233494 [0,2,0,0,0,0|2,0,0]=4 14696 B16R2.2925 Cc1cccc(c1Br)NCn2cncn2 34a_100000684715_200020645497 [0,2,0,0,0,0|1,0,1]=4 14697 B16R2.2925 Cc1cccc(c1Br)OCc2c[nH]cn2 34a_100000686692_100000707719 [0,2,0,0,0,0|1,0,0]=3 14698 B16R2.2925 Cc1cccc(c1Br)OCc2cscn2 34a_100000686692_100000205941 [0,2,0,0,0,0|2,0,0]=4 14699 B16R2.2925 Cc1cccc(c1Br)OCc2cscn2 7a_100000686692_100000205941 [0,2,0,0,0,0|2,0,0]=4 14700 B16R2.2925 Cc1cccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100012362457 [0,2,0,0,0,0|1,0,0]=3 14701 B16R2.2925 Cc1cccc(c1Br)SCc2c[nH]cn2 62a_100012362457_100000707719 [0,2,0,0,0,0|1,0,0]=3 14702 B16R2.2925 Cc1cccc(c1Br)SCc2cscn2 62a_100000205941_100012362457 [0,2,0,0,0,0|2,0,0]=4 14703 B16R2.2925 Cc1cccc(c1Br)SCc2cscn2 62a_100012362457_100000205941 [0,2,0,0,0,0|2,0,0]=4 14704 B16R2.2925 Cc1cccc(c1C)CSc2c[nH]cn2 62a_100000756875_100011515928 [0,2,0,0,0,0|2,0,0]=4 14705 B16R2.2925 Cc1cccc(c1C)CSc2c[nH]cn2 62a_100011515928_100000756875 [0,2,0,0,0,0|2,0,0]=4 14706 B16R2.2925 Cc1cccc(c1C)NCc2c[nH]cn2 2230a_100000210026_100000707719 [0,2,0,0,0,0|0,0,0]=2 14707 B16R2.2925 Cc1cccc(c1C)NCc2c[nH]cn2 34a_100000210026_100000707719 [0,2,0,0,0,0|0,0,0]=2 14708 B16R2.2925 Cc1cccc(c1C)NCc2cc[nH]n2 207a_100000210026_100000738523 [0,2,0,0,0,0|2,0,0]=4 14709 B16R2.2925 Cc1cccc(c1C)NCc2ccco2 207a_100000210026_100000186105 [0,2,0,0,0,0|2,0,0]=4 14710 B16R2.2925 Cc1cccc(c1C)NCc2ccco2 270302a_100000210026_100000186105 [0,2,0,0,0,0|2,0,0]=4 14711 B16R2.2925 Cc1cccc(c1C)NCc2cccs2 207a_100000210026_100000209959 [0,2,0,0,0,0|2,0,0]=4 14712 B16R2.2925 Cc1cccc(c1C)NCc2cccs2 270302a_100000210026_100000209959 [0,2,0,0,0,0|2,0,0]=4 14713 B16R2.2925 Cc1cccc(c1C)NCc2ccoc2 207a_100000210026_100011215517 [0,2,0,0,0,0|2,0,0]=4 14714 B16R2.2925 Cc1cccc(c1C)NCc2ccon2 2230a_100000210026_100000234950 [0,2,0,0,0,0|2,0,0]=4 14715 B16R2.2925 Cc1cccc(c1C)NCc2ccon2 34a_100000210026_100000234950 [0,2,0,0,0,0|2,0,0]=4 14716 B16R2.2925 Cc1cccc(c1C)NCc2ccon2 7a_100000210026_100000234950 [0,2,0,0,0,0|2,0,0]=4 14717 B16R2.2925 Cc1cccc(c1C)NCc2ccsc2 207a_100000210026_100000188534 [0,2,0,0,0,0|2,0,0]=4 14718 B16R2.2925 Cc1cccc(c1C)NCc2ccsc2 2230a_100000210026_100011261437 [0,2,0,0,0,0|2,0,0]=4 14719 B16R2.2925 Cc1cccc(c1C)NCc2ccsc2 270302a_100000210026_100000188534 [0,2,0,0,0,0|2,0,0]=4 14720 B16R2.2925 Cc1cccc(c1C)NCc2ccsc2 34a_100000210026_100011261437 [0,2,0,0,0,0|2,0,0]=4 14721 B16R2.2925 Cc1cccc(c1C)NCc2ccsc2 7a_100000210026_100011261437 [0,2,0,0,0,0|2,0,0]=4 14722 B16R2.2925 Cc1cccc(c1C)NCc2cn[nH]c2 207a_100000210026_100016992096 [0,2,0,0,0,0|2,0,0]=4 14723 B16R2.2925 Cc1cccc(c1C)NCc2cn[nH]c2 270302a_100000210026_100016992096 [0,2,0,0,0,0|2,0,0]=4 14724 B16R2.2925 Cc1cccc(c1C)NCc2cnc[nH]2 207a_100000210026_100000742939 [0,2,0,0,0,0|0,0,2]=4 14725 B16R2.2925 Cc1cccc(c1C)NCc2cncs2 207a_100000210026_100000749870 [0,2,0,0,0,0|1,0,1]=4 14726 B16R2.2925 Cc1cccc(c1C)NCc2cncs2 2230a_100000210026_100015185245 [0,2,0,0,0,0|1,0,1]=4 14727 B16R2.2925 Cc1cccc(c1C)NCc2cncs2 270302a_100000210026_100000749870 [0,2,0,0,0,0|1,0,1]=4 14728 B16R2.2925 Cc1cccc(c1C)NCc2cncs2 34a_100000210026_100015185245 [0,2,0,0,0,0|1,0,1]=4 14729 B16R2.2925 Cc1cccc(c1C)NCc2cncs2 7a_100000210026_100015185245 [0,2,0,0,0,0|1,0,1]=4 14730 B16R2.2925 Cc1cccc(c1C)NCc2cscn2 207a_100000210026_100000743575 [0,2,0,0,0,0|1,0,0]=3 14731 B16R2.2925 Cc1cccc(c1C)NCc2cscn2 2230a_100000210026_100000205941 [0,2,0,0,0,0|1,0,0]=3 14732 B16R2.2925 Cc1cccc(c1C)NCc2cscn2 270302a_100000210026_100000743575 [0,2,0,0,0,0|1,0,0]=3 14733 B16R2.2925 Cc1cccc(c1C)NCc2cscn2 34a_100000210026_100000205941 [0,2,0,0,0,0|1,0,0]=3 14734 B16R2.2925 Cc1cccc(c1C)NCc2cscn2 7a_100000210026_100000205941 [0,2,0,0,0,0|1,0,0]=3 14735 B16R2.2925 Cc1cccc(c1C)NCc2ncc[nH]2 207a_100000210026_100000743867 [0,2,0,0,0,0|2,0,0]=4 14736 B16R2.2925 Cc1cccc(c1C)NCc2ncc[nH]2 2230a_100000210026_100016991755 [0,2,0,0,0,0|2,0,0]=4 14737 B16R2.2925 Cc1cccc(c1C)NCc2ncc[nH]2 34a_100000210026_100016991755 [0,2,0,0,0,0|2,0,0]=4 14738 B16R2.2925 Cc1cccc(c1C)NCc2ncc[nH]2 7a_100000210026_100000753453 [0,2,0,0,0,0|2,0,0]=4 14739 B16R2.2925 Cc1cccc(c1C)NCc2ncco2 2230a_100000210026_103436540062 [0,2,0,0,0,0|2,0,0]=4 14740 B16R2.2925 Cc1cccc(c1C)NCc2ncco2 34a_100000210026_103436540062 [0,2,0,0,0,0|2,0,0]=4 14741 B16R2.2925 Cc1cccc(c1C)NCc2ncco2 7a_100000210026_103436540062 [0,2,0,0,0,0|2,0,0]=4 14742 B16R2.2925 Cc1cccc(c1C)NCc2nccs2 207a_100000210026_100000750902 [0,2,0,0,0,0|2,0,0]=4 14743 B16R2.2925 Cc1cccc(c1C)NCc2nccs2 2230a_100000210026_100015184050 [0,2,0,0,0,0|2,0,0]=4 14744 B16R2.2925 Cc1cccc(c1C)NCc2nccs2 270302a_100000210026_100000750902 [0,2,0,0,0,0|2,0,0]=4 14745 B16R2.2925 Cc1cccc(c1C)NCc2nccs2 34a_100000210026_100015184050 [0,2,0,0,0,0|2,0,0]=4 14746 B16R2.2925 Cc1cccc(c1C)NCc2nccs2 7a_100000210026_100015184050 [0,2,0,0,0,0|2,0,0]=4 14747 B16R2.2925 Cc1cccc(c1C)NCc2ncon2 34a_100000210026_100000233494 [0,2,0,0,0,0|2,0,0]=4 14748 B16R2.2925 Cc1cccc(c1C)NCn2cncn2 2230a_100000210026_200020645497 [0,2,0,0,0,0|1,0,1]=4 14749 B16R2.2925 Cc1cccc(c1C)NCn2cncn2 34a_100000210026_200020645497 [0,2,0,0,0,0|1,0,1]=4 14750 B16R2.2925 Cc1cccc(c1C)NCn2cncn2 7a_100000210026_200020645497 [0,2,0,0,0,0|1,0,1]=4 14751 B16R2.2925 Cc1cccc(c1C)OCc2c[nH]cn2 34a_100000185855_100000707719 [0,2,0,0,0,0|1,0,0]=3 14752 B16R2.2925 Cc1cccc(c1C)OCc2cscn2 34a_100000185855_100000205941 [0,2,0,0,0,0|2,0,0]=4 14753 B16R2.2925 Cc1cccc(c1C)OCc2cscn2 7a_100000185855_100000205941 [0,2,0,0,0,0|2,0,0]=4 14754 B16R2.2925 Cc1cccc(c1C)SCc2c[nH]cn2 62a_100000707719_100011214922 [0,2,0,0,0,0|1,0,0]=3 14755 B16R2.2925 Cc1cccc(c1C)SCc2c[nH]cn2 62a_100011214922_100000707719 [0,2,0,0,0,0|1,0,0]=3 14756 B16R2.2925 Cc1cccc(c1C)SCc2cscn2 62a_100000205941_100011214922 [0,2,0,0,0,0|2,0,0]=4 14757 B16R2.2925 Cc1cccc(c1C)SCc2cscn2 62a_100011214922_100000205941 [0,2,0,0,0,0|2,0,0]=4 14758 B16R2.2925 Cc1cccc(c1Cl)NCc2c[nH]cn2 34a_100000765562_100000707719 [0,2,0,0,0,0|0,0,0]=2 14759 B16R2.2925 Cc1cccc(c1Cl)NCc2cc[nH]n2 207a_100000765562_100000738523 [0,2,0,0,0,0|2,0,0]=4 14760 B16R2.2925 Cc1cccc(c1Cl)NCc2ccco2 207a_100000765562_100000186105 [0,2,0,0,0,0|2,0,0]=4 14761 B16R2.2925 Cc1cccc(c1Cl)NCc2ccco2 270302a_100000765562_100000186105 [0,2,0,0,0,0|2,0,0]=4 14762 B16R2.2925 Cc1cccc(c1Cl)NCc2cccs2 207a_100000765562_100000209959 [0,2,0,0,0,0|2,0,0]=4 14763 B16R2.2925 Cc1cccc(c1Cl)NCc2cccs2 270302a_100000765562_100000209959 [0,2,0,0,0,0|2,0,0]=4 14764 B16R2.2925 Cc1cccc(c1Cl)NCc2ccoc2 207a_100000765562_100011215517 [0,2,0,0,0,0|2,0,0]=4 14765 B16R2.2925 Cc1cccc(c1Cl)NCc2ccon2 34a_100000765562_100000234950 [0,2,0,0,0,0|2,0,0]=4 14766 B16R2.2925 Cc1cccc(c1Cl)NCc2ccon2 7a_100000765562_100000234950 [0,2,0,0,0,0|2,0,0]=4 14767 B16R2.2925 Cc1cccc(c1Cl)NCc2ccsc2 207a_100000765562_100000188534 [0,2,0,0,0,0|2,0,0]=4 14768 B16R2.2925 Cc1cccc(c1Cl)NCc2ccsc2 270302a_100000765562_100000188534 [0,2,0,0,0,0|2,0,0]=4 14769 B16R2.2925 Cc1cccc(c1Cl)NCc2ccsc2 34a_100000765562_100011261437 [0,2,0,0,0,0|2,0,0]=4 14770 B16R2.2925 Cc1cccc(c1Cl)NCc2ccsc2 7a_100000765562_100011261437 [0,2,0,0,0,0|2,0,0]=4 14771 B16R2.2925 Cc1cccc(c1Cl)NCc2cn[nH]c2 207a_100000765562_100016992096 [0,2,0,0,0,0|2,0,0]=4 14772 B16R2.2925 Cc1cccc(c1Cl)NCc2cn[nH]c2 270302a_100000765562_100016992096 [0,2,0,0,0,0|2,0,0]=4 14773 B16R2.2925 Cc1cccc(c1Cl)NCc2cnc[nH]2 207a_100000765562_100000742939 [0,2,0,0,0,0|0,0,2]=4 14774 B16R2.2925 Cc1cccc(c1Cl)NCc2cncs2 207a_100000765562_100000749870 [0,2,0,0,0,0|1,0,1]=4 14775 B16R2.2925 Cc1cccc(c1Cl)NCc2cncs2 270302a_100000765562_100000749870 [0,2,0,0,0,0|1,0,1]=4 14776 B16R2.2925 Cc1cccc(c1Cl)NCc2cncs2 34a_100000765562_100015185245 [0,2,0,0,0,0|1,0,1]=4 14777 B16R2.2925 Cc1cccc(c1Cl)NCc2cncs2 7a_100000765562_100015185245 [0,2,0,0,0,0|1,0,1]=4 14778 B16R2.2925 Cc1cccc(c1Cl)NCc2cscn2 207a_100000765562_100000743575 [0,2,0,0,0,0|1,0,0]=3 14779 B16R2.2925 Cc1cccc(c1Cl)NCc2cscn2 270302a_100000765562_100000743575 [0,2,0,0,0,0|1,0,0]=3 14780 B16R2.2925 Cc1cccc(c1Cl)NCc2cscn2 34a_100000765562_100000205941 [0,2,0,0,0,0|1,0,0]=3 14781 B16R2.2925 Cc1cccc(c1Cl)NCc2cscn2 7a_100000765562_100000205941 [0,2,0,0,0,0|1,0,0]=3 14782 B16R2.2925 Cc1cccc(c1Cl)NCc2ncc[nH]2 207a_100000765562_100000743867 [0,2,0,0,0,0|2,0,0]=4 14783 B16R2.2925 Cc1cccc(c1Cl)NCc2ncc[nH]2 34a_100000765562_100016991755 [0,2,0,0,0,0|2,0,0]=4 14784 B16R2.2925 Cc1cccc(c1Cl)NCc2ncc[nH]2 7a_100000765562_100000753453 [0,2,0,0,0,0|2,0,0]=4 14785 B16R2.2925 Cc1cccc(c1Cl)NCc2ncco2 34a_100000765562_103436540062 [0,2,0,0,0,0|2,0,0]=4 14786 B16R2.2925 Cc1cccc(c1Cl)NCc2ncco2 7a_100000765562_103436540062 [0,2,0,0,0,0|2,0,0]=4 14787 B16R2.2925 Cc1cccc(c1Cl)NCc2nccs2 207a_100000765562_100000750902 [0,2,0,0,0,0|2,0,0]=4 14788 B16R2.2925 Cc1cccc(c1Cl)NCc2nccs2 270302a_100000765562_100000750902 [0,2,0,0,0,0|2,0,0]=4 14789 B16R2.2925 Cc1cccc(c1Cl)NCc2nccs2 34a_100000765562_100015184050 [0,2,0,0,0,0|2,0,0]=4 14790 B16R2.2925 Cc1cccc(c1Cl)NCc2nccs2 7a_100000765562_100015184050 [0,2,0,0,0,0|2,0,0]=4 14791 B16R2.2925 Cc1cccc(c1Cl)NCc2ncon2 34a_100000765562_100000233494 [0,2,0,0,0,0|2,0,0]=4 14792 B16R2.2925 Cc1cccc(c1Cl)NCn2cncn2 34a_100000765562_200020645497 [0,2,0,0,0,0|1,0,1]=4 14793 B16R2.2925 Cc1cccc(c1Cl)NCn2cncn2 7a_100000765562_200020645497 [0,2,0,0,0,0|1,0,1]=4 14794 B16R2.2925 Cc1cccc(c1Cl)OCc2c[nH]cn2 34a_100000695629_100000707719 [0,2,0,0,0,0|1,0,0]=3 14795 B16R2.2925 Cc1cccc(c1Cl)OCc2cscn2 34a_100000695629_100000205941 [0,2,0,0,0,0|2,0,0]=4 14796 B16R2.2925 Cc1cccc(c1Cl)OCc2cscn2 7a_100000695629_100000205941 [0,2,0,0,0,0|2,0,0]=4 14797 B16R2.2925 Cc1cccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_200012352035 [0,2,0,0,0,0|1,0,0]=3 14798 B16R2.2925 Cc1cccc(c1Cl)SCc2c[nH]cn2 62a_200012352035_100000707719 [0,2,0,0,0,0|1,0,0]=3 14799 B16R2.2925 Cc1cccc(c1Cl)SCc2cscn2 62a_100000205941_200012352035 [0,2,0,0,0,0|2,0,0]=4 14800 B16R2.2925 Cc1cccc(c1Cl)SCc2cscn2 62a_200012352035_100000205941 [0,2,0,0,0,0|2,0,0]=4 14801 B16R2.2925 Cc1cccc(c1F)CSc2c[nH]cn2 62a_100000756875_100011216058 [0,2,0,0,0,0|2,0,0]=4 14802 B16R2.2925 Cc1cccc(c1F)CSc2c[nH]cn2 62a_100011216058_100000756875 [0,2,0,0,0,0|2,0,0]=4 14803 B16R2.2925 Cc1cccc(c1F)NCc2c[nH]cn2 2230a_100000697159_100000707719 [0,2,0,0,0,0|0,0,0]=2 14804 B16R2.2925 Cc1cccc(c1F)NCc2c[nH]cn2 34a_100000697159_100000707719 [0,2,0,0,0,0|0,0,0]=2 14805 B16R2.2925 Cc1cccc(c1F)NCc2cc[nH]n2 207a_100000697159_100000738523 [0,2,0,0,0,0|2,0,0]=4 14806 B16R2.2925 Cc1cccc(c1F)NCc2ccco2 207a_100000697159_100000186105 [0,2,0,0,0,0|2,0,0]=4 14807 B16R2.2925 Cc1cccc(c1F)NCc2ccco2 270302a_100000697159_100000186105 [0,2,0,0,0,0|2,0,0]=4 14808 B16R2.2925 Cc1cccc(c1F)NCc2cccs2 207a_100000697159_100000209959 [0,2,0,0,0,0|2,0,0]=4 14809 B16R2.2925 Cc1cccc(c1F)NCc2cccs2 270302a_100000697159_100000209959 [0,2,0,0,0,0|2,0,0]=4 14810 B16R2.2925 Cc1cccc(c1F)NCc2ccoc2 207a_100000697159_100011215517 [0,2,0,0,0,0|2,0,0]=4 14811 B16R2.2925 Cc1cccc(c1F)NCc2ccon2 2230a_100000697159_100000234950 [0,2,0,0,0,0|2,0,0]=4 14812 B16R2.2925 Cc1cccc(c1F)NCc2ccon2 34a_100000697159_100000234950 [0,2,0,0,0,0|2,0,0]=4 14813 B16R2.2925 Cc1cccc(c1F)NCc2ccon2 7a_100000697159_100000234950 [0,2,0,0,0,0|2,0,0]=4 14814 B16R2.2925 Cc1cccc(c1F)NCc2ccsc2 207a_100000697159_100000188534 [0,2,0,0,0,0|2,0,0]=4 14815 B16R2.2925 Cc1cccc(c1F)NCc2ccsc2 2230a_100000697159_100011261437 [0,2,0,0,0,0|2,0,0]=4 14816 B16R2.2925 Cc1cccc(c1F)NCc2ccsc2 270302a_100000697159_100000188534 [0,2,0,0,0,0|2,0,0]=4 14817 B16R2.2925 Cc1cccc(c1F)NCc2ccsc2 34a_100000697159_100011261437 [0,2,0,0,0,0|2,0,0]=4 14818 B16R2.2925 Cc1cccc(c1F)NCc2ccsc2 7a_100000697159_100011261437 [0,2,0,0,0,0|2,0,0]=4 14819 B16R2.2925 Cc1cccc(c1F)NCc2cn[nH]c2 207a_100000697159_100016992096 [0,2,0,0,0,0|2,0,0]=4 14820 B16R2.2925 Cc1cccc(c1F)NCc2cn[nH]c2 270302a_100000697159_100016992096 [0,2,0,0,0,0|2,0,0]=4 14821 B16R2.2925 Cc1cccc(c1F)NCc2cnc[nH]2 207a_100000697159_100000742939 [0,2,0,0,0,0|0,0,2]=4 14822 B16R2.2925 Cc1cccc(c1F)NCc2cncs2 207a_100000697159_100000749870 [0,2,0,0,0,0|1,0,1]=4 14823 B16R2.2925 Cc1cccc(c1F)NCc2cncs2 2230a_100000697159_100015185245 [0,2,0,0,0,0|1,0,1]=4 14824 B16R2.2925 Cc1cccc(c1F)NCc2cncs2 270302a_100000697159_100000749870 [0,2,0,0,0,0|1,0,1]=4 14825 B16R2.2925 Cc1cccc(c1F)NCc2cncs2 34a_100000697159_100015185245 [0,2,0,0,0,0|1,0,1]=4 14826 B16R2.2925 Cc1cccc(c1F)NCc2cncs2 7a_100000697159_100015185245 [0,2,0,0,0,0|1,0,1]=4 14827 B16R2.2925 Cc1cccc(c1F)NCc2cscn2 207a_100000697159_100000743575 [0,2,0,0,0,0|1,0,0]=3 14828 B16R2.2925 Cc1cccc(c1F)NCc2cscn2 2230a_100000697159_100000205941 [0,2,0,0,0,0|1,0,0]=3 14829 B16R2.2925 Cc1cccc(c1F)NCc2cscn2 270302a_100000697159_100000743575 [0,2,0,0,0,0|1,0,0]=3 14830 B16R2.2925 Cc1cccc(c1F)NCc2cscn2 34a_100000697159_100000205941 [0,2,0,0,0,0|1,0,0]=3 14831 B16R2.2925 Cc1cccc(c1F)NCc2cscn2 7a_100000697159_100000205941 [0,2,0,0,0,0|1,0,0]=3 14832 B16R2.2925 Cc1cccc(c1F)NCc2ncc[nH]2 207a_100000697159_100000743867 [0,2,0,0,0,0|2,0,0]=4 14833 B16R2.2925 Cc1cccc(c1F)NCc2ncc[nH]2 2230a_100000697159_100016991755 [0,2,0,0,0,0|2,0,0]=4 14834 B16R2.2925 Cc1cccc(c1F)NCc2ncc[nH]2 34a_100000697159_100016991755 [0,2,0,0,0,0|2,0,0]=4 14835 B16R2.2925 Cc1cccc(c1F)NCc2ncc[nH]2 7a_100000697159_100000753453 [0,2,0,0,0,0|2,0,0]=4 14836 B16R2.2925 Cc1cccc(c1F)NCc2ncco2 2230a_100000697159_103436540062 [0,2,0,0,0,0|2,0,0]=4 14837 B16R2.2925 Cc1cccc(c1F)NCc2ncco2 34a_100000697159_103436540062 [0,2,0,0,0,0|2,0,0]=4 14838 B16R2.2925 Cc1cccc(c1F)NCc2ncco2 7a_100000697159_103436540062 [0,2,0,0,0,0|2,0,0]=4 14839 B16R2.2925 Cc1cccc(c1F)NCc2nccs2 207a_100000697159_100000750902 [0,2,0,0,0,0|2,0,0]=4 14840 B16R2.2925 Cc1cccc(c1F)NCc2nccs2 2230a_100000697159_100015184050 [0,2,0,0,0,0|2,0,0]=4 14841 B16R2.2925 Cc1cccc(c1F)NCc2nccs2 270302a_100000697159_100000750902 [0,2,0,0,0,0|2,0,0]=4 14842 B16R2.2925 Cc1cccc(c1F)NCc2nccs2 34a_100000697159_100015184050 [0,2,0,0,0,0|2,0,0]=4 14843 B16R2.2925 Cc1cccc(c1F)NCc2nccs2 7a_100000697159_100015184050 [0,2,0,0,0,0|2,0,0]=4 14844 B16R2.2925 Cc1cccc(c1F)NCc2ncon2 34a_100000697159_100000233494 [0,2,0,0,0,0|2,0,0]=4 14845 B16R2.2925 Cc1cccc(c1F)NCn2cncn2 2230a_100000697159_200020645497 [0,2,0,0,0,0|1,0,1]=4 14846 B16R2.2925 Cc1cccc(c1F)NCn2cncn2 34a_100000697159_200020645497 [0,2,0,0,0,0|1,0,1]=4 14847 B16R2.2925 Cc1cccc(c1F)NCn2cncn2 7a_100000697159_200020645497 [0,2,0,0,0,0|1,0,1]=4 14848 B16R2.2925 Cc1cccc(c1F)OCc2c[nH]cn2 34a_100000751311_100000707719 [0,2,0,0,0,0|1,0,0]=3 14849 B16R2.2925 Cc1cccc(c1F)OCc2cscn2 34a_100000751311_100000205941 [0,2,0,0,0,0|2,0,0]=4 14850 B16R2.2925 Cc1cccc(c1F)OCc2cscn2 7a_100000751311_100000205941 [0,2,0,0,0,0|2,0,0]=4 14851 B16R2.2925 Cc1cccc(c1F)SCc2c[nH]cn2 62a_100000707719_100000717567 [0,2,0,0,0,0|1,0,0]=3 14852 B16R2.2925 Cc1cccc(c1F)SCc2c[nH]cn2 62a_100000717567_100000707719 [0,2,0,0,0,0|1,0,0]=3 14853 B16R2.2925 Cc1cccc(c1F)SCc2cscn2 62a_100000205941_100000717567 [0,2,0,0,0,0|2,0,0]=4 14854 B16R2.2925 Cc1cccc(c1F)SCc2cscn2 62a_100000717567_100000205941 [0,2,0,0,0,0|2,0,0]=4 14855 B16R2.2925 Cc1cccc(c1I)NCc2c[nH]cn2 34a_100000761888_100000707719 [0,2,0,0,0,0|0,0,0]=2 14856 B16R2.2925 Cc1cccc(c1I)NCc2ccon2 34a_100000761888_100000234950 [0,2,0,0,0,0|2,0,0]=4 14857 B16R2.2925 Cc1cccc(c1I)NCc2ccsc2 34a_100000761888_100011261437 [0,2,0,0,0,0|2,0,0]=4 14858 B16R2.2925 Cc1cccc(c1I)NCc2cncs2 34a_100000761888_100015185245 [0,2,0,0,0,0|1,0,1]=4 14859 B16R2.2925 Cc1cccc(c1I)NCc2cscn2 34a_100000761888_100000205941 [0,2,0,0,0,0|1,0,0]=3 14860 B16R2.2925 Cc1cccc(c1I)NCc2ncc[nH]2 34a_100000761888_100016991755 [0,2,0,0,0,0|2,0,0]=4 14861 B16R2.2925 Cc1cccc(c1I)NCc2ncco2 34a_100000761888_103436540062 [0,2,0,0,0,0|2,0,0]=4 14862 B16R2.2925 Cc1cccc(c1I)NCc2nccs2 34a_100000761888_100015184050 [0,2,0,0,0,0|2,0,0]=4 14863 B16R2.2925 Cc1cccc(c1I)NCc2ncon2 34a_100000761888_100000233494 [0,2,0,0,0,0|2,0,0]=4 14864 B16R2.2925 Cc1cccc(c1I)NCn2cncn2 34a_100000761888_200020645497 [0,2,0,0,0,0|1,0,1]=4 14865 B16R2.2925 Cc1cccc(c1I)OCc2c[nH]cn2 34a_100010083724_100000707719 [0,2,0,0,0,0|1,0,0]=3 14866 B16R2.2925 Cc1cccc(c1I)OCc2cscn2 34a_100010083724_100000205941 [0,2,0,0,0,0|2,0,0]=4 14867 B16R2.2925 Cc1cccc(c1I)OCc2cscn2 7a_100010083724_100000205941 [0,2,0,0,0,0|2,0,0]=4 14868 B16R2.2925 Cc1cccc(c1N)OCc2c[nH]cn2 34a_100000743429_100000707719 [0,2,0,0,0,0|1,0,0]=3 14869 B16R2.2925 Cc1cccc(c1N)OCc2cscn2 34a_100000743429_100000205941 [0,2,0,0,0,0|2,0,0]=4 14870 B16R2.2925 Cc1cccc(c1N)OCc2cscn2 7a_100000743429_100000205941 [0,2,0,0,0,0|2,0,0]=4 14871 B16R2.2925 Cc1cccc(c1N)SCc2c[nH]cn2 62a_100000707719_100011834072 [0,2,0,0,0,0|1,0,0]=3 14872 B16R2.2925 Cc1cccc(c1N)SCc2c[nH]cn2 62a_100011834072_100000707719 [0,2,0,0,0,0|1,0,0]=3 14873 B16R2.2925 Cc1cccc(c1N)SCc2cscn2 62a_100000205941_100011834072 [0,2,0,0,0,0|2,0,0]=4 14874 B16R2.2925 Cc1cccc(c1N)SCc2cscn2 62a_100011834072_100000205941 [0,2,0,0,0,0|2,0,0]=4 14875 B16R2.2925 Cc1cccc(c1O)NCc2c[nH]cn2 34a_100000756359_100000707719 [0,2,0,0,0,0|0,0,0]=2 14876 B16R2.2925 Cc1cccc(c1O)NCc2ccco2 270302a_100000756359_100000186105 [0,2,0,0,0,0|2,0,0]=4 14877 B16R2.2925 Cc1cccc(c1O)NCc2cccs2 270302a_100000756359_100000209959 [0,2,0,0,0,0|2,0,0]=4 14878 B16R2.2925 Cc1cccc(c1O)NCc2ccon2 34a_100000756359_100000234950 [0,2,0,0,0,0|2,0,0]=4 14879 B16R2.2925 Cc1cccc(c1O)NCc2ccsc2 270302a_100000756359_100000188534 [0,2,0,0,0,0|2,0,0]=4 14880 B16R2.2925 Cc1cccc(c1O)NCc2ccsc2 34a_100000756359_100011261437 [0,2,0,0,0,0|2,0,0]=4 14881 B16R2.2925 Cc1cccc(c1O)NCc2cn[nH]c2 270302a_100000756359_100016992096 [0,2,0,0,0,0|2,0,0]=4 14882 B16R2.2925 Cc1cccc(c1O)NCc2cncs2 270302a_100000756359_100000749870 [0,2,0,0,0,0|1,0,1]=4 14883 B16R2.2925 Cc1cccc(c1O)NCc2cncs2 34a_100000756359_100015185245 [0,2,0,0,0,0|1,0,1]=4 14884 B16R2.2925 Cc1cccc(c1O)NCc2cscn2 270302a_100000756359_100000743575 [0,2,0,0,0,0|1,0,0]=3 14885 B16R2.2925 Cc1cccc(c1O)NCc2cscn2 34a_100000756359_100000205941 [0,2,0,0,0,0|1,0,0]=3 14886 B16R2.2925 Cc1cccc(c1O)NCc2ncc[nH]2 34a_100000756359_100016991755 [0,2,0,0,0,0|2,0,0]=4 14887 B16R2.2925 Cc1cccc(c1O)NCc2ncco2 34a_100000756359_103436540062 [0,2,0,0,0,0|2,0,0]=4 14888 B16R2.2925 Cc1cccc(c1O)NCc2nccs2 270302a_100000756359_100000750902 [0,2,0,0,0,0|2,0,0]=4 14889 B16R2.2925 Cc1cccc(c1O)NCc2nccs2 34a_100000756359_100015184050 [0,2,0,0,0,0|2,0,0]=4 14890 B16R2.2925 Cc1cccc(c1O)NCc2ncon2 34a_100000756359_100000233494 [0,2,0,0,0,0|2,0,0]=4 14891 B16R2.2925 Cc1cccc(c1O)NCn2cncn2 34a_100000756359_200020645497 [0,2,0,0,0,0|1,0,1]=4 14892 B16R2.2925 Cc1cccc(c1O)SCc2c[nH]cn2 62a_100000707719_100009817157 [0,2,0,0,0,0|1,0,0]=3 14893 B16R2.2925 Cc1cccc(c1O)SCc2c[nH]cn2 62a_100009817157_100000707719 [0,2,0,0,0,0|1,0,0]=3 14894 B16R2.2925 Cc1cccc(c1O)SCc2cscn2 62a_100000205941_100009817157 [0,2,0,0,0,0|2,0,0]=4 14895 B16R2.2925 Cc1cccc(c1O)SCc2cscn2 62a_100009817157_100000205941 [0,2,0,0,0,0|2,0,0]=4 14896 B16R2.2925 Cc1ccnc(c1Br)OCc2c[nH]cn2 34a_100012000493_100000707719 [0,2,0,0,0,0|2,0,0]=4 14897 B16R2.2925 Cc1ccnc(c1C)SCc2c[nH]cn2 62a_100000707719_100009847204 [0,2,0,0,0,0|2,0,0]=4 14898 B16R2.2925 Cc1ccnc(c1C)SCc2c[nH]cn2 62a_100009847204_100000707719 [0,2,0,0,0,0|2,0,0]=4 14899 B16R2.2925 Cc1ccnc(c1F)SCc2c[nH]cn2 62a_100000707719_100009817629 [0,2,0,0,0,0|2,0,0]=4 14900 B16R2.2925 Cc1ccnc(c1F)SCc2c[nH]cn2 62a_100009817629_100000707719 [0,2,0,0,0,0|2,0,0]=4 14901 B16R2.2925 Cc1ccnc(c1N)SCc2c[nH]cn2 62a_100000707719_100000763560 [0,2,0,0,0,0|2,0,0]=4 14902 B16R2.2925 Cc1ccnc(c1N)SCc2c[nH]cn2 62a_100000763560_100000707719 [0,2,0,0,0,0|2,0,0]=4 14903 B16R2.2925 Cc1ccnc(c1O)SCc2c[nH]cn2 62a_100000707719_100000696282 [0,2,0,0,0,0|2,0,0]=4 14904 B16R2.2925 Cc1cncc(c1C)SCc2c[nH]cn2 62a_100000707719_100009864703 [0,2,0,0,0,0|2,0,0]=4 14905 B16R2.2925 Cc1cncc(c1C)SCc2c[nH]cn2 62a_100009864703_100000707719 [0,2,0,0,0,0|2,0,0]=4 14906 B16R2.2925 Cc1cncc(c1N)SCc2c[nH]cn2 62a_100000707719_100009818025 [0,2,0,0,0,0|2,0,0]=4 14907 B16R2.2925 Cc1cncc(c1N)SCc2c[nH]cn2 62a_100009818025_100000707719 [0,2,0,0,0,0|2,0,0]=4 14908 B16R2.2925 Cc1nccc(c1C)SCc2c[nH]cn2 62a_100000707719_100009846815 [0,2,0,0,0,0|2,0,0]=4 14909 B16R2.2925 Cc1nccc(c1C)SCc2c[nH]cn2 62a_100009846815_100000707719 [0,2,0,0,0,0|2,0,0]=4 14910 B16R2.2925 Cc1nccc(c1Cl)NCc2c[nH]cn2 27a_100000758547_100000698670 [0,2,0,0,0,0|1,0,0]=3 14911 B16R2.2925 Cc1nccc(c1Cl)NCc2c[nH]nn2 27a_100020620823_100000698670 [0,2,0,0,0,0|2,0,0]=4 14912 B16R2.2925 Cc1nccc(c1Cl)NCc2cocn2 27a_100015188801_100000698670 [0,2,0,0,0,0|2,0,0]=4 14913 B16R2.2925 Cc1nccc(c1Cl)NCc2cscn2 27a_100015185402_100000698670 [0,2,0,0,0,0|2,0,0]=4 14914 B16R2.2925 Cc1nccc(c1Cl)SCc2c[nH]cn2 62a_100000698670_100000707719 [0,2,0,0,0,0|2,0,0]=4 14915 B16R2.2925 Cc1nccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100000698670 [0,2,0,0,0,0|2,0,0]=4 14916 B16R2.2925 Cc1nccc(c1F)NCc2c[nH]cn2 27a_100000758547_100009849794 [0,2,0,0,0,0|1,0,0]=3 14917 B16R2.2925 Cc1nccc(c1F)NCc2c[nH]nn2 27a_100020620823_100009849794 [0,2,0,0,0,0|2,0,0]=4 14918 B16R2.2925 Cc1nccc(c1F)NCc2cocn2 27a_100015188801_100009849794 [0,2,0,0,0,0|2,0,0]=4 14919 B16R2.2925 Cc1nccc(c1F)NCc2cscn2 27a_100015185402_100009849794 [0,2,0,0,0,0|2,0,0]=4 14920 B16R2.2925 Cc1nccc(c1F)SCc2c[nH]cn2 62a_100000707719_100009849794 [0,2,0,0,0,0|2,0,0]=4 14921 B16R2.2925 Cc1nccc(c1F)SCc2c[nH]cn2 62a_100009849794_100000707719 [0,2,0,0,0,0|2,0,0]=4 14922 B16R2.2925 Cc1nccc(c1N)SCc2c[nH]cn2 62a_100000707719_100009885578 [0,2,0,0,0,0|2,0,0]=4 14923 B16R2.2925 Cc1nccc(c1N)SCc2c[nH]cn2 62a_100009885578_100000707719 [0,2,0,0,0,0|2,0,0]=4 14924 B16R2.2925 Cc1ncnc(c1C)NCc2c[nH]cn2 27a_100000758547_100011438038 [0,2,0,0,0,0|2,0,0]=4 14925 B16R2.2925 Cc1ncnc(c1F)NCc2c[nH]cn2 27a_100000758547_100011671633 [0,2,0,0,0,0|2,0,0]=4 14926 B16R2.2925 Clc1c(cccc1CSc2c[nH]cn2)Br 62a_100000756875_100012349491 [0,2,0,0,0,0|2,0,0]=4 14927 B16R2.2925 Clc1c(cccc1CSc2c[nH]cn2)Br 62a_100012349491_100000756875 [0,2,0,0,0,0|2,0,0]=4 14928 B16R2.2925 Clc1c(cccc1NCc2c[nH]cn2)Br 34a_100000687075_100000707719 [0,2,0,0,0,0|0,0,0]=2 14929 B16R2.2925 Clc1c(cccc1NCc2cc[nH]n2)Br 207a_100000687075_100000738523 [0,2,0,0,0,0|2,0,0]=4 14930 B16R2.2925 Clc1c(cccc1NCc2ccco2)Br 207a_100000687075_100000186105 [0,2,0,0,0,0|2,0,0]=4 14931 B16R2.2925 Clc1c(cccc1NCc2ccco2)Br 270302a_100000687075_100000186105 [0,2,0,0,0,0|2,0,0]=4 14932 B16R2.2925 Clc1c(cccc1NCc2cccs2)Br 207a_100000687075_100000209959 [0,2,0,0,0,0|2,0,0]=4 14933 B16R2.2925 Clc1c(cccc1NCc2cccs2)Br 270302a_100000687075_100000209959 [0,2,0,0,0,0|2,0,0]=4 14934 B16R2.2925 Clc1c(cccc1NCc2ccoc2)Br 207a_100000687075_100011215517 [0,2,0,0,0,0|2,0,0]=4 14935 B16R2.2925 Clc1c(cccc1NCc2ccon2)Br 34a_100000687075_100000234950 [0,2,0,0,0,0|2,0,0]=4 14936 B16R2.2925 Clc1c(cccc1NCc2ccsc2)Br 207a_100000687075_100000188534 [0,2,0,0,0,0|2,0,0]=4 14937 B16R2.2925 Clc1c(cccc1NCc2ccsc2)Br 270302a_100000687075_100000188534 [0,2,0,0,0,0|2,0,0]=4 14938 B16R2.2925 Clc1c(cccc1NCc2ccsc2)Br 34a_100000687075_100011261437 [0,2,0,0,0,0|2,0,0]=4 14939 B16R2.2925 Clc1c(cccc1NCc2cn[nH]c2)Br 207a_100000687075_100016992096 [0,2,0,0,0,0|2,0,0]=4 14940 B16R2.2925 Clc1c(cccc1NCc2cn[nH]c2)Br 270302a_100000687075_100016992096 [0,2,0,0,0,0|2,0,0]=4 14941 B16R2.2925 Clc1c(cccc1NCc2cnc[nH]2)Br 207a_100000687075_100000742939 [0,2,0,0,0,0|0,0,2]=4 14942 B16R2.2925 Clc1c(cccc1NCc2cncs2)Br 207a_100000687075_100000749870 [0,2,0,0,0,0|1,0,1]=4 14943 B16R2.2925 Clc1c(cccc1NCc2cncs2)Br 270302a_100000687075_100000749870 [0,2,0,0,0,0|1,0,1]=4 14944 B16R2.2925 Clc1c(cccc1NCc2cncs2)Br 34a_100000687075_100015185245 [0,2,0,0,0,0|1,0,1]=4 14945 B16R2.2925 Clc1c(cccc1NCc2cscn2)Br 207a_100000687075_100000743575 [0,2,0,0,0,0|1,0,0]=3 14946 B16R2.2925 Clc1c(cccc1NCc2cscn2)Br 270302a_100000687075_100000743575 [0,2,0,0,0,0|1,0,0]=3 14947 B16R2.2925 Clc1c(cccc1NCc2cscn2)Br 34a_100000687075_100000205941 [0,2,0,0,0,0|1,0,0]=3 14948 B16R2.2925 Clc1c(cccc1NCc2ncc[nH]2)Br 207a_100000687075_100000743867 [0,2,0,0,0,0|2,0,0]=4 14949 B16R2.2925 Clc1c(cccc1NCc2ncc[nH]2)Br 34a_100000687075_100016991755 [0,2,0,0,0,0|2,0,0]=4 14950 B16R2.2925 Clc1c(cccc1NCc2ncco2)Br 34a_100000687075_103436540062 [0,2,0,0,0,0|2,0,0]=4 14951 B16R2.2925 Clc1c(cccc1NCc2nccs2)Br 207a_100000687075_100000750902 [0,2,0,0,0,0|2,0,0]=4 14952 B16R2.2925 Clc1c(cccc1NCc2nccs2)Br 270302a_100000687075_100000750902 [0,2,0,0,0,0|2,0,0]=4 14953 B16R2.2925 Clc1c(cccc1NCc2nccs2)Br 34a_100000687075_100015184050 [0,2,0,0,0,0|2,0,0]=4 14954 B16R2.2925 Clc1c(cccc1NCc2ncon2)Br 34a_100000687075_100000233494 [0,2,0,0,0,0|2,0,0]=4 14955 B16R2.2925 Clc1c(cccc1NCn2cncn2)Br 34a_100000687075_200020645497 [0,2,0,0,0,0|1,0,1]=4 14956 B16R2.2925 Clc1c(cccc1OCc2c[nH]cn2)Br 34a_100010187913_100000707719 [0,2,0,0,0,0|1,0,0]=3 14957 B16R2.2925 Clc1c(cccc1OCc2c[nH]cn2)I 34a_100000049636_100000707719 [0,2,0,0,0,0|1,0,0]=3 14958 B16R2.2925 Clc1c(cccc1OCc2cscn2)Br 34a_100010187913_100000205941 [0,2,0,0,0,0|2,0,0]=4 14959 B16R2.2925 Clc1c(cccc1OCc2cscn2)Br 7a_100010187913_100000205941 [0,2,0,0,0,0|2,0,0]=4 14960 B16R2.2925 Clc1c(cccc1OCc2cscn2)I 34a_100000049636_100000205941 [0,2,0,0,0,0|2,0,0]=4 14961 B16R2.2925 Clc1c(cccc1OCc2cscn2)I 7a_100000049636_100000205941 [0,2,0,0,0,0|2,0,0]=4 14962 B16R2.2925 Clc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100010142854 [0,2,0,0,0,0|1,0,0]=3 14963 B16R2.2925 Clc1c(cccc1SCc2c[nH]cn2)Br 62a_100010142854_100000707719 [0,2,0,0,0,0|1,0,0]=3 14964 B16R2.2925 Clc1c(cccc1SCc2cscn2)Br 62a_100000205941_100010142854 [0,2,0,0,0,0|2,0,0]=4 14965 B16R2.2925 Clc1c(cccc1SCc2cscn2)Br 62a_100010142854_100000205941 [0,2,0,0,0,0|2,0,0]=4 14966 B16R2.2925 Clc1cccc(c1Br)CSc2c[nH]cn2 62a_100000756875_100010145525 [0,2,0,0,0,0|2,0,0]=4 14967 B16R2.2925 Clc1cccc(c1Br)CSc2c[nH]cn2 62a_100010145525_100000756875 [0,2,0,0,0,0|2,0,0]=4 14968 B16R2.2925 Clc1cccc(c1Br)NCc2c[nH]cn2 34a_100000687072_100000707719 [0,2,0,0,0,0|0,0,0]=2 14969 B16R2.2925 Clc1cccc(c1Br)NCc2ccon2 34a_100000687072_100000234950 [0,2,0,0,0,0|2,0,0]=4 14970 B16R2.2925 Clc1cccc(c1Br)NCc2ccsc2 34a_100000687072_100011261437 [0,2,0,0,0,0|2,0,0]=4 14971 B16R2.2925 Clc1cccc(c1Br)NCc2cncs2 34a_100000687072_100015185245 [0,2,0,0,0,0|1,0,1]=4 14972 B16R2.2925 Clc1cccc(c1Br)NCc2cscn2 34a_100000687072_100000205941 [0,2,0,0,0,0|1,0,0]=3 14973 B16R2.2925 Clc1cccc(c1Br)NCc2ncc[nH]2 34a_100000687072_100016991755 [0,2,0,0,0,0|2,0,0]=4 14974 B16R2.2925 Clc1cccc(c1Br)NCc2ncco2 34a_100000687072_103436540062 [0,2,0,0,0,0|2,0,0]=4 14975 B16R2.2925 Clc1cccc(c1Br)NCc2nccs2 34a_100000687072_100015184050 [0,2,0,0,0,0|2,0,0]=4 14976 B16R2.2925 Clc1cccc(c1Br)NCc2ncon2 34a_100000687072_100000233494 [0,2,0,0,0,0|2,0,0]=4 14977 B16R2.2925 Clc1cccc(c1Br)NCn2cncn2 34a_100000687072_200020645497 [0,2,0,0,0,0|1,0,1]=4 14978 B16R2.2925 Clc1cccc(c1Br)OCc2c[nH]cn2 34a_100012348804_100000707719 [0,2,0,0,0,0|1,0,0]=3 14979 B16R2.2925 Clc1cccc(c1Br)OCc2cscn2 34a_100012348804_100000205941 [0,2,0,0,0,0|2,0,0]=4 14980 B16R2.2925 Clc1cccc(c1Br)OCc2cscn2 7a_100012348804_100000205941 [0,2,0,0,0,0|2,0,0]=4 14981 B16R2.2925 Clc1cccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100014021842 [0,2,0,0,0,0|1,0,0]=3 14982 B16R2.2925 Clc1cccc(c1Br)SCc2c[nH]cn2 62a_100014021842_100000707719 [0,2,0,0,0,0|1,0,0]=3 14983 B16R2.2925 Clc1cccc(c1Br)SCc2cscn2 62a_100000205941_100014021842 [0,2,0,0,0,0|2,0,0]=4 14984 B16R2.2925 Clc1cccc(c1Br)SCc2cscn2 62a_100014021842_100000205941 [0,2,0,0,0,0|2,0,0]=4 14985 B16R2.2925 Clc1cccc(c1Cl)CSc2c[nH]cn2 62a_100000720918_100000756875 [0,2,0,0,0,0|2,0,0]=4 14986 B16R2.2925 Clc1cccc(c1Cl)CSc2c[nH]cn2 62a_100000756875_100000723366 [0,2,0,0,0,0|2,0,0]=4 14987 B16R2.2925 Clc1cccc(c1Cl)NCc2c[nH]cn2 34a_100000185733_100000707719 [0,2,0,0,0,0|0,0,0]=2 14988 B16R2.2925 Clc1cccc(c1Cl)NCc2ccco2 270302a_100000185733_100000186105 [0,2,0,0,0,0|2,0,0]=4 14989 B16R2.2925 Clc1cccc(c1Cl)NCc2cccs2 270302a_100000185733_100000209959 [0,2,0,0,0,0|2,0,0]=4 14990 B16R2.2925 Clc1cccc(c1Cl)NCc2ccon2 34a_100000185733_100000234950 [0,2,0,0,0,0|2,0,0]=4 14991 B16R2.2925 Clc1cccc(c1Cl)NCc2ccsc2 270302a_100000185733_100000188534 [0,2,0,0,0,0|2,0,0]=4 14992 B16R2.2925 Clc1cccc(c1Cl)NCc2ccsc2 34a_100000185733_100011261437 [0,2,0,0,0,0|2,0,0]=4 14993 B16R2.2925 Clc1cccc(c1Cl)NCc2cn[nH]c2 270302a_100000185733_100016992096 [0,2,0,0,0,0|2,0,0]=4 14994 B16R2.2925 Clc1cccc(c1Cl)NCc2cncs2 270302a_100000185733_100000749870 [0,2,0,0,0,0|1,0,1]=4 14995 B16R2.2925 Clc1cccc(c1Cl)NCc2cncs2 34a_100000185733_100015185245 [0,2,0,0,0,0|1,0,1]=4 14996 B16R2.2925 Clc1cccc(c1Cl)NCc2cscn2 270302a_100000185733_100000743575 [0,2,0,0,0,0|1,0,0]=3 14997 B16R2.2925 Clc1cccc(c1Cl)NCc2cscn2 34a_100000185733_100000205941 [0,2,0,0,0,0|1,0,0]=3 14998 B16R2.2925 Clc1cccc(c1Cl)NCc2ncc[nH]2 34a_100000185733_100016991755 [0,2,0,0,0,0|2,0,0]=4 14999 B16R2.2925 Clc1cccc(c1Cl)NCc2ncco2 34a_100000185733_103436540062 [0,2,0,0,0,0|2,0,0]=4 15000 B16R2.2925 Clc1cccc(c1Cl)NCc2nccs2 270302a_100000185733_100000750902 [0,2,0,0,0,0|2,0,0]=4 15001 B16R2.2925 Clc1cccc(c1Cl)NCc2nccs2 34a_100000185733_100015184050 [0,2,0,0,0,0|2,0,0]=4 15002 B16R2.2925 Clc1cccc(c1Cl)NCc2ncon2 34a_100000185733_100000233494 [0,2,0,0,0,0|2,0,0]=4 15003 B16R2.2925 Clc1cccc(c1Cl)NCn2cncn2 34a_100000185733_200020645497 [0,2,0,0,0,0|1,0,1]=4 15004 B16R2.2925 Clc1cccc(c1Cl)OCc2c[nH]cn2 34a_100000211076_100000707719 [0,2,0,0,0,0|1,0,0]=3 15005 B16R2.2925 Clc1cccc(c1Cl)OCc2cscn2 34a_100000211076_100000205941 [0,2,0,0,0,0|2,0,0]=4 15006 B16R2.2925 Clc1cccc(c1Cl)OCc2cscn2 7a_100000211076_100000205941 [0,2,0,0,0,0|2,0,0]=4 15007 B16R2.2925 Clc1cccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100011215384 [0,2,0,0,0,0|1,0,0]=3 15008 B16R2.2925 Clc1cccc(c1Cl)SCc2c[nH]cn2 62a_100011215384_100000707719 [0,2,0,0,0,0|1,0,0]=3 15009 B16R2.2925 Clc1cccc(c1Cl)SCc2cscn2 62a_100000205941_100011215384 [0,2,0,0,0,0|2,0,0]=4 15010 B16R2.2925 Clc1cccc(c1Cl)SCc2cscn2 62a_100011215384_100000205941 [0,2,0,0,0,0|2,0,0]=4 15011 B16R2.2925 Clc1cccc(c1I)NCc2c[nH]cn2 34a_100000049713_100000707719 [0,2,0,0,0,0|0,0,0]=2 15012 B16R2.2925 Clc1cccc(c1I)NCc2ccon2 34a_100000049713_100000234950 [0,2,0,0,0,0|2,0,0]=4 15013 B16R2.2925 Clc1cccc(c1I)NCc2ccsc2 34a_100000049713_100011261437 [0,2,0,0,0,0|2,0,0]=4 15014 B16R2.2925 Clc1cccc(c1I)NCc2cncs2 34a_100000049713_100015185245 [0,2,0,0,0,0|1,0,1]=4 15015 B16R2.2925 Clc1cccc(c1I)NCc2cscn2 34a_100000049713_100000205941 [0,2,0,0,0,0|1,0,0]=3 15016 B16R2.2925 Clc1cccc(c1I)NCc2ncc[nH]2 34a_100000049713_100016991755 [0,2,0,0,0,0|2,0,0]=4 15017 B16R2.2925 Clc1cccc(c1I)NCc2ncco2 34a_100000049713_103436540062 [0,2,0,0,0,0|2,0,0]=4 15018 B16R2.2925 Clc1cccc(c1I)NCc2nccs2 34a_100000049713_100015184050 [0,2,0,0,0,0|2,0,0]=4 15019 B16R2.2925 Clc1cccc(c1I)NCc2ncon2 34a_100000049713_100000233494 [0,2,0,0,0,0|2,0,0]=4 15020 B16R2.2925 Clc1cccc(c1I)NCn2cncn2 34a_100000049713_200020645497 [0,2,0,0,0,0|1,0,1]=4 15021 B16R2.2925 Clc1cccc(c1I)OCc2c[nH]cn2 34a_100000050174_100000707719 [0,2,0,0,0,0|1,0,0]=3 15022 B16R2.2925 Clc1cccc(c1I)OCc2cscn2 34a_100000050174_100000205941 [0,2,0,0,0,0|2,0,0]=4 15023 B16R2.2925 Clc1cccc(c1I)OCc2cscn2 7a_100000050174_100000205941 [0,2,0,0,0,0|2,0,0]=4 15024 B16R2.2925 Clc1nccc(c1Br)OCc2c[nH]cn2 34a_100010136240_100000707719 [0,2,0,0,0,0|2,0,0]=4 15025 B16R2.2925 Clc1nccc(c1Cl)OCc2c[nH]cn2 34a_100009860235_100000707719 [0,2,0,0,0,0|2,0,0]=4 15026 B16R2.2925 Clc1nccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100010246212 [0,2,0,0,0,0|2,0,0]=4 15027 B16R2.2925 Clc1nccc(c1Cl)SCc2c[nH]cn2 62a_100010246212_100000707719 [0,2,0,0,0,0|2,0,0]=4 15028 B16R2.2925 Cn1c(cccc1=O)SCc2c[nH]cn2 62a_100000707719_100000726605 [0,2,0,0,0,0|2,0,0]=4 15029 B16R2.2925 Cn1c(cccc1=O)SCc2c[nH]cn2 62a_100000726605_100000707719 [0,2,0,0,0,0|2,0,0]=4 15030 B16R2.2925 Cn1cccc(c1=O)OCc2c[nH]cn2 34a_100000117616_100000707719 [0,2,0,0,0,0|2,0,0]=4 15031 B16R2.2925 Cn1cccc(c1=O)SCc2c[nH]cn2 62a_100000687173_100000707719 [0,2,0,0,0,0|2,0,0]=4 15032 B16R2.2925 Cn1cccc(c1=O)SCc2c[nH]cn2 62a_100000707719_100000687173 [0,2,0,0,0,0|2,0,0]=4 15033 B16R2.2925 Fc1c(cccc1CSc2c[nH]cn2)Br 62a_100000756875_100012356506 [0,2,0,0,0,0|2,0,0]=4 15034 B16R2.2925 Fc1c(cccc1CSc2c[nH]cn2)Br 62a_100012356506_100000756875 [0,2,0,0,0,0|2,0,0]=4 15035 B16R2.2925 Fc1c(cccc1CSc2c[nH]cn2)Cl 62a_100000716733_100000756875 [0,2,0,0,0,0|2,0,0]=4 15036 B16R2.2925 Fc1c(cccc1CSc2c[nH]cn2)Cl 62a_100000756875_100000716733 [0,2,0,0,0,0|2,0,0]=4 15037 B16R2.2925 Fc1c(cccc1NCc2c[nH]cn2)Br 2230a_100011935091_100000707719 [0,2,0,0,0,0|0,0,0]=2 15038 B16R2.2925 Fc1c(cccc1NCc2c[nH]cn2)Br 34a_100011935091_100000707719 [0,2,0,0,0,0|0,0,0]=2 15039 B16R2.2925 Fc1c(cccc1NCc2c[nH]cn2)Cl 2230a_100000199060_100000707719 [0,2,0,0,0,0|0,0,0]=2 15040 B16R2.2925 Fc1c(cccc1NCc2c[nH]cn2)Cl 34a_100000199060_100000707719 [0,2,0,0,0,0|0,0,0]=2 15041 B16R2.2925 Fc1c(cccc1NCc2cc[nH]n2)Br 207a_100011935091_100000738523 [0,2,0,0,0,0|2,0,0]=4 15042 B16R2.2925 Fc1c(cccc1NCc2cc[nH]n2)Cl 207a_100000199060_100000738523 [0,2,0,0,0,0|2,0,0]=4 15043 B16R2.2925 Fc1c(cccc1NCc2ccco2)Br 207a_100011935091_100000186105 [0,2,0,0,0,0|2,0,0]=4 15044 B16R2.2925 Fc1c(cccc1NCc2ccco2)Br 270302a_100011935091_100000186105 [0,2,0,0,0,0|2,0,0]=4 15045 B16R2.2925 Fc1c(cccc1NCc2ccco2)Cl 207a_100000199060_100000186105 [0,2,0,0,0,0|2,0,0]=4 15046 B16R2.2925 Fc1c(cccc1NCc2ccco2)Cl 270302a_100000199060_100000186105 [0,2,0,0,0,0|2,0,0]=4 15047 B16R2.2925 Fc1c(cccc1NCc2cccs2)Br 207a_100011935091_100000209959 [0,2,0,0,0,0|2,0,0]=4 15048 B16R2.2925 Fc1c(cccc1NCc2cccs2)Br 270302a_100011935091_100000209959 [0,2,0,0,0,0|2,0,0]=4 15049 B16R2.2925 Fc1c(cccc1NCc2cccs2)Cl 207a_100000199060_100000209959 [0,2,0,0,0,0|2,0,0]=4 15050 B16R2.2925 Fc1c(cccc1NCc2cccs2)Cl 270302a_100000199060_100000209959 [0,2,0,0,0,0|2,0,0]=4 15051 B16R2.2925 Fc1c(cccc1NCc2ccoc2)Br 207a_100011935091_100011215517 [0,2,0,0,0,0|2,0,0]=4 15052 B16R2.2925 Fc1c(cccc1NCc2ccoc2)Cl 207a_100000199060_100011215517 [0,2,0,0,0,0|2,0,0]=4 15053 B16R2.2925 Fc1c(cccc1NCc2ccon2)Br 2230a_100011935091_100000234950 [0,2,0,0,0,0|2,0,0]=4 15054 B16R2.2925 Fc1c(cccc1NCc2ccon2)Br 34a_100011935091_100000234950 [0,2,0,0,0,0|2,0,0]=4 15055 B16R2.2925 Fc1c(cccc1NCc2ccon2)Cl 2230a_100000199060_100000234950 [0,2,0,0,0,0|2,0,0]=4 15056 B16R2.2925 Fc1c(cccc1NCc2ccon2)Cl 34a_100000199060_100000234950 [0,2,0,0,0,0|2,0,0]=4 15057 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Br 207a_100011935091_100000188534 [0,2,0,0,0,0|2,0,0]=4 15058 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Br 2230a_100011935091_100011261437 [0,2,0,0,0,0|2,0,0]=4 15059 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Br 270302a_100011935091_100000188534 [0,2,0,0,0,0|2,0,0]=4 15060 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Br 34a_100011935091_100011261437 [0,2,0,0,0,0|2,0,0]=4 15061 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Cl 207a_100000199060_100000188534 [0,2,0,0,0,0|2,0,0]=4 15062 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Cl 2230a_100000199060_100011261437 [0,2,0,0,0,0|2,0,0]=4 15063 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Cl 270302a_100000199060_100000188534 [0,2,0,0,0,0|2,0,0]=4 15064 B16R2.2925 Fc1c(cccc1NCc2ccsc2)Cl 34a_100000199060_100011261437 [0,2,0,0,0,0|2,0,0]=4 15065 B16R2.2925 Fc1c(cccc1NCc2cn[nH]c2)Br 207a_100011935091_100016992096 [0,2,0,0,0,0|2,0,0]=4 15066 B16R2.2925 Fc1c(cccc1NCc2cn[nH]c2)Br 270302a_100011935091_100016992096 [0,2,0,0,0,0|2,0,0]=4 15067 B16R2.2925 Fc1c(cccc1NCc2cn[nH]c2)Cl 207a_100000199060_100016992096 [0,2,0,0,0,0|2,0,0]=4 15068 B16R2.2925 Fc1c(cccc1NCc2cn[nH]c2)Cl 270302a_100000199060_100016992096 [0,2,0,0,0,0|2,0,0]=4 15069 B16R2.2925 Fc1c(cccc1NCc2cnc[nH]2)Br 207a_100011935091_100000742939 [0,2,0,0,0,0|0,0,2]=4 15070 B16R2.2925 Fc1c(cccc1NCc2cnc[nH]2)Cl 207a_100000199060_100000742939 [0,2,0,0,0,0|0,0,2]=4 15071 B16R2.2925 Fc1c(cccc1NCc2cncs2)Br 207a_100011935091_100000749870 [0,2,0,0,0,0|1,0,1]=4 15072 B16R2.2925 Fc1c(cccc1NCc2cncs2)Br 2230a_100011935091_100015185245 [0,2,0,0,0,0|1,0,1]=4 15073 B16R2.2925 Fc1c(cccc1NCc2cncs2)Br 270302a_100011935091_100000749870 [0,2,0,0,0,0|1,0,1]=4 15074 B16R2.2925 Fc1c(cccc1NCc2cncs2)Br 34a_100011935091_100015185245 [0,2,0,0,0,0|1,0,1]=4 15075 B16R2.2925 Fc1c(cccc1NCc2cncs2)Cl 207a_100000199060_100000749870 [0,2,0,0,0,0|1,0,1]=4 15076 B16R2.2925 Fc1c(cccc1NCc2cncs2)Cl 2230a_100000199060_100015185245 [0,2,0,0,0,0|1,0,1]=4 15077 B16R2.2925 Fc1c(cccc1NCc2cncs2)Cl 270302a_100000199060_100000749870 [0,2,0,0,0,0|1,0,1]=4 15078 B16R2.2925 Fc1c(cccc1NCc2cncs2)Cl 34a_100000199060_100015185245 [0,2,0,0,0,0|1,0,1]=4 15079 B16R2.2925 Fc1c(cccc1NCc2cscn2)Br 207a_100011935091_100000743575 [0,2,0,0,0,0|1,0,0]=3 15080 B16R2.2925 Fc1c(cccc1NCc2cscn2)Br 2230a_100011935091_100000205941 [0,2,0,0,0,0|1,0,0]=3 15081 B16R2.2925 Fc1c(cccc1NCc2cscn2)Br 270302a_100011935091_100000743575 [0,2,0,0,0,0|1,0,0]=3 15082 B16R2.2925 Fc1c(cccc1NCc2cscn2)Br 34a_100011935091_100000205941 [0,2,0,0,0,0|1,0,0]=3 15083 B16R2.2925 Fc1c(cccc1NCc2cscn2)Cl 207a_100000199060_100000743575 [0,2,0,0,0,0|1,0,0]=3 15084 B16R2.2925 Fc1c(cccc1NCc2cscn2)Cl 2230a_100000199060_100000205941 [0,2,0,0,0,0|1,0,0]=3 15085 B16R2.2925 Fc1c(cccc1NCc2cscn2)Cl 270302a_100000199060_100000743575 [0,2,0,0,0,0|1,0,0]=3 15086 B16R2.2925 Fc1c(cccc1NCc2cscn2)Cl 34a_100000199060_100000205941 [0,2,0,0,0,0|1,0,0]=3 15087 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Br 207a_100011935091_100000743867 [0,2,0,0,0,0|2,0,0]=4 15088 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Br 2230a_100011935091_100016991755 [0,2,0,0,0,0|2,0,0]=4 15089 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Br 34a_100011935091_100016991755 [0,2,0,0,0,0|2,0,0]=4 15090 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Cl 207a_100000199060_100000743867 [0,2,0,0,0,0|2,0,0]=4 15091 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Cl 2230a_100000199060_100016991755 [0,2,0,0,0,0|2,0,0]=4 15092 B16R2.2925 Fc1c(cccc1NCc2ncc[nH]2)Cl 34a_100000199060_100016991755 [0,2,0,0,0,0|2,0,0]=4 15093 B16R2.2925 Fc1c(cccc1NCc2ncco2)Br 2230a_100011935091_103436540062 [0,2,0,0,0,0|2,0,0]=4 15094 B16R2.2925 Fc1c(cccc1NCc2ncco2)Br 34a_100011935091_103436540062 [0,2,0,0,0,0|2,0,0]=4 15095 B16R2.2925 Fc1c(cccc1NCc2ncco2)Cl 2230a_100000199060_103436540062 [0,2,0,0,0,0|2,0,0]=4 15096 B16R2.2925 Fc1c(cccc1NCc2ncco2)Cl 34a_100000199060_103436540062 [0,2,0,0,0,0|2,0,0]=4 15097 B16R2.2925 Fc1c(cccc1NCc2nccs2)Br 207a_100011935091_100000750902 [0,2,0,0,0,0|2,0,0]=4 15098 B16R2.2925 Fc1c(cccc1NCc2nccs2)Br 2230a_100011935091_100015184050 [0,2,0,0,0,0|2,0,0]=4 15099 B16R2.2925 Fc1c(cccc1NCc2nccs2)Br 270302a_100011935091_100000750902 [0,2,0,0,0,0|2,0,0]=4 15100 B16R2.2925 Fc1c(cccc1NCc2nccs2)Br 34a_100011935091_100015184050 [0,2,0,0,0,0|2,0,0]=4 15101 B16R2.2925 Fc1c(cccc1NCc2nccs2)Cl 207a_100000199060_100000750902 [0,2,0,0,0,0|2,0,0]=4 15102 B16R2.2925 Fc1c(cccc1NCc2nccs2)Cl 2230a_100000199060_100015184050 [0,2,0,0,0,0|2,0,0]=4 15103 B16R2.2925 Fc1c(cccc1NCc2nccs2)Cl 270302a_100000199060_100000750902 [0,2,0,0,0,0|2,0,0]=4 15104 B16R2.2925 Fc1c(cccc1NCc2nccs2)Cl 34a_100000199060_100015184050 [0,2,0,0,0,0|2,0,0]=4 15105 B16R2.2925 Fc1c(cccc1NCc2ncon2)Br 34a_100011935091_100000233494 [0,2,0,0,0,0|2,0,0]=4 15106 B16R2.2925 Fc1c(cccc1NCc2ncon2)Cl 34a_100000199060_100000233494 [0,2,0,0,0,0|2,0,0]=4 15107 B16R2.2925 Fc1c(cccc1NCn2cncn2)Br 2230a_100011935091_200020645497 [0,2,0,0,0,0|1,0,1]=4 15108 B16R2.2925 Fc1c(cccc1NCn2cncn2)Br 34a_100011935091_200020645497 [0,2,0,0,0,0|1,0,1]=4 15109 B16R2.2925 Fc1c(cccc1NCn2cncn2)Cl 2230a_100000199060_200020645497 [0,2,0,0,0,0|1,0,1]=4 15110 B16R2.2925 Fc1c(cccc1NCn2cncn2)Cl 34a_100000199060_200020645497 [0,2,0,0,0,0|1,0,1]=4 15111 B16R2.2925 Fc1c(cccc1OCc2c[nH]cn2)Br 34a_100009817021_100000707719 [0,2,0,0,0,0|1,0,0]=3 15112 B16R2.2925 Fc1c(cccc1OCc2c[nH]cn2)Cl 34a_100000687438_100000707719 [0,2,0,0,0,0|1,0,0]=3 15113 B16R2.2925 Fc1c(cccc1OCc2cscn2)Br 34a_100009817021_100000205941 [0,2,0,0,0,0|2,0,0]=4 15114 B16R2.2925 Fc1c(cccc1OCc2cscn2)Br 7a_100009817021_100000205941 [0,2,0,0,0,0|2,0,0]=4 15115 B16R2.2925 Fc1c(cccc1OCc2cscn2)Cl 34a_100000687438_100000205941 [0,2,0,0,0,0|2,0,0]=4 15116 B16R2.2925 Fc1c(cccc1OCc2cscn2)Cl 7a_100000687438_100000205941 [0,2,0,0,0,0|2,0,0]=4 15117 B16R2.2925 Fc1c(cccc1SCc2c[nH]cn2)Br 62a_100000702267_100000707719 [0,2,0,0,0,0|1,0,0]=3 15118 B16R2.2925 Fc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100000702267 [0,2,0,0,0,0|1,0,0]=3 15119 B16R2.2925 Fc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000707719_100011217346 [0,2,0,0,0,0|1,0,0]=3 15120 B16R2.2925 Fc1c(cccc1SCc2c[nH]cn2)Cl 62a_100011217346_100000707719 [0,2,0,0,0,0|1,0,0]=3 15121 B16R2.2925 Fc1c(cccc1SCc2cscn2)Br 62a_100000205941_100000702267 [0,2,0,0,0,0|2,0,0]=4 15122 B16R2.2925 Fc1c(cccc1SCc2cscn2)Br 62a_100000702267_100000205941 [0,2,0,0,0,0|2,0,0]=4 15123 B16R2.2925 Fc1c(cccc1SCc2cscn2)Cl 62a_100000205941_100011217346 [0,2,0,0,0,0|2,0,0]=4 15124 B16R2.2925 Fc1c(cccc1SCc2cscn2)Cl 62a_100011217346_100000205941 [0,2,0,0,0,0|2,0,0]=4 15125 B16R2.2925 Fc1c(ccnc1Br)OCc2c[nH]cn2 34a_100009876375_100000707719 [0,2,0,0,0,0|2,0,0]=4 15126 B16R2.2925 Fc1c(ccnc1Br)SCc2c[nH]cn2 62a_100000707719_200015269031 [0,2,0,0,0,0|2,0,0]=4 15127 B16R2.2925 Fc1c(ccnc1Br)SCc2c[nH]cn2 62a_200015269031_100000707719 [0,2,0,0,0,0|2,0,0]=4 15128 B16R2.2925 Fc1c(ccnc1Cl)OCc2c[nH]cn2 34a_100009856406_100000707719 [0,2,0,0,0,0|2,0,0]=4 15129 B16R2.2925 Fc1c(ccnc1Cl)SCc2c[nH]cn2 62a_100000707719_100010150473 [0,2,0,0,0,0|2,0,0]=4 15130 B16R2.2925 Fc1c(ccnc1Cl)SCc2c[nH]cn2 62a_100010150473_100000707719 [0,2,0,0,0,0|2,0,0]=4 15131 B16R2.2925 Fc1cccc(c1Br)CSc2c[nH]cn2 62a_100000756875_100012351116 [0,2,0,0,0,0|2,0,0]=4 15132 B16R2.2925 Fc1cccc(c1Br)CSc2c[nH]cn2 62a_100012351116_100000756875 [0,2,0,0,0,0|2,0,0]=4 15133 B16R2.2925 Fc1cccc(c1Br)NCc2c[nH]cn2 34a_100011934729_100000707719 [0,2,0,0,0,0|0,0,0]=2 15134 B16R2.2925 Fc1cccc(c1Br)NCc2ccco2 270302a_100011934729_100000186105 [0,2,0,0,0,0|2,0,0]=4 15135 B16R2.2925 Fc1cccc(c1Br)NCc2cccs2 270302a_100011934729_100000209959 [0,2,0,0,0,0|2,0,0]=4 15136 B16R2.2925 Fc1cccc(c1Br)NCc2ccon2 34a_100011934729_100000234950 [0,2,0,0,0,0|2,0,0]=4 15137 B16R2.2925 Fc1cccc(c1Br)NCc2ccsc2 270302a_100011934729_100000188534 [0,2,0,0,0,0|2,0,0]=4 15138 B16R2.2925 Fc1cccc(c1Br)NCc2ccsc2 34a_100011934729_100011261437 [0,2,0,0,0,0|2,0,0]=4 15139 B16R2.2925 Fc1cccc(c1Br)NCc2cn[nH]c2 270302a_100011934729_100016992096 [0,2,0,0,0,0|2,0,0]=4 15140 B16R2.2925 Fc1cccc(c1Br)NCc2cncs2 270302a_100011934729_100000749870 [0,2,0,0,0,0|1,0,1]=4 15141 B16R2.2925 Fc1cccc(c1Br)NCc2cncs2 34a_100011934729_100015185245 [0,2,0,0,0,0|1,0,1]=4 15142 B16R2.2925 Fc1cccc(c1Br)NCc2cscn2 270302a_100011934729_100000743575 [0,2,0,0,0,0|1,0,0]=3 15143 B16R2.2925 Fc1cccc(c1Br)NCc2cscn2 34a_100011934729_100000205941 [0,2,0,0,0,0|1,0,0]=3 15144 B16R2.2925 Fc1cccc(c1Br)NCc2ncc[nH]2 34a_100011934729_100016991755 [0,2,0,0,0,0|2,0,0]=4 15145 B16R2.2925 Fc1cccc(c1Br)NCc2ncco2 34a_100011934729_103436540062 [0,2,0,0,0,0|2,0,0]=4 15146 B16R2.2925 Fc1cccc(c1Br)NCc2nccs2 270302a_100011934729_100000750902 [0,2,0,0,0,0|2,0,0]=4 15147 B16R2.2925 Fc1cccc(c1Br)NCc2nccs2 34a_100011934729_100015184050 [0,2,0,0,0,0|2,0,0]=4 15148 B16R2.2925 Fc1cccc(c1Br)NCc2ncon2 34a_100011934729_100000233494 [0,2,0,0,0,0|2,0,0]=4 15149 B16R2.2925 Fc1cccc(c1Br)NCn2cncn2 34a_100011934729_200020645497 [0,2,0,0,0,0|1,0,1]=4 15150 B16R2.2925 Fc1cccc(c1Br)OCc2c[nH]cn2 34a_100009820682_100000707719 [0,2,0,0,0,0|1,0,0]=3 15151 B16R2.2925 Fc1cccc(c1Br)OCc2cscn2 34a_100009820682_100000205941 [0,2,0,0,0,0|2,0,0]=4 15152 B16R2.2925 Fc1cccc(c1Br)OCc2cscn2 7a_100009820682_100000205941 [0,2,0,0,0,0|2,0,0]=4 15153 B16R2.2925 Fc1cccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100010202630 [0,2,0,0,0,0|1,0,0]=3 15154 B16R2.2925 Fc1cccc(c1Br)SCc2c[nH]cn2 62a_100010202630_100000707719 [0,2,0,0,0,0|1,0,0]=3 15155 B16R2.2925 Fc1cccc(c1Br)SCc2cscn2 62a_100000205941_100010202630 [0,2,0,0,0,0|2,0,0]=4 15156 B16R2.2925 Fc1cccc(c1Br)SCc2cscn2 62a_100010202630_100000205941 [0,2,0,0,0,0|2,0,0]=4 15157 B16R2.2925 Fc1cccc(c1Cl)CSc2c[nH]cn2 62a_100000696688_100000756875 [0,2,0,0,0,0|2,0,0]=4 15158 B16R2.2925 Fc1cccc(c1Cl)CSc2c[nH]cn2 62a_100000756875_100000696688 [0,2,0,0,0,0|2,0,0]=4 15159 B16R2.2925 Fc1cccc(c1Cl)NCc2c[nH]cn2 34a_100000692321_100000707719 [0,2,0,0,0,0|0,0,0]=2 15160 B16R2.2925 Fc1cccc(c1Cl)NCc2ccco2 270302a_100000692321_100000186105 [0,2,0,0,0,0|2,0,0]=4 15161 B16R2.2925 Fc1cccc(c1Cl)NCc2cccs2 270302a_100000692321_100000209959 [0,2,0,0,0,0|2,0,0]=4 15162 B16R2.2925 Fc1cccc(c1Cl)NCc2ccon2 34a_100000692321_100000234950 [0,2,0,0,0,0|2,0,0]=4 15163 B16R2.2925 Fc1cccc(c1Cl)NCc2ccsc2 270302a_100000692321_100000188534 [0,2,0,0,0,0|2,0,0]=4 15164 B16R2.2925 Fc1cccc(c1Cl)NCc2ccsc2 34a_100000692321_100011261437 [0,2,0,0,0,0|2,0,0]=4 15165 B16R2.2925 Fc1cccc(c1Cl)NCc2cn[nH]c2 270302a_100000692321_100016992096 [0,2,0,0,0,0|2,0,0]=4 15166 B16R2.2925 Fc1cccc(c1Cl)NCc2cncs2 270302a_100000692321_100000749870 [0,2,0,0,0,0|1,0,1]=4 15167 B16R2.2925 Fc1cccc(c1Cl)NCc2cncs2 34a_100000692321_100015185245 [0,2,0,0,0,0|1,0,1]=4 15168 B16R2.2925 Fc1cccc(c1Cl)NCc2cscn2 270302a_100000692321_100000743575 [0,2,0,0,0,0|1,0,0]=3 15169 B16R2.2925 Fc1cccc(c1Cl)NCc2cscn2 34a_100000692321_100000205941 [0,2,0,0,0,0|1,0,0]=3 15170 B16R2.2925 Fc1cccc(c1Cl)NCc2ncc[nH]2 34a_100000692321_100016991755 [0,2,0,0,0,0|2,0,0]=4 15171 B16R2.2925 Fc1cccc(c1Cl)NCc2ncco2 34a_100000692321_103436540062 [0,2,0,0,0,0|2,0,0]=4 15172 B16R2.2925 Fc1cccc(c1Cl)NCc2nccs2 270302a_100000692321_100000750902 [0,2,0,0,0,0|2,0,0]=4 15173 B16R2.2925 Fc1cccc(c1Cl)NCc2nccs2 34a_100000692321_100015184050 [0,2,0,0,0,0|2,0,0]=4 15174 B16R2.2925 Fc1cccc(c1Cl)NCc2ncon2 34a_100000692321_100000233494 [0,2,0,0,0,0|2,0,0]=4 15175 B16R2.2925 Fc1cccc(c1Cl)NCn2cncn2 34a_100000692321_200020645497 [0,2,0,0,0,0|1,0,1]=4 15176 B16R2.2925 Fc1cccc(c1Cl)OCc2c[nH]cn2 34a_100000087408_100000707719 [0,2,0,0,0,0|1,0,0]=3 15177 B16R2.2925 Fc1cccc(c1Cl)OCc2cscn2 34a_100000087408_100000205941 [0,2,0,0,0,0|2,0,0]=4 15178 B16R2.2925 Fc1cccc(c1Cl)OCc2cscn2 7a_100000087408_100000205941 [0,2,0,0,0,0|2,0,0]=4 15179 B16R2.2925 Fc1cccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_200010234923 [0,2,0,0,0,0|1,0,0]=3 15180 B16R2.2925 Fc1cccc(c1Cl)SCc2c[nH]cn2 62a_200010234923_100000707719 [0,2,0,0,0,0|1,0,0]=3 15181 B16R2.2925 Fc1cccc(c1Cl)SCc2cscn2 62a_100000205941_200010234923 [0,2,0,0,0,0|2,0,0]=4 15182 B16R2.2925 Fc1cccc(c1Cl)SCc2cscn2 62a_200010234923_100000205941 [0,2,0,0,0,0|2,0,0]=4 15183 B16R2.2925 Fc1cccc(c1F)CSc2c[nH]cn2 62a_100000217499_100000756875 [0,2,0,0,0,0|2,0,0]=4 15184 B16R2.2925 Fc1cccc(c1F)CSc2c[nH]cn2 62a_100000756875_100000217499 [0,2,0,0,0,0|2,0,0]=4 15185 B16R2.2925 Fc1cccc(c1F)NCc2c[nH]cn2 34a_100000743855_100000707719 [0,2,0,0,0,0|0,0,0]=2 15186 B16R2.2925 Fc1cccc(c1F)NCc2ccco2 270302a_100000743855_100000186105 [0,2,0,0,0,0|2,0,0]=4 15187 B16R2.2925 Fc1cccc(c1F)NCc2cccs2 270302a_100000743855_100000209959 [0,2,0,0,0,0|2,0,0]=4 15188 B16R2.2925 Fc1cccc(c1F)NCc2ccon2 34a_100000743855_100000234950 [0,2,0,0,0,0|2,0,0]=4 15189 B16R2.2925 Fc1cccc(c1F)NCc2ccsc2 270302a_100000743855_100000188534 [0,2,0,0,0,0|2,0,0]=4 15190 B16R2.2925 Fc1cccc(c1F)NCc2ccsc2 34a_100000743855_100011261437 [0,2,0,0,0,0|2,0,0]=4 15191 B16R2.2925 Fc1cccc(c1F)NCc2cn[nH]c2 270302a_100000743855_100016992096 [0,2,0,0,0,0|2,0,0]=4 15192 B16R2.2925 Fc1cccc(c1F)NCc2cncs2 270302a_100000743855_100000749870 [0,2,0,0,0,0|1,0,1]=4 15193 B16R2.2925 Fc1cccc(c1F)NCc2cncs2 34a_100000743855_100015185245 [0,2,0,0,0,0|1,0,1]=4 15194 B16R2.2925 Fc1cccc(c1F)NCc2cscn2 270302a_100000743855_100000743575 [0,2,0,0,0,0|1,0,0]=3 15195 B16R2.2925 Fc1cccc(c1F)NCc2cscn2 34a_100000743855_100000205941 [0,2,0,0,0,0|1,0,0]=3 15196 B16R2.2925 Fc1cccc(c1F)NCc2ncc[nH]2 34a_100000743855_100016991755 [0,2,0,0,0,0|2,0,0]=4 15197 B16R2.2925 Fc1cccc(c1F)NCc2ncco2 34a_100000743855_103436540062 [0,2,0,0,0,0|2,0,0]=4 15198 B16R2.2925 Fc1cccc(c1F)NCc2nccs2 270302a_100000743855_100000750902 [0,2,0,0,0,0|2,0,0]=4 15199 B16R2.2925 Fc1cccc(c1F)NCc2nccs2 34a_100000743855_100015184050 [0,2,0,0,0,0|2,0,0]=4 15200 B16R2.2925 Fc1cccc(c1F)NCc2ncon2 34a_100000743855_100000233494 [0,2,0,0,0,0|2,0,0]=4 15201 B16R2.2925 Fc1cccc(c1F)NCn2cncn2 34a_100000743855_200020645497 [0,2,0,0,0,0|1,0,1]=4 15202 B16R2.2925 Fc1cccc(c1F)OCc2c[nH]cn2 34a_100000751161_100000707719 [0,2,0,0,0,0|1,0,0]=3 15203 B16R2.2925 Fc1cccc(c1F)OCc2cscn2 34a_100000751161_100000205941 [0,2,0,0,0,0|2,0,0]=4 15204 B16R2.2925 Fc1cccc(c1F)OCc2cscn2 7a_100000751161_100000205941 [0,2,0,0,0,0|2,0,0]=4 15205 B16R2.2925 Fc1cccc(c1F)SCc2c[nH]cn2 62a_100000694657_100000707719 [0,2,0,0,0,0|1,0,0]=3 15206 B16R2.2925 Fc1cccc(c1F)SCc2c[nH]cn2 62a_100000707719_100000694657 [0,2,0,0,0,0|1,0,0]=3 15207 B16R2.2925 Fc1cccc(c1F)SCc2cscn2 62a_100000205941_100000694657 [0,2,0,0,0,0|2,0,0]=4 15208 B16R2.2925 Fc1cccc(c1F)SCc2cscn2 62a_100000694657_100000205941 [0,2,0,0,0,0|2,0,0]=4 15209 B16R2.2925 Fc1cccc(c1I)CSc2c[nH]cn2 62a_100000756875_100010149603 [0,2,0,0,0,0|2,0,0]=4 15210 B16R2.2925 Fc1cccc(c1I)CSc2c[nH]cn2 62a_100010149603_100000756875 [0,2,0,0,0,0|2,0,0]=4 15211 B16R2.2925 Fc1cccc(c1I)NCc2c[nH]cn2 34a_100000690935_100000707719 [0,2,0,0,0,0|0,0,0]=2 15212 B16R2.2925 Fc1cccc(c1I)NCc2ccon2 34a_100000690935_100000234950 [0,2,0,0,0,0|2,0,0]=4 15213 B16R2.2925 Fc1cccc(c1I)NCc2ccsc2 34a_100000690935_100011261437 [0,2,0,0,0,0|2,0,0]=4 15214 B16R2.2925 Fc1cccc(c1I)NCc2cncs2 34a_100000690935_100015185245 [0,2,0,0,0,0|1,0,1]=4 15215 B16R2.2925 Fc1cccc(c1I)NCc2cscn2 34a_100000690935_100000205941 [0,2,0,0,0,0|1,0,0]=3 15216 B16R2.2925 Fc1cccc(c1I)NCc2ncc[nH]2 34a_100000690935_100016991755 [0,2,0,0,0,0|2,0,0]=4 15217 B16R2.2925 Fc1cccc(c1I)NCc2ncco2 34a_100000690935_103436540062 [0,2,0,0,0,0|2,0,0]=4 15218 B16R2.2925 Fc1cccc(c1I)NCc2nccs2 34a_100000690935_100015184050 [0,2,0,0,0,0|2,0,0]=4 15219 B16R2.2925 Fc1cccc(c1I)NCc2ncon2 34a_100000690935_100000233494 [0,2,0,0,0,0|2,0,0]=4 15220 B16R2.2925 Fc1cccc(c1I)NCn2cncn2 34a_100000690935_200020645497 [0,2,0,0,0,0|1,0,1]=4 15221 B16R2.2925 Fc1cccc(c1I)OCc2c[nH]cn2 34a_100000690913_100000707719 [0,2,0,0,0,0|1,0,0]=3 15222 B16R2.2925 Fc1cccc(c1I)OCc2cscn2 34a_100000690913_100000205941 [0,2,0,0,0,0|2,0,0]=4 15223 B16R2.2925 Fc1cccc(c1I)OCc2cscn2 7a_100000690913_100000205941 [0,2,0,0,0,0|2,0,0]=4 15224 B16R2.2925 Fc1nccc(c1Br)NCc2c[nH]cn2 27a_100000758547_100010006599 [0,2,0,0,0,0|1,0,0]=3 15225 B16R2.2925 Fc1nccc(c1Br)NCc2c[nH]nn2 27a_100020620823_100010006599 [0,2,0,0,0,0|2,0,0]=4 15226 B16R2.2925 Fc1nccc(c1Br)NCc2cocn2 27a_100015188801_100010006599 [0,2,0,0,0,0|2,0,0]=4 15227 B16R2.2925 Fc1nccc(c1Br)NCc2cscn2 27a_100015185402_100010006599 [0,2,0,0,0,0|2,0,0]=4 15228 B16R2.2925 Fc1nccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100010006599 [0,2,0,0,0,0|2,0,0]=4 15229 B16R2.2925 Fc1nccc(c1Br)SCc2c[nH]cn2 62a_100010006599_100000707719 [0,2,0,0,0,0|2,0,0]=4 15230 B16R2.2925 Fc1nccc(c1Cl)NCc2c[nH]cn2 27a_100000758547_100010067886 [0,2,0,0,0,0|1,0,0]=3 15231 B16R2.2925 Fc1nccc(c1Cl)NCc2c[nH]nn2 27a_100020620823_100010067886 [0,2,0,0,0,0|2,0,0]=4 15232 B16R2.2925 Fc1nccc(c1Cl)NCc2cocn2 27a_100015188801_100010067886 [0,2,0,0,0,0|2,0,0]=4 15233 B16R2.2925 Fc1nccc(c1Cl)NCc2cscn2 27a_100015185402_100010067886 [0,2,0,0,0,0|2,0,0]=4 15234 B16R2.2925 Fc1nccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100010067886 [0,2,0,0,0,0|2,0,0]=4 15235 B16R2.2925 Fc1nccc(c1Cl)SCc2c[nH]cn2 62a_100010067886_100000707719 [0,2,0,0,0,0|2,0,0]=4 15236 B16R2.2925 Fc1nccc(c1F)NCc2c[nH]cn2 27a_100000758547_100010214882 [0,2,0,0,0,0|1,0,0]=3 15237 B16R2.2925 Fc1nccc(c1F)NCc2c[nH]nn2 27a_100020620823_100010214882 [0,2,0,0,0,0|2,0,0]=4 15238 B16R2.2925 Fc1nccc(c1F)NCc2cocn2 27a_100015188801_100010214882 [0,2,0,0,0,0|2,0,0]=4 15239 B16R2.2925 Fc1nccc(c1F)NCc2cscn2 27a_100015185402_100010214882 [0,2,0,0,0,0|2,0,0]=4 15240 B16R2.2925 Fc1nccc(c1F)SCc2c[nH]cn2 62a_100000707719_100010214882 [0,2,0,0,0,0|2,0,0]=4 15241 B16R2.2925 Fc1nccc(c1F)SCc2c[nH]cn2 62a_100010214882_100000707719 [0,2,0,0,0,0|2,0,0]=4 15242 B16R2.2925 Nc1c(cccc1OCc2c[nH]cn2)Br 34a_100011934926_100000707719 [0,2,0,0,0,0|1,0,0]=3 15243 B16R2.2925 Nc1c(cccc1OCc2c[nH]cn2)Cl 34a_100012022510_100000707719 [0,2,0,0,0,0|1,0,0]=3 15244 B16R2.2925 Nc1c(cccc1OCc2c[nH]cn2)F 34a_100020591140_100000707719 [0,2,0,0,0,0|1,0,0]=3 15245 B16R2.2925 Nc1c(cccc1OCc2c[nH]cn2)I 34a_200000049512_100000707719 [0,2,0,0,0,0|1,0,0]=3 15246 B16R2.2925 Nc1c(cccc1OCc2cscn2)Br 34a_100011934926_100000205941 [0,2,0,0,0,0|2,0,0]=4 15247 B16R2.2925 Nc1c(cccc1OCc2cscn2)Br 7a_100011934926_100000205941 [0,2,0,0,0,0|2,0,0]=4 15248 B16R2.2925 Nc1c(cccc1OCc2cscn2)Cl 34a_100012022510_100000205941 [0,2,0,0,0,0|2,0,0]=4 15249 B16R2.2925 Nc1c(cccc1OCc2cscn2)Cl 7a_100012022510_100000205941 [0,2,0,0,0,0|2,0,0]=4 15250 B16R2.2925 Nc1c(cccc1OCc2cscn2)F 34a_100020591140_100000205941 [0,2,0,0,0,0|2,0,0]=4 15251 B16R2.2925 Nc1c(cccc1OCc2cscn2)F 7a_100020591140_100000205941 [0,2,0,0,0,0|2,0,0]=4 15252 B16R2.2925 Nc1c(cccc1OCc2cscn2)I 34a_200000049512_100000205941 [0,2,0,0,0,0|2,0,0]=4 15253 B16R2.2925 Nc1c(cccc1OCc2cscn2)I 7a_200000049512_100000205941 [0,2,0,0,0,0|2,0,0]=4 15254 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100010146558 [0,2,0,0,0,0|1,0,0]=3 15255 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)Br 62a_100010146558_100000707719 [0,2,0,0,0,0|1,0,0]=3 15256 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000707719_100010190421 [0,2,0,0,0,0|1,0,0]=3 15257 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)Cl 62a_100010190421_100000707719 [0,2,0,0,0,0|1,0,0]=3 15258 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)F 62a_100000042321_100000707719 [0,2,0,0,0,0|1,0,0]=3 15259 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100000042321 [0,2,0,0,0,0|1,0,0]=3 15260 B16R2.2925 Nc1c(cccc1SCc2c[nH]cn2)O 62a_100000707719_100011934926 [0,2,0,0,0,0|1,0,0]=3 15261 B16R2.2925 Nc1c(cccc1SCc2cscn2)Br 62a_100000205941_100010146558 [0,2,0,0,0,0|2,0,0]=4 15262 B16R2.2925 Nc1c(cccc1SCc2cscn2)Br 62a_100010146558_100000205941 [0,2,0,0,0,0|2,0,0]=4 15263 B16R2.2925 Nc1c(cccc1SCc2cscn2)Cl 62a_100000205941_100010190421 [0,2,0,0,0,0|2,0,0]=4 15264 B16R2.2925 Nc1c(cccc1SCc2cscn2)Cl 62a_100010190421_100000205941 [0,2,0,0,0,0|2,0,0]=4 15265 B16R2.2925 Nc1c(cccc1SCc2cscn2)F 62a_100000042321_100000205941 [0,2,0,0,0,0|2,0,0]=4 15266 B16R2.2925 Nc1c(cccc1SCc2cscn2)F 62a_100000205941_100000042321 [0,2,0,0,0,0|2,0,0]=4 15267 B16R2.2925 Nc1c(cccc1SCc2cscn2)O 62a_100000205941_100011934926 [0,2,0,0,0,0|2,0,0]=4 15268 B16R2.2925 Nc1c(ccnc1Cl)OCc2c[nH]cn2 34a_100000128729_100000707719 [0,2,0,0,0,0|2,0,0]=4 15269 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)Br 62a_100000707719_100011290786 [0,2,0,0,0,0|2,0,0]=4 15270 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)Br 62a_100011290786_100000707719 [0,2,0,0,0,0|2,0,0]=4 15271 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)Cl 62a_100000684942_100000707719 [0,2,0,0,0,0|2,0,0]=4 15272 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)Cl 62a_100000707719_100000684942 [0,2,0,0,0,0|2,0,0]=4 15273 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)F 62a_100000707719_100009880649 [0,2,0,0,0,0|2,0,0]=4 15274 B16R2.2925 Nc1c(cncc1SCc2c[nH]cn2)F 62a_100009880649_100000707719 [0,2,0,0,0,0|2,0,0]=4 15275 B16R2.2925 Nc1cccc(c1Br)OCc2c[nH]cn2 34a_100012183704_100000707719 [0,2,0,0,0,0|1,0,0]=3 15276 B16R2.2925 Nc1cccc(c1Br)OCc2cscn2 34a_100012183704_100000205941 [0,2,0,0,0,0|2,0,0]=4 15277 B16R2.2925 Nc1cccc(c1Br)OCc2cscn2 7a_100012183704_100000205941 [0,2,0,0,0,0|2,0,0]=4 15278 B16R2.2925 Nc1cccc(c1Cl)OCc2c[nH]cn2 34a_100012002038_100000707719 [0,2,0,0,0,0|1,0,0]=3 15279 B16R2.2925 Nc1cccc(c1Cl)OCc2cscn2 34a_100012002038_100000205941 [0,2,0,0,0,0|2,0,0]=4 15280 B16R2.2925 Nc1cccc(c1Cl)OCc2cscn2 7a_100012002038_100000205941 [0,2,0,0,0,0|2,0,0]=4 15281 B16R2.2925 Nc1cccc(c1F)SCc2c[nH]cn2 62a_100000707719_100011935091 [0,2,0,0,0,0|1,0,0]=3 15282 B16R2.2925 Nc1cccc(c1F)SCc2c[nH]cn2 62a_100011935091_100000707719 [0,2,0,0,0,0|1,0,0]=3 15283 B16R2.2925 Nc1cccc(c1F)SCc2cscn2 62a_100000205941_100011935091 [0,2,0,0,0,0|2,0,0]=4 15284 B16R2.2925 Nc1cccc(c1F)SCc2cscn2 62a_100011935091_100000205941 [0,2,0,0,0,0|2,0,0]=4 15285 B16R2.2925 Nc1cccc(c1N)OCc2c[nH]cn2 34a_100000033209_100000707719 [0,2,0,0,0,0|1,0,0]=3 15286 B16R2.2925 Nc1cccc(c1N)OCc2cscn2 34a_100000033209_100000205941 [0,2,0,0,0,0|2,0,0]=4 15287 B16R2.2925 Nc1cccc(c1N)SCc2c[nH]cn2 62a_100015191791_100000707719 [0,2,0,0,0,0|1,0,0]=3 15288 B16R2.2925 Nc1cccc(c1N)SCc2cscn2 62a_100015191791_100000205941 [0,2,0,0,0,0|2,0,0]=4 15289 B16R2.2925 Nc1cccc(c1O)SCc2c[nH]cn2 62a_100000707719_100010084371 [0,2,0,0,0,0|1,0,0]=3 15290 B16R2.2925 Nc1cccc(c1O)SCc2c[nH]cn2 62a_100011934915_100000707719 [0,2,0,0,0,0|1,0,0]=3 15291 B16R2.2925 Nc1cccc(c1O)SCc2cscn2 62a_100000205941_100010084371 [0,2,0,0,0,0|2,0,0]=4 15292 B16R2.2925 Nc1cccc(c1O)SCc2cscn2 62a_100011934915_100000205941 [0,2,0,0,0,0|2,0,0]=4 15293 B16R2.2925 Nc1ccnc(c1Cl)OCc2c[nH]cn2 34a_200000093555_100000707719 [0,2,0,0,0,0|2,0,0]=4 15294 B16R2.2925 Nc1ccnc(c1F)SCc2c[nH]cn2 62a_100000707719_100015205195 [0,2,0,0,0,0|2,0,0]=4 15295 B16R2.2925 Nc1ccnc(c1F)SCc2c[nH]cn2 62a_100015205195_100000707719 [0,2,0,0,0,0|2,0,0]=4 15296 B16R2.2925 Nc1ccnc(c1N)SCc2c[nH]cn2 62a_100000085203_100000707719 [0,2,0,0,0,0|2,0,0]=4 15297 B16R2.2925 Nc1ccnc(c1N)SCc2c[nH]cn2 62a_100000707719_100000085203 [0,2,0,0,0,0|2,0,0]=4 15298 B16R2.2925 Nc1ccnc(c1O)SCc2c[nH]cn2 62a_100000707719_100009844647 [0,2,0,0,0,0|2,0,0]=4 15299 B16R2.2925 Nc1cncc(c1N)SCc2c[nH]cn2 62a_100000694774_100000707719 [0,2,0,0,0,0|2,0,0]=4 15300 B16R2.2925 Nc1cncc(c1N)SCc2c[nH]cn2 62a_100000707719_100000694774 [0,2,0,0,0,0|2,0,0]=4 15301 B16R2.2925 Nc1cncc(c1O)SCc2c[nH]cn2 62a_100000694263_100000707719 [0,2,0,0,0,0|2,0,0]=4 15302 B16R2.2925 Nc1cncc(c1O)SCc2c[nH]cn2 62a_100000707719_100000694263 [0,2,0,0,0,0|2,0,0]=4 15303 B16R2.2925 Nc1nccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100010735111 [0,2,0,0,0,0|2,0,0]=4 15304 B16R2.2925 Nc1nccc(c1Cl)SCc2c[nH]cn2 62a_100010735111_100000707719 [0,2,0,0,0,0|2,0,0]=4 15305 B16R2.2925 Nc1nccc(c1F)SCc2c[nH]cn2 62a_100000707719_100010077785 [0,2,0,0,0,0|2,0,0]=4 15306 B16R2.2925 Nc1nccc(c1F)SCc2c[nH]cn2 62a_100010077785_100000707719 [0,2,0,0,0,0|2,0,0]=4 15307 B16R2.2925 Nc1nccc(c1N)SCc2c[nH]cn2 62a_100000124095_100000707719 [0,2,0,0,0,0|2,0,0]=4 15308 B16R2.2925 Nc1ncnc(c1F)NCc2c[nH]cn2 27a_100000758547_100000126652 [0,2,0,0,0,0|2,0,0]=4 15309 B16R2.2925 Oc1c(cccc1NCc2c[nH]cn2)Br 34a_100011934915_100000707719 [0,2,0,0,0,0|0,0,0]=2 15310 B16R2.2925 Oc1c(cccc1NCc2c[nH]cn2)Cl 34a_100000754742_100000707719 [0,2,0,0,0,0|0,0,0]=2 15311 B16R2.2925 Oc1c(cccc1NCc2c[nH]cn2)F 34a_100011934987_100000707719 [0,2,0,0,0,0|0,0,0]=2 15312 B16R2.2925 Oc1c(cccc1NCc2ccco2)Cl 270302a_100000754742_100000186105 [0,2,0,0,0,0|2,0,0]=4 15313 B16R2.2925 Oc1c(cccc1NCc2ccco2)F 270302a_100011934987_100000186105 [0,2,0,0,0,0|2,0,0]=4 15314 B16R2.2925 Oc1c(cccc1NCc2cccs2)Cl 270302a_100000754742_100000209959 [0,2,0,0,0,0|2,0,0]=4 15315 B16R2.2925 Oc1c(cccc1NCc2cccs2)F 270302a_100011934987_100000209959 [0,2,0,0,0,0|2,0,0]=4 15316 B16R2.2925 Oc1c(cccc1NCc2ccon2)Br 34a_100011934915_100000234950 [0,2,0,0,0,0|2,0,0]=4 15317 B16R2.2925 Oc1c(cccc1NCc2ccon2)Cl 34a_100000754742_100000234950 [0,2,0,0,0,0|2,0,0]=4 15318 B16R2.2925 Oc1c(cccc1NCc2ccon2)F 34a_100011934987_100000234950 [0,2,0,0,0,0|2,0,0]=4 15319 B16R2.2925 Oc1c(cccc1NCc2ccsc2)Br 34a_100011934915_100011261437 [0,2,0,0,0,0|2,0,0]=4 15320 B16R2.2925 Oc1c(cccc1NCc2ccsc2)Cl 270302a_100000754742_100000188534 [0,2,0,0,0,0|2,0,0]=4 15321 B16R2.2925 Oc1c(cccc1NCc2ccsc2)Cl 34a_100000754742_100011261437 [0,2,0,0,0,0|2,0,0]=4 15322 B16R2.2925 Oc1c(cccc1NCc2ccsc2)F 270302a_100011934987_100000188534 [0,2,0,0,0,0|2,0,0]=4 15323 B16R2.2925 Oc1c(cccc1NCc2ccsc2)F 34a_100011934987_100011261437 [0,2,0,0,0,0|2,0,0]=4 15324 B16R2.2925 Oc1c(cccc1NCc2cn[nH]c2)Cl 270302a_100000754742_100016992096 [0,2,0,0,0,0|2,0,0]=4 15325 B16R2.2925 Oc1c(cccc1NCc2cn[nH]c2)F 270302a_100011934987_100016992096 [0,2,0,0,0,0|2,0,0]=4 15326 B16R2.2925 Oc1c(cccc1NCc2cncs2)Br 34a_100011934915_100015185245 [0,2,0,0,0,0|1,0,1]=4 15327 B16R2.2925 Oc1c(cccc1NCc2cncs2)Cl 270302a_100000754742_100000749870 [0,2,0,0,0,0|1,0,1]=4 15328 B16R2.2925 Oc1c(cccc1NCc2cncs2)Cl 34a_100000754742_100015185245 [0,2,0,0,0,0|1,0,1]=4 15329 B16R2.2925 Oc1c(cccc1NCc2cncs2)F 270302a_100011934987_100000749870 [0,2,0,0,0,0|1,0,1]=4 15330 B16R2.2925 Oc1c(cccc1NCc2cncs2)F 34a_100011934987_100015185245 [0,2,0,0,0,0|1,0,1]=4 15331 B16R2.2925 Oc1c(cccc1NCc2cscn2)Br 34a_100011934915_100000205941 [0,2,0,0,0,0|1,0,0]=3 15332 B16R2.2925 Oc1c(cccc1NCc2cscn2)Cl 270302a_100000754742_100000743575 [0,2,0,0,0,0|1,0,0]=3 15333 B16R2.2925 Oc1c(cccc1NCc2cscn2)Cl 34a_100000754742_100000205941 [0,2,0,0,0,0|1,0,0]=3 15334 B16R2.2925 Oc1c(cccc1NCc2cscn2)F 270302a_100011934987_100000743575 [0,2,0,0,0,0|1,0,0]=3 15335 B16R2.2925 Oc1c(cccc1NCc2cscn2)F 34a_100011934987_100000205941 [0,2,0,0,0,0|1,0,0]=3 15336 B16R2.2925 Oc1c(cccc1NCc2ncc[nH]2)Br 34a_100011934915_100016991755 [0,2,0,0,0,0|2,0,0]=4 15337 B16R2.2925 Oc1c(cccc1NCc2ncc[nH]2)Cl 34a_100000754742_100016991755 [0,2,0,0,0,0|2,0,0]=4 15338 B16R2.2925 Oc1c(cccc1NCc2ncc[nH]2)F 34a_100011934987_100016991755 [0,2,0,0,0,0|2,0,0]=4 15339 B16R2.2925 Oc1c(cccc1NCc2ncco2)Br 34a_100011934915_103436540062 [0,2,0,0,0,0|2,0,0]=4 15340 B16R2.2925 Oc1c(cccc1NCc2ncco2)Cl 34a_100000754742_103436540062 [0,2,0,0,0,0|2,0,0]=4 15341 B16R2.2925 Oc1c(cccc1NCc2ncco2)F 34a_100011934987_103436540062 [0,2,0,0,0,0|2,0,0]=4 15342 B16R2.2925 Oc1c(cccc1NCc2nccs2)Br 34a_100011934915_100015184050 [0,2,0,0,0,0|2,0,0]=4 15343 B16R2.2925 Oc1c(cccc1NCc2nccs2)Cl 270302a_100000754742_100000750902 [0,2,0,0,0,0|2,0,0]=4 15344 B16R2.2925 Oc1c(cccc1NCc2nccs2)Cl 34a_100000754742_100015184050 [0,2,0,0,0,0|2,0,0]=4 15345 B16R2.2925 Oc1c(cccc1NCc2nccs2)F 270302a_100011934987_100000750902 [0,2,0,0,0,0|2,0,0]=4 15346 B16R2.2925 Oc1c(cccc1NCc2nccs2)F 34a_100011934987_100015184050 [0,2,0,0,0,0|2,0,0]=4 15347 B16R2.2925 Oc1c(cccc1NCc2ncon2)Br 34a_100011934915_100000233494 [0,2,0,0,0,0|2,0,0]=4 15348 B16R2.2925 Oc1c(cccc1NCc2ncon2)Cl 34a_100000754742_100000233494 [0,2,0,0,0,0|2,0,0]=4 15349 B16R2.2925 Oc1c(cccc1NCc2ncon2)F 34a_100011934987_100000233494 [0,2,0,0,0,0|2,0,0]=4 15350 B16R2.2925 Oc1c(cccc1NCn2cncn2)Br 34a_100011934915_200020645497 [0,2,0,0,0,0|1,0,1]=4 15351 B16R2.2925 Oc1c(cccc1NCn2cncn2)Cl 34a_100000754742_200020645497 [0,2,0,0,0,0|1,0,1]=4 15352 B16R2.2925 Oc1c(cccc1NCn2cncn2)F 34a_100011934987_200020645497 [0,2,0,0,0,0|1,0,1]=4 15353 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)Br 62a_100000707719_100010084509 [0,2,0,0,0,0|1,0,0]=3 15354 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)Br 62a_100010084509_100000707719 [0,2,0,0,0,0|1,0,0]=3 15355 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)Cl 62a_100000707719_100010202889 [0,2,0,0,0,0|1,0,0]=3 15356 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)Cl 62a_100010202889_100000707719 [0,2,0,0,0,0|1,0,0]=3 15357 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)F 62a_100000707719_100009813666 [0,2,0,0,0,0|1,0,0]=3 15358 B16R2.2925 Oc1c(cccc1SCc2c[nH]cn2)F 62a_100009813666_100000707719 [0,2,0,0,0,0|1,0,0]=3 15359 B16R2.2925 Oc1c(cccc1SCc2cscn2)Br 62a_100000205941_100010084509 [0,2,0,0,0,0|2,0,0]=4 15360 B16R2.2925 Oc1c(cccc1SCc2cscn2)Br 62a_100010084509_100000205941 [0,2,0,0,0,0|2,0,0]=4 15361 B16R2.2925 Oc1c(cccc1SCc2cscn2)Cl 62a_100000205941_100010202889 [0,2,0,0,0,0|2,0,0]=4 15362 B16R2.2925 Oc1c(cccc1SCc2cscn2)Cl 62a_100010202889_100000205941 [0,2,0,0,0,0|2,0,0]=4 15363 B16R2.2925 Oc1c(cccc1SCc2cscn2)F 62a_100000205941_100009813666 [0,2,0,0,0,0|2,0,0]=4 15364 B16R2.2925 Oc1c(cccc1SCc2cscn2)F 62a_100009813666_100000205941 [0,2,0,0,0,0|2,0,0]=4 15365 B16R2.2925 Oc1c(ccnc1Cl)SCc2c[nH]cn2 62a_100000707719_100010067911 [0,2,0,0,0,0|2,0,0]=4 15366 B16R2.2925 Oc1c(ccnc1SCc2c[nH]cn2)F 62a_100000707719_100009867227 [0,2,0,0,0,0|2,0,0]=4 15367 B16R2.2925 Oc1cccc(c1Br)NCc2c[nH]cn2 34a_100012183704_100000707719 [0,2,0,0,0,0|0,0,0]=2 15368 B16R2.2925 Oc1cccc(c1Br)NCc2ccon2 34a_100012183704_100000234950 [0,2,0,0,0,0|2,0,0]=4 15369 B16R2.2925 Oc1cccc(c1Br)NCc2ccon2 7a_100012183704_100000234950 [0,2,0,0,0,0|2,0,0]=4 15370 B16R2.2925 Oc1cccc(c1Br)NCc2ccsc2 34a_100012183704_100011261437 [0,2,0,0,0,0|2,0,0]=4 15371 B16R2.2925 Oc1cccc(c1Br)NCc2ccsc2 7a_100012183704_100011261437 [0,2,0,0,0,0|2,0,0]=4 15372 B16R2.2925 Oc1cccc(c1Br)NCc2cncs2 34a_100012183704_100015185245 [0,2,0,0,0,0|1,0,1]=4 15373 B16R2.2925 Oc1cccc(c1Br)NCc2cncs2 7a_100012183704_100015185245 [0,2,0,0,0,0|1,0,1]=4 15374 B16R2.2925 Oc1cccc(c1Br)NCc2cscn2 34a_100012183704_100000205941 [0,2,0,0,0,0|1,0,0]=3 15375 B16R2.2925 Oc1cccc(c1Br)NCc2cscn2 7a_100012183704_100000205941 [0,2,0,0,0,0|1,0,0]=3 15376 B16R2.2925 Oc1cccc(c1Br)NCc2ncc[nH]2 34a_100012183704_100016991755 [0,2,0,0,0,0|2,0,0]=4 15377 B16R2.2925 Oc1cccc(c1Br)NCc2ncc[nH]2 7a_100012183704_100000753453 [0,2,0,0,0,0|2,0,0]=4 15378 B16R2.2925 Oc1cccc(c1Br)NCc2ncco2 34a_100012183704_103436540062 [0,2,0,0,0,0|2,0,0]=4 15379 B16R2.2925 Oc1cccc(c1Br)NCc2ncco2 7a_100012183704_103436540062 [0,2,0,0,0,0|2,0,0]=4 15380 B16R2.2925 Oc1cccc(c1Br)NCc2nccs2 34a_100012183704_100015184050 [0,2,0,0,0,0|2,0,0]=4 15381 B16R2.2925 Oc1cccc(c1Br)NCc2nccs2 7a_100012183704_100015184050 [0,2,0,0,0,0|2,0,0]=4 15382 B16R2.2925 Oc1cccc(c1Br)NCc2ncon2 34a_100012183704_100000233494 [0,2,0,0,0,0|2,0,0]=4 15383 B16R2.2925 Oc1cccc(c1Br)NCn2cncn2 34a_100012183704_200020645497 [0,2,0,0,0,0|1,0,1]=4 15384 B16R2.2925 Oc1cccc(c1Br)NCn2cncn2 7a_100012183704_200020645497 [0,2,0,0,0,0|1,0,1]=4 15385 B16R2.2925 Oc1cccc(c1Br)SCc2c[nH]cn2 62a_100000707719_100010187914 [0,2,0,0,0,0|1,0,0]=3 15386 B16R2.2925 Oc1cccc(c1Br)SCc2c[nH]cn2 62a_100010187914_100000707719 [0,2,0,0,0,0|1,0,0]=3 15387 B16R2.2925 Oc1cccc(c1Br)SCc2cscn2 62a_100000205941_100010187914 [0,2,0,0,0,0|2,0,0]=4 15388 B16R2.2925 Oc1cccc(c1Br)SCc2cscn2 62a_100010187914_100000205941 [0,2,0,0,0,0|2,0,0]=4 15389 B16R2.2925 Oc1cccc(c1Cl)NCc2c[nH]cn2 34a_100012002038_100000707719 [0,2,0,0,0,0|0,0,0]=2 15390 B16R2.2925 Oc1cccc(c1Cl)NCc2ccon2 34a_100012002038_100000234950 [0,2,0,0,0,0|2,0,0]=4 15391 B16R2.2925 Oc1cccc(c1Cl)NCc2ccon2 7a_100012002038_100000234950 [0,2,0,0,0,0|2,0,0]=4 15392 B16R2.2925 Oc1cccc(c1Cl)NCc2ccsc2 34a_100012002038_100011261437 [0,2,0,0,0,0|2,0,0]=4 15393 B16R2.2925 Oc1cccc(c1Cl)NCc2ccsc2 7a_100012002038_100011261437 [0,2,0,0,0,0|2,0,0]=4 15394 B16R2.2925 Oc1cccc(c1Cl)NCc2cncs2 34a_100012002038_100015185245 [0,2,0,0,0,0|1,0,1]=4 15395 B16R2.2925 Oc1cccc(c1Cl)NCc2cncs2 7a_100012002038_100015185245 [0,2,0,0,0,0|1,0,1]=4 15396 B16R2.2925 Oc1cccc(c1Cl)NCc2cscn2 34a_100012002038_100000205941 [0,2,0,0,0,0|1,0,0]=3 15397 B16R2.2925 Oc1cccc(c1Cl)NCc2cscn2 7a_100012002038_100000205941 [0,2,0,0,0,0|1,0,0]=3 15398 B16R2.2925 Oc1cccc(c1Cl)NCc2ncc[nH]2 34a_100012002038_100016991755 [0,2,0,0,0,0|2,0,0]=4 15399 B16R2.2925 Oc1cccc(c1Cl)NCc2ncc[nH]2 7a_100012002038_100000753453 [0,2,0,0,0,0|2,0,0]=4 15400 B16R2.2925 Oc1cccc(c1Cl)NCc2ncco2 34a_100012002038_103436540062 [0,2,0,0,0,0|2,0,0]=4 15401 B16R2.2925 Oc1cccc(c1Cl)NCc2ncco2 7a_100012002038_103436540062 [0,2,0,0,0,0|2,0,0]=4 15402 B16R2.2925 Oc1cccc(c1Cl)NCc2nccs2 34a_100012002038_100015184050 [0,2,0,0,0,0|2,0,0]=4 15403 B16R2.2925 Oc1cccc(c1Cl)NCc2nccs2 7a_100012002038_100015184050 [0,2,0,0,0,0|2,0,0]=4 15404 B16R2.2925 Oc1cccc(c1Cl)NCc2ncon2 34a_100012002038_100000233494 [0,2,0,0,0,0|2,0,0]=4 15405 B16R2.2925 Oc1cccc(c1Cl)NCn2cncn2 34a_100012002038_200020645497 [0,2,0,0,0,0|1,0,1]=4 15406 B16R2.2925 Oc1cccc(c1Cl)NCn2cncn2 7a_100012002038_200020645497 [0,2,0,0,0,0|1,0,1]=4 15407 B16R2.2925 Oc1cccc(c1Cl)SCc2c[nH]cn2 62a_100000707719_100000049636 [0,2,0,0,0,0|1,0,0]=3 15408 B16R2.2925 Oc1cccc(c1Cl)SCc2cscn2 62a_100000205941_100000049636 [0,2,0,0,0,0|2,0,0]=4 15409 B16R2.2925 Oc1cccc(c1F)SCc2c[nH]cn2 62a_100000707719_100009817021 [0,2,0,0,0,0|1,0,0]=3 15410 B16R2.2925 Oc1cccc(c1F)SCc2c[nH]cn2 62a_100009817021_100000707719 [0,2,0,0,0,0|1,0,0]=3 15411 B16R2.2925 Oc1cccc(c1F)SCc2cscn2 62a_100000205941_100009817021 [0,2,0,0,0,0|2,0,0]=4 15412 B16R2.2925 Oc1cccc(c1F)SCc2cscn2 62a_100009817021_100000205941 [0,2,0,0,0,0|2,0,0]=4 15413 B16R2.2925 Oc1cccc(c1O)SCc2c[nH]cn2 62a_100000707719_100009815950 [0,2,0,0,0,0|1,0,0]=3 15414 B16R2.2925 Oc1cccc(c1O)SCc2cscn2 62a_100000205941_100009815950 [0,2,0,0,0,0|2,0,0]=4 15415 B16R2.2925 Oc1ccnc(c1F)SCc2c[nH]cn2 62a_100000707719_100009876375 [0,2,0,0,0,0|2,0,0]=4 15416 B16R2.2925 Oc1ccnc(c1F)SCc2c[nH]cn2 62a_100009876375_100000707719 [0,2,0,0,0,0|2,0,0]=4 15417 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2Cl 62a_100000181259_100000756875 [0,2,0,0,0,0|2,0,0]=4 15418 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2Cl 62a_100000756875_100000181259 [0,2,0,0,0,0|2,0,0]=4 15419 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2F 62a_100000756875_200000741388 [0,2,0,0,0,0|2,0,0]=4 15420 B16R2.2965 CC(Sc1c[nH]cn1)c2ccccc2F 62a_200000741388_100000756875 [0,2,0,0,0,0|2,0,0]=4 15421 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 2230a_100020606079_100000707719 [0,2,0,0,0,0|0,0,0]=2 15422 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 269982a_100020606079_100000707719 [0,2,0,0,0,0|0,0,0]=2 15423 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Br 34a_100020606079_100000707719 [0,2,0,0,0,0|0,0,0]=2 15424 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 2230a_100000219374_100000707719 [0,2,0,0,0,0|0,0,0]=2 15425 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 269982a_100000219374_100000707719 [0,2,0,0,0,0|0,0,0]=2 15426 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2Cl 34a_100000219374_100000707719 [0,2,0,0,0,0|0,0,0]=2 15427 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 2230a_100000220357_100000707719 [0,2,0,0,0,0|0,0,0]=2 15428 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 269982a_100000220357_100000707719 [0,2,0,0,0,0|0,0,0]=2 15429 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 34a_100000220357_100000707719 [0,2,0,0,0,0|0,0,0]=2 15430 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2F 38a_100000220357_100000707719 [0,2,0,0,0,0|0,0,0]=2 15431 B16R2.2965 CN(Cc1c[nH]cn1)c2ccccc2O 269982a_100000033821_100000707719 [0,2,0,0,0,0|0,0,0]=2 15432 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 2230a_100020606079_100000234950 [0,2,0,0,0,0|2,0,0]=4 15433 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 269982a_100020606079_100000234950 [0,2,0,0,0,0|2,0,0]=4 15434 B16R2.2965 CN(Cc1ccon1)c2ccccc2Br 34a_100020606079_100000234950 [0,2,0,0,0,0|2,0,0]=4 15435 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 2230a_100000219374_100000234950 [0,2,0,0,0,0|2,0,0]=4 15436 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 269982a_100000219374_100000234950 [0,2,0,0,0,0|2,0,0]=4 15437 B16R2.2965 CN(Cc1ccon1)c2ccccc2Cl 34a_100000219374_100000234950 [0,2,0,0,0,0|2,0,0]=4 15438 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 2230a_100000220357_100000234950 [0,2,0,0,0,0|2,0,0]=4 15439 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 269982a_100000220357_100000234950 [0,2,0,0,0,0|2,0,0]=4 15440 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 34a_100000220357_100000234950 [0,2,0,0,0,0|2,0,0]=4 15441 B16R2.2965 CN(Cc1ccon1)c2ccccc2F 38a_100000220357_100000234950 [0,2,0,0,0,0|2,0,0]=4 15442 B16R2.2965 CN(Cc1ccon1)c2ccccc2O 269982a_100000033821_100000234950 [0,2,0,0,0,0|2,0,0]=4 15443 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 2230a_100020606079_100011261437 [0,2,0,0,0,0|2,0,0]=4 15444 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 269982a_100020606079_100011233845 [0,2,0,0,0,0|2,0,0]=4 15445 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Br 34a_100020606079_100011261437 [0,2,0,0,0,0|2,0,0]=4 15446 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 2230a_100000219374_100011261437 [0,2,0,0,0,0|2,0,0]=4 15447 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 269982a_100000219374_100011233845 [0,2,0,0,0,0|2,0,0]=4 15448 B16R2.2965 CN(Cc1ccsc1)c2ccccc2Cl 34a_100000219374_100011261437 [0,2,0,0,0,0|2,0,0]=4 15449 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 2230a_100000220357_100011261437 [0,2,0,0,0,0|2,0,0]=4 15450 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 269982a_100000220357_100011233845 [0,2,0,0,0,0|2,0,0]=4 15451 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 34a_100000220357_100011261437 [0,2,0,0,0,0|2,0,0]=4 15452 B16R2.2965 CN(Cc1ccsc1)c2ccccc2F 38a_100000220357_100011233845 [0,2,0,0,0,0|2,0,0]=4 15453 B16R2.2965 CN(Cc1ccsc1)c2ccccc2O 269982a_100000033821_100011233845 [0,2,0,0,0,0|2,0,0]=4 15454 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 2230a_100020606079_100015185245 [0,2,0,0,0,0|1,0,1]=4 15455 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 269982a_100020606079_100015185245 [0,2,0,0,0,0|1,0,1]=4 15456 B16R2.2965 CN(Cc1cncs1)c2ccccc2Br 34a_100020606079_100015185245 [0,2,0,0,0,0|1,0,1]=4 15457 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 2230a_100000219374_100015185245 [0,2,0,0,0,0|1,0,1]=4 15458 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 269982a_100000219374_100015185245 [0,2,0,0,0,0|1,0,1]=4 15459 B16R2.2965 CN(Cc1cncs1)c2ccccc2Cl 34a_100000219374_100015185245 [0,2,0,0,0,0|1,0,1]=4 15460 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 2230a_100000220357_100015185245 [0,2,0,0,0,0|1,0,1]=4 15461 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 269982a_100000220357_100015185245 [0,2,0,0,0,0|1,0,1]=4 15462 B16R2.2965 CN(Cc1cncs1)c2ccccc2F 34a_100000220357_100015185245 [0,2,0,0,0,0|1,0,1]=4 15463 B16R2.2965 CN(Cc1cncs1)c2ccccc2O 269982a_100000033821_100015185245 [0,2,0,0,0,0|1,0,1]=4 15464 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 2230a_100020606079_100000205941 [0,2,0,0,0,0|1,0,0]=3 15465 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 269982a_100020606079_100000205941 [0,2,0,0,0,0|1,0,0]=3 15466 B16R2.2965 CN(Cc1cscn1)c2ccccc2Br 34a_100020606079_100000205941 [0,2,0,0,0,0|1,0,0]=3 15467 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 2230a_100000219374_100000205941 [0,2,0,0,0,0|1,0,0]=3 15468 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 269982a_100000219374_100000205941 [0,2,0,0,0,0|1,0,0]=3 15469 B16R2.2965 CN(Cc1cscn1)c2ccccc2Cl 34a_100000219374_100000205941 [0,2,0,0,0,0|1,0,0]=3 15470 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 2230a_100000220357_100000205941 [0,2,0,0,0,0|1,0,0]=3 15471 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 269982a_100000220357_100000205941 [0,2,0,0,0,0|1,0,0]=3 15472 B16R2.2965 CN(Cc1cscn1)c2ccccc2F 34a_100000220357_100000205941 [0,2,0,0,0,0|1,0,0]=3 15473 B16R2.2965 CN(Cc1cscn1)c2ccccc2O 269982a_100000033821_100000205941 [0,2,0,0,0,0|1,0,0]=3 15474 B16R2.2965 CN(Cc1cscn1)c2ccncc2Br 27a_100000225794_100000726257 [0,2,0,0,0,0|2,0,0]=4 15475 B16R2.2965 CN(Cc1cscn1)c2ccncc2F 27a_100000225794_100000035921 [0,2,0,0,0,0|2,0,0]=4 15476 B16R2.2965 CN(Cc1cscn1)c2ncccc2Br 27a_100000225794_100000696092 [0,2,0,0,0,0|2,0,0]=4 15477 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 2230a_100020606079_100016991755 [0,2,0,0,0,0|2,0,0]=4 15478 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 269982a_100020606079_100016991755 [0,2,0,0,0,0|2,0,0]=4 15479 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Br 34a_100020606079_100016991755 [0,2,0,0,0,0|2,0,0]=4 15480 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 2230a_100000219374_100016991755 [0,2,0,0,0,0|2,0,0]=4 15481 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 269982a_100000219374_100016991755 [0,2,0,0,0,0|2,0,0]=4 15482 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2Cl 34a_100000219374_100016991755 [0,2,0,0,0,0|2,0,0]=4 15483 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 2230a_100000220357_100016991755 [0,2,0,0,0,0|2,0,0]=4 15484 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 269982a_100000220357_100016991755 [0,2,0,0,0,0|2,0,0]=4 15485 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 34a_100000220357_100016991755 [0,2,0,0,0,0|2,0,0]=4 15486 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2F 38a_100000220357_100016991755 [0,2,0,0,0,0|2,0,0]=4 15487 B16R2.2965 CN(Cc1ncc[nH]1)c2ccccc2O 269982a_100000033821_100016991755 [0,2,0,0,0,0|2,0,0]=4 15488 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 2230a_100020606079_103436540062 [0,2,0,0,0,0|2,0,0]=4 15489 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 269982a_100020606079_103436540062 [0,2,0,0,0,0|2,0,0]=4 15490 B16R2.2965 CN(Cc1ncco1)c2ccccc2Br 34a_100020606079_103436540062 [0,2,0,0,0,0|2,0,0]=4 15491 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 2230a_100000219374_103436540062 [0,2,0,0,0,0|2,0,0]=4 15492 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 269982a_100000219374_103436540062 [0,2,0,0,0,0|2,0,0]=4 15493 B16R2.2965 CN(Cc1ncco1)c2ccccc2Cl 34a_100000219374_103436540062 [0,2,0,0,0,0|2,0,0]=4 15494 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 2230a_100000220357_103436540062 [0,2,0,0,0,0|2,0,0]=4 15495 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 269982a_100000220357_103436540062 [0,2,0,0,0,0|2,0,0]=4 15496 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 34a_100000220357_103436540062 [0,2,0,0,0,0|2,0,0]=4 15497 B16R2.2965 CN(Cc1ncco1)c2ccccc2F 38a_100000220357_103436540062 [0,2,0,0,0,0|2,0,0]=4 15498 B16R2.2965 CN(Cc1ncco1)c2ccccc2O 269982a_100000033821_103436540062 [0,2,0,0,0,0|2,0,0]=4 15499 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 2230a_100020606079_100015184050 [0,2,0,0,0,0|2,0,0]=4 15500 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 269982a_100020606079_100015184050 [0,2,0,0,0,0|2,0,0]=4 15501 B16R2.2965 CN(Cc1nccs1)c2ccccc2Br 34a_100020606079_100015184050 [0,2,0,0,0,0|2,0,0]=4 15502 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 2230a_100000219374_100015184050 [0,2,0,0,0,0|2,0,0]=4 15503 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 269982a_100000219374_100015184050 [0,2,0,0,0,0|2,0,0]=4 15504 B16R2.2965 CN(Cc1nccs1)c2ccccc2Cl 34a_100000219374_100015184050 [0,2,0,0,0,0|2,0,0]=4 15505 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 2230a_100000220357_100015184050 [0,2,0,0,0,0|2,0,0]=4 15506 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 269982a_100000220357_100015184050 [0,2,0,0,0,0|2,0,0]=4 15507 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 34a_100000220357_100015184050 [0,2,0,0,0,0|2,0,0]=4 15508 B16R2.2965 CN(Cc1nccs1)c2ccccc2F 38a_100000220357_100015184050 [0,2,0,0,0,0|2,0,0]=4 15509 B16R2.2965 CN(Cc1nccs1)c2ccccc2O 269982a_100000033821_100015184050 [0,2,0,0,0,0|2,0,0]=4 15510 B16R2.2965 CN(Cc1ncon1)c2ccccc2Br 269982a_100020606079_100000233494 [0,2,0,0,0,0|2,0,0]=4 15511 B16R2.2965 CN(Cc1ncon1)c2ccccc2Br 34a_100020606079_100000233494 [0,2,0,0,0,0|2,0,0]=4 15512 B16R2.2965 CN(Cc1ncon1)c2ccccc2Cl 269982a_100000219374_100000233494 [0,2,0,0,0,0|2,0,0]=4 15513 B16R2.2965 CN(Cc1ncon1)c2ccccc2Cl 34a_100000219374_100000233494 [0,2,0,0,0,0|2,0,0]=4 15514 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 269982a_100000220357_100000233494 [0,2,0,0,0,0|2,0,0]=4 15515 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 34a_100000220357_100000233494 [0,2,0,0,0,0|2,0,0]=4 15516 B16R2.2965 CN(Cc1ncon1)c2ccccc2F 38a_100000220357_100000233494 [0,2,0,0,0,0|2,0,0]=4 15517 B16R2.2965 CN(Cc1ncon1)c2ccccc2O 269982a_100000033821_100000233494 [0,2,0,0,0,0|2,0,0]=4 15518 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 2230a_100020606079_200020645497 [0,2,0,0,0,0|1,0,1]=4 15519 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 269982a_100020606079_200020645497 [0,2,0,0,0,0|1,0,1]=4 15520 B16R2.2965 CN(Cn1cncn1)c2ccccc2Br 34a_100020606079_200020645497 [0,2,0,0,0,0|1,0,1]=4 15521 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 2230a_100000219374_200020645497 [0,2,0,0,0,0|1,0,1]=4 15522 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 269982a_100000219374_200020645497 [0,2,0,0,0,0|1,0,1]=4 15523 B16R2.2965 CN(Cn1cncn1)c2ccccc2Cl 34a_100000219374_200020645497 [0,2,0,0,0,0|1,0,1]=4 15524 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 2230a_100000220357_200020645497 [0,2,0,0,0,0|1,0,1]=4 15525 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 269982a_100000220357_200020645497 [0,2,0,0,0,0|1,0,1]=4 15526 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 34a_100000220357_200020645497 [0,2,0,0,0,0|1,0,1]=4 15527 B16R2.2965 CN(Cn1cncn1)c2ccccc2F 38a_100000220357_200020645497 [0,2,0,0,0,0|1,0,1]=4 15528 B16R2.2965 CN(Cn1cncn1)c2ccccc2O 269982a_100000033821_200020645497 [0,2,0,0,0,0|1,0,1]=4 15529 B16R2.2965 Cc1ccccc1C(=O)Cc2c[nH]cn2 1458a_100000212026_100000707719 [0,2,0,0,0,0|1,0,0]=3 15530 B16R2.2965 Cc1ccccc1C(=O)Cc2cscn2 1458a_100000212026_100000205941 [0,2,0,0,0,0|2,0,0]=4 15531 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 2230a_100000219699_100000707719 [0,2,0,0,0,0|0,0,0]=2 15532 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 269982a_100000219699_100000707719 [0,2,0,0,0,0|0,0,0]=2 15533 B16R2.2965 Cc1ccccc1N(C)Cc2c[nH]cn2 34a_100000219699_100000707719 [0,2,0,0,0,0|0,0,0]=2 15534 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 2230a_100000219699_100000234950 [0,2,0,0,0,0|2,0,0]=4 15535 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 269982a_100000219699_100000234950 [0,2,0,0,0,0|2,0,0]=4 15536 B16R2.2965 Cc1ccccc1N(C)Cc2ccon2 34a_100000219699_100000234950 [0,2,0,0,0,0|2,0,0]=4 15537 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 2230a_100000219699_100011261437 [0,2,0,0,0,0|2,0,0]=4 15538 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 269982a_100000219699_100011233845 [0,2,0,0,0,0|2,0,0]=4 15539 B16R2.2965 Cc1ccccc1N(C)Cc2ccsc2 34a_100000219699_100011261437 [0,2,0,0,0,0|2,0,0]=4 15540 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 2230a_100000219699_100015185245 [0,2,0,0,0,0|1,0,1]=4 15541 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 269982a_100000219699_100015185245 [0,2,0,0,0,0|1,0,1]=4 15542 B16R2.2965 Cc1ccccc1N(C)Cc2cncs2 34a_100000219699_100015185245 [0,2,0,0,0,0|1,0,1]=4 15543 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 2230a_100000219699_100000205941 [0,2,0,0,0,0|1,0,0]=3 15544 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 269982a_100000219699_100000205941 [0,2,0,0,0,0|1,0,0]=3 15545 B16R2.2965 Cc1ccccc1N(C)Cc2cscn2 34a_100000219699_100000205941 [0,2,0,0,0,0|1,0,0]=3 15546 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 2230a_100000219699_100016991755 [0,2,0,0,0,0|2,0,0]=4 15547 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 269982a_100000219699_100016991755 [0,2,0,0,0,0|2,0,0]=4 15548 B16R2.2965 Cc1ccccc1N(C)Cc2ncc[nH]2 34a_100000219699_100016991755 [0,2,0,0,0,0|2,0,0]=4 15549 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 2230a_100000219699_103436540062 [0,2,0,0,0,0|2,0,0]=4 15550 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 269982a_100000219699_103436540062 [0,2,0,0,0,0|2,0,0]=4 15551 B16R2.2965 Cc1ccccc1N(C)Cc2ncco2 34a_100000219699_103436540062 [0,2,0,0,0,0|2,0,0]=4 15552 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 2230a_100000219699_100015184050 [0,2,0,0,0,0|2,0,0]=4 15553 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 269982a_100000219699_100015184050 [0,2,0,0,0,0|2,0,0]=4 15554 B16R2.2965 Cc1ccccc1N(C)Cc2nccs2 34a_100000219699_100015184050 [0,2,0,0,0,0|2,0,0]=4 15555 B16R2.2965 Cc1ccccc1N(C)Cc2ncon2 269982a_100000219699_100000233494 [0,2,0,0,0,0|2,0,0]=4 15556 B16R2.2965 Cc1ccccc1N(C)Cc2ncon2 34a_100000219699_100000233494 [0,2,0,0,0,0|2,0,0]=4 15557 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 2230a_100000219699_200020645497 [0,2,0,0,0,0|1,0,1]=4 15558 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 269982a_100000219699_200020645497 [0,2,0,0,0,0|1,0,1]=4 15559 B16R2.2965 Cc1ccccc1N(C)Cn2cncn2 34a_100000219699_200020645497 [0,2,0,0,0,0|1,0,1]=4 15560 B16R2.2965 Cc1cnccc1N(C)Cc2cscn2 27a_100000225794_100000765111 [0,2,0,0,0,0|2,0,0]=4 15561 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2Br 1458a_100000188424_100000707719 [0,2,0,0,0,0|1,0,0]=3 15562 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2Cl 1458a_100000185844_100000707719 [0,2,0,0,0,0|1,0,0]=3 15563 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2F 1458a_100000188656_100000707719 [0,2,0,0,0,0|1,0,0]=3 15564 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2I 1458a_100000187884_100000707719 [0,2,0,0,0,0|1,0,0]=3 15565 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2O 1458a_100015234032_100000707719 [0,2,0,0,0,0|1,0,0]=3 15566 B16R2.2965 O=C(Cc1c[nH]cn1)c2ccccc2[O-] 1458a_100009911694_100000707719 [0,2,0,0,0,0|1,0,0]=3 15567 B16R2.2965 O=C(Cc1cscn1)c2ccccc2Br 1458a_100000188424_100000205941 [0,2,0,0,0,0|2,0,0]=4 15568 B16R2.2965 O=C(Cc1cscn1)c2ccccc2Cl 1458a_100000185844_100000205941 [0,2,0,0,0,0|2,0,0]=4 15569 B16R2.2965 O=C(Cc1cscn1)c2ccccc2F 1458a_100000188656_100000205941 [0,2,0,0,0,0|2,0,0]=4 15570 B16R2.2965 O=C(Cc1cscn1)c2ccccc2I 1458a_100000187884_100000205941 [0,2,0,0,0,0|2,0,0]=4 15571 B16R2.2965 O=C(Cc1cscn1)c2ccccc2O 1458a_100015234032_100000205941 [0,2,0,0,0,0|2,0,0]=4 15572 B16R2.2965 O=C(Cc1cscn1)c2ccccc2[O-] 1458a_100009911694_100000205941 [0,2,0,0,0,0|2,0,0]=4 15573 B16R2.12623 Brc1cc(c(cn1)Br)NCc2c[nH]cn2 27a_100000758547_100010171693 [0,2,0,0,0,0|1,0,0]=3 15574 B16R2.12623 Brc1cc(c(cn1)Br)NCc2c[nH]nn2 27a_100020620823_100010171693 [0,2,0,0,0,0|2,0,0]=4 15575 B16R2.12623 Brc1cc(c(cn1)Br)NCc2cocn2 27a_100015188801_100010171693 [0,2,0,0,0,0|2,0,0]=4 15576 B16R2.12623 Brc1cc(c(cn1)Br)NCc2cscn2 27a_100015185402_100010171693 [0,2,0,0,0,0|2,0,0]=4 15577 B16R2.12623 Brc1cc(c(cn1)Br)OCc2c[nH]cn2 34a_100010235016_100000707719 [0,2,0,0,0,0|2,0,0]=4 15578 B16R2.12623 Brc1cc(c(cn1)Br)SCc2c[nH]cn2 62a_100000707719_100010171693 [0,2,0,0,0,0|2,0,0]=4 15579 B16R2.12623 Brc1cc(c(cn1)Br)SCc2c[nH]cn2 62a_100010171693_100000707719 [0,2,0,0,0,0|2,0,0]=4 15580 B16R2.12623 Brc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100000756875_100011982794 [0,2,0,0,0,0|2,0,0]=4 15581 B16R2.12623 Brc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100011982794_100000756875 [0,2,0,0,0,0|2,0,0]=4 15582 B16R2.12623 Brc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100000756875_100012362523 [0,2,0,0,0,0|2,0,0]=4 15583 B16R2.12623 Brc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100012362523_100000756875 [0,2,0,0,0,0|2,0,0]=4 15584 B16R2.12623 Brc1ccc(c(c1)NCc2c[nH]cn2)Br 34a_100000737762_100000707719 [0,2,0,0,0,0|0,0,0]=2 15585 B16R2.12623 Brc1ccc(c(c1)NCc2c[nH]cn2)I 34a_100000743836_100000707719 [0,2,0,0,0,0|0,0,0]=2 15586 B16R2.12623 Brc1ccc(c(c1)NCc2ccon2)Br 34a_100000737762_100000234950 [0,2,0,0,0,0|2,0,0]=4 15587 B16R2.12623 Brc1ccc(c(c1)NCc2ccon2)I 34a_100000743836_100000234950 [0,2,0,0,0,0|2,0,0]=4 15588 B16R2.12623 Brc1ccc(c(c1)NCc2ccsc2)Br 34a_100000737762_100011261437 [0,2,0,0,0,0|2,0,0]=4 15589 B16R2.12623 Brc1ccc(c(c1)NCc2ccsc2)I 34a_100000743836_100011261437 [0,2,0,0,0,0|2,0,0]=4 15590 B16R2.12623 Brc1ccc(c(c1)NCc2cncs2)Br 34a_100000737762_100015185245 [0,2,0,0,0,0|1,0,1]=4 15591 B16R2.12623 Brc1ccc(c(c1)NCc2cncs2)I 34a_100000743836_100015185245 [0,2,0,0,0,0|1,0,1]=4 15592 B16R2.12623 Brc1ccc(c(c1)NCc2cscn2)Br 34a_100000737762_100000205941 [0,2,0,0,0,0|1,0,0]=3 15593 B16R2.12623 Brc1ccc(c(c1)NCc2cscn2)I 34a_100000743836_100000205941 [0,2,0,0,0,0|1,0,0]=3 15594 B16R2.12623 Brc1ccc(c(c1)NCc2ncc[nH]2)Br 34a_100000737762_100016991755 [0,2,0,0,0,0|2,0,0]=4 15595 B16R2.12623 Brc1ccc(c(c1)NCc2ncc[nH]2)I 34a_100000743836_100016991755 [0,2,0,0,0,0|2,0,0]=4 15596 B16R2.12623 Brc1ccc(c(c1)NCc2ncco2)Br 34a_100000737762_103436540062 [0,2,0,0,0,0|2,0,0]=4 15597 B16R2.12623 Brc1ccc(c(c1)NCc2ncco2)I 34a_100000743836_103436540062 [0,2,0,0,0,0|2,0,0]=4 15598 B16R2.12623 Brc1ccc(c(c1)NCc2nccs2)Br 34a_100000737762_100015184050 [0,2,0,0,0,0|2,0,0]=4 15599 B16R2.12623 Brc1ccc(c(c1)NCc2nccs2)I 34a_100000743836_100015184050 [0,2,0,0,0,0|2,0,0]=4 15600 B16R2.12623 Brc1ccc(c(c1)NCc2ncon2)Br 34a_100000737762_100000233494 [0,2,0,0,0,0|2,0,0]=4 15601 B16R2.12623 Brc1ccc(c(c1)NCc2ncon2)I 34a_100000743836_100000233494 [0,2,0,0,0,0|2,0,0]=4 15602 B16R2.12623 Brc1ccc(c(c1)NCn2cncn2)Br 34a_100000737762_200020645497 [0,2,0,0,0,0|1,0,1]=4 15603 B16R2.12623 Brc1ccc(c(c1)NCn2cncn2)I 34a_100000743836_200020645497 [0,2,0,0,0,0|1,0,1]=4 15604 B16R2.12623 Brc1ccc(c(c1)OCc2c[nH]cn2)Br 34a_100011220040_100000707719 [0,2,0,0,0,0|1,0,0]=3 15605 B16R2.12623 Brc1ccc(c(c1)OCc2c[nH]cn2)I 34a_100012344904_100000707719 [0,2,0,0,0,0|1,0,0]=3 15606 B16R2.12623 Brc1ccc(c(c1)OCc2cscn2)Br 34a_100011220040_100000205941 [0,2,0,0,0,0|2,0,0]=4 15607 B16R2.12623 Brc1ccc(c(c1)OCc2cscn2)Br 7a_100011220040_100000205941 [0,2,0,0,0,0|2,0,0]=4 15608 B16R2.12623 Brc1ccc(c(c1)OCc2cscn2)I 34a_100012344904_100000205941 [0,2,0,0,0,0|2,0,0]=4 15609 B16R2.12623 Brc1ccc(c(c1)OCc2cscn2)I 7a_100012344904_100000205941 [0,2,0,0,0,0|2,0,0]=4 15610 B16R2.12623 Brc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100011483371 [0,2,0,0,0,0|1,0,0]=3 15611 B16R2.12623 Brc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100011483371_100000707719 [0,2,0,0,0,0|1,0,0]=3 15612 B16R2.12623 Brc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100011483371 [0,2,0,0,0,0|2,0,0]=4 15613 B16R2.12623 Brc1ccc(c(c1)SCc2cscn2)Br 62a_100011483371_100000205941 [0,2,0,0,0,0|2,0,0]=4 15614 B16R2.12623 Brc1ccc(cc1CSc2c[nH]cn2)I 62a_100000756875_100012355412 [0,2,0,0,0,0|2,0,0]=4 15615 B16R2.12623 Brc1ccc(cc1CSc2c[nH]cn2)I 62a_100012355412_100000756875 [0,2,0,0,0,0|2,0,0]=4 15616 B16R2.12623 Brc1ccc(cc1OCc2c[nH]cn2)I 34a_100012356990_100000707719 [0,2,0,0,0,0|1,0,0]=3 15617 B16R2.12623 Brc1ccc(cc1OCc2cscn2)I 34a_100012356990_100000205941 [0,2,0,0,0,0|2,0,0]=4 15618 B16R2.12623 Brc1ccc(cc1OCc2cscn2)I 7a_100012356990_100000205941 [0,2,0,0,0,0|2,0,0]=4 15619 B16R2.12623 Brc1cnc(c(c1)OCc2c[nH]cn2)I 34a_100010210634_100000707719 [0,2,0,0,0,0|2,0,0]=4 15620 B16R2.12623 Cc1cc(c(=O)[nH]n1)NCc2c[nH]cn2 27a_100000758547_100009819039 [0,2,0,0,0,0|2,0,0]=4 15621 B16R2.12623 Cc1cc(c(cn1)Br)OCc2c[nH]cn2 34a_100011016184_100000707719 [0,2,0,0,0,0|2,0,0]=4 15622 B16R2.12623 Cc1cc(c(cn1)C)SCc2c[nH]cn2 62a_100000707719_100009862788 [0,2,0,0,0,0|2,0,0]=4 15623 B16R2.12623 Cc1cc(c(cn1)C)SCc2c[nH]cn2 62a_100009862788_100000707719 [0,2,0,0,0,0|2,0,0]=4 15624 B16R2.12623 Cc1cc(c(cn1)F)NCc2c[nH]cn2 27a_100000758547_100009867690 [0,2,0,0,0,0|1,0,0]=3 15625 B16R2.12623 Cc1cc(c(cn1)F)NCc2c[nH]nn2 27a_100020620823_100009867690 [0,2,0,0,0,0|2,0,0]=4 15626 B16R2.12623 Cc1cc(c(cn1)F)NCc2cocn2 27a_100015188801_100009867690 [0,2,0,0,0,0|2,0,0]=4 15627 B16R2.12623 Cc1cc(c(cn1)F)NCc2cscn2 27a_100015185402_100009867690 [0,2,0,0,0,0|2,0,0]=4 15628 B16R2.12623 Cc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100000707719_100009867690 [0,2,0,0,0,0|2,0,0]=4 15629 B16R2.12623 Cc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100009867690_100000707719 [0,2,0,0,0,0|2,0,0]=4 15630 B16R2.12623 Cc1cc(c(cn1)O)SCc2c[nH]cn2 62a_100000707719_100009843476 [0,2,0,0,0,0|2,0,0]=4 15631 B16R2.12623 Cc1cc(c(cn1)O)SCc2c[nH]cn2 62a_100009843476_100000707719 [0,2,0,0,0,0|2,0,0]=4 15632 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)C 62a_100000184699_100000756875 [0,2,0,0,0,0|2,0,0]=4 15633 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)C 62a_100000756875_100000184699 [0,2,0,0,0,0|2,0,0]=4 15634 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100000756875_100009871730 [0,2,0,0,0,0|2,0,0]=4 15635 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100009871730_100000756875 [0,2,0,0,0,0|2,0,0]=4 15636 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)F 62a_100000756875_100011260760 [0,2,0,0,0,0|2,0,0]=4 15637 B16R2.12623 Cc1ccc(c(c1)CSc2c[nH]cn2)F 62a_100011260760_100000756875 [0,2,0,0,0,0|2,0,0]=4 15638 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)Br 34a_100000745044_100000707719 [0,2,0,0,0,0|0,0,0]=2 15639 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)C 2230a_100000185781_100000707719 [0,2,0,0,0,0|0,0,0]=2 15640 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)C 34a_100000185781_100000707719 [0,2,0,0,0,0|0,0,0]=2 15641 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)Cl 34a_100011215360_100000707719 [0,2,0,0,0,0|0,0,0]=2 15642 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)F 34a_100000211285_100000707719 [0,2,0,0,0,0|0,0,0]=2 15643 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)I 34a_100011216686_100000707719 [0,2,0,0,0,0|0,0,0]=2 15644 B16R2.12623 Cc1ccc(c(c1)NCc2c[nH]cn2)O 34a_100011215204_100000707719 [0,2,0,0,0,0|0,0,0]=2 15645 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)C 207a_100000185781_100000738523 [0,2,0,0,0,0|2,0,0]=4 15646 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)Cl 207a_100011215360_100000738523 [0,2,0,0,0,0|2,0,0]=4 15647 B16R2.12623 Cc1ccc(c(c1)NCc2cc[nH]n2)F 207a_100000211285_100000738523 [0,2,0,0,0,0|2,0,0]=4 15648 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)Br 270302a_100000745044_100000186105 [0,2,0,0,0,0|2,0,0]=4 15649 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)C 207a_100000185781_100000186105 [0,2,0,0,0,0|2,0,0]=4 15650 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)C 270302a_100000185781_100000186105 [0,2,0,0,0,0|2,0,0]=4 15651 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)Cl 207a_100011215360_100000186105 [0,2,0,0,0,0|2,0,0]=4 15652 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)Cl 270302a_100011215360_100000186105 [0,2,0,0,0,0|2,0,0]=4 15653 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)F 207a_100000211285_100000186105 [0,2,0,0,0,0|2,0,0]=4 15654 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)F 270302a_100000211285_100000186105 [0,2,0,0,0,0|2,0,0]=4 15655 B16R2.12623 Cc1ccc(c(c1)NCc2ccco2)I 270302a_100011216686_100000186105 [0,2,0,0,0,0|2,0,0]=4 15656 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)Br 270302a_100000745044_100000209959 [0,2,0,0,0,0|2,0,0]=4 15657 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)C 207a_100000185781_100000209959 [0,2,0,0,0,0|2,0,0]=4 15658 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)C 270302a_100000185781_100000209959 [0,2,0,0,0,0|2,0,0]=4 15659 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)Cl 207a_100011215360_100000209959 [0,2,0,0,0,0|2,0,0]=4 15660 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)Cl 270302a_100011215360_100000209959 [0,2,0,0,0,0|2,0,0]=4 15661 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)F 207a_100000211285_100000209959 [0,2,0,0,0,0|2,0,0]=4 15662 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)F 270302a_100000211285_100000209959 [0,2,0,0,0,0|2,0,0]=4 15663 B16R2.12623 Cc1ccc(c(c1)NCc2cccs2)I 270302a_100011216686_100000209959 [0,2,0,0,0,0|2,0,0]=4 15664 B16R2.12623 Cc1ccc(c(c1)NCc2ccoc2)C 207a_100000185781_100011215517 [0,2,0,0,0,0|2,0,0]=4 15665 B16R2.12623 Cc1ccc(c(c1)NCc2ccoc2)Cl 207a_100011215360_100011215517 [0,2,0,0,0,0|2,0,0]=4 15666 B16R2.12623 Cc1ccc(c(c1)NCc2ccoc2)F 207a_100000211285_100011215517 [0,2,0,0,0,0|2,0,0]=4 15667 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)Br 34a_100000745044_100000234950 [0,2,0,0,0,0|2,0,0]=4 15668 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)C 2230a_100000185781_100000234950 [0,2,0,0,0,0|2,0,0]=4 15669 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)C 34a_100000185781_100000234950 [0,2,0,0,0,0|2,0,0]=4 15670 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)C 7a_100000185781_100000234950 [0,2,0,0,0,0|2,0,0]=4 15671 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)Cl 34a_100011215360_100000234950 [0,2,0,0,0,0|2,0,0]=4 15672 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)F 34a_100000211285_100000234950 [0,2,0,0,0,0|2,0,0]=4 15673 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)I 34a_100011216686_100000234950 [0,2,0,0,0,0|2,0,0]=4 15674 B16R2.12623 Cc1ccc(c(c1)NCc2ccon2)O 34a_100011215204_100000234950 [0,2,0,0,0,0|2,0,0]=4 15675 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)Br 270302a_100000745044_100000188534 [0,2,0,0,0,0|2,0,0]=4 15676 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)Br 34a_100000745044_100011261437 [0,2,0,0,0,0|2,0,0]=4 15677 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)C 207a_100000185781_100000188534 [0,2,0,0,0,0|2,0,0]=4 15678 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)C 2230a_100000185781_100011261437 [0,2,0,0,0,0|2,0,0]=4 15679 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)C 270302a_100000185781_100000188534 [0,2,0,0,0,0|2,0,0]=4 15680 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)C 34a_100000185781_100011261437 [0,2,0,0,0,0|2,0,0]=4 15681 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)C 7a_100000185781_100011261437 [0,2,0,0,0,0|2,0,0]=4 15682 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)Cl 207a_100011215360_100000188534 [0,2,0,0,0,0|2,0,0]=4 15683 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)Cl 270302a_100011215360_100000188534 [0,2,0,0,0,0|2,0,0]=4 15684 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)Cl 34a_100011215360_100011261437 [0,2,0,0,0,0|2,0,0]=4 15685 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)F 207a_100000211285_100000188534 [0,2,0,0,0,0|2,0,0]=4 15686 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)F 270302a_100000211285_100000188534 [0,2,0,0,0,0|2,0,0]=4 15687 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)F 34a_100000211285_100011261437 [0,2,0,0,0,0|2,0,0]=4 15688 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)I 270302a_100011216686_100000188534 [0,2,0,0,0,0|2,0,0]=4 15689 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)I 34a_100011216686_100011261437 [0,2,0,0,0,0|2,0,0]=4 15690 B16R2.12623 Cc1ccc(c(c1)NCc2ccsc2)O 34a_100011215204_100011261437 [0,2,0,0,0,0|2,0,0]=4 15691 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)Br 270302a_100000745044_100016992096 [0,2,0,0,0,0|2,0,0]=4 15692 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)C 207a_100000185781_100016992096 [0,2,0,0,0,0|2,0,0]=4 15693 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)C 270302a_100000185781_100016992096 [0,2,0,0,0,0|2,0,0]=4 15694 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)Cl 207a_100011215360_100016992096 [0,2,0,0,0,0|2,0,0]=4 15695 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)Cl 270302a_100011215360_100016992096 [0,2,0,0,0,0|2,0,0]=4 15696 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)F 207a_100000211285_100016992096 [0,2,0,0,0,0|2,0,0]=4 15697 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)F 270302a_100000211285_100016992096 [0,2,0,0,0,0|2,0,0]=4 15698 B16R2.12623 Cc1ccc(c(c1)NCc2cn[nH]c2)I 270302a_100011216686_100016992096 [0,2,0,0,0,0|2,0,0]=4 15699 B16R2.12623 Cc1ccc(c(c1)NCc2cnc[nH]2)C 207a_100000185781_100000742939 [0,2,0,0,0,0|0,0,2]=4 15700 B16R2.12623 Cc1ccc(c(c1)NCc2cnc[nH]2)Cl 207a_100011215360_100000742939 [0,2,0,0,0,0|0,0,2]=4 15701 B16R2.12623 Cc1ccc(c(c1)NCc2cnc[nH]2)F 207a_100000211285_100000742939 [0,2,0,0,0,0|0,0,2]=4 15702 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)Br 270302a_100000745044_100000749870 [0,2,0,0,0,0|1,0,1]=4 15703 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)Br 34a_100000745044_100015185245 [0,2,0,0,0,0|1,0,1]=4 15704 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)C 207a_100000185781_100000749870 [0,2,0,0,0,0|1,0,1]=4 15705 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)C 2230a_100000185781_100015185245 [0,2,0,0,0,0|1,0,1]=4 15706 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)C 270302a_100000185781_100000749870 [0,2,0,0,0,0|1,0,1]=4 15707 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)C 34a_100000185781_100015185245 [0,2,0,0,0,0|1,0,1]=4 15708 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)C 7a_100000185781_100015185245 [0,2,0,0,0,0|1,0,1]=4 15709 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)Cl 207a_100011215360_100000749870 [0,2,0,0,0,0|1,0,1]=4 15710 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)Cl 270302a_100011215360_100000749870 [0,2,0,0,0,0|1,0,1]=4 15711 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)Cl 34a_100011215360_100015185245 [0,2,0,0,0,0|1,0,1]=4 15712 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)F 207a_100000211285_100000749870 [0,2,0,0,0,0|1,0,1]=4 15713 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)F 270302a_100000211285_100000749870 [0,2,0,0,0,0|1,0,1]=4 15714 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)F 34a_100000211285_100015185245 [0,2,0,0,0,0|1,0,1]=4 15715 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)I 270302a_100011216686_100000749870 [0,2,0,0,0,0|1,0,1]=4 15716 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)I 34a_100011216686_100015185245 [0,2,0,0,0,0|1,0,1]=4 15717 B16R2.12623 Cc1ccc(c(c1)NCc2cncs2)O 34a_100011215204_100015185245 [0,2,0,0,0,0|1,0,1]=4 15718 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)Br 270302a_100000745044_100000743575 [0,2,0,0,0,0|1,0,0]=3 15719 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)Br 34a_100000745044_100000205941 [0,2,0,0,0,0|1,0,0]=3 15720 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)C 207a_100000185781_100000743575 [0,2,0,0,0,0|1,0,0]=3 15721 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)C 2230a_100000185781_100000205941 [0,2,0,0,0,0|1,0,0]=3 15722 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)C 270302a_100000185781_100000743575 [0,2,0,0,0,0|1,0,0]=3 15723 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)C 34a_100000185781_100000205941 [0,2,0,0,0,0|1,0,0]=3 15724 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)C 7a_100000185781_100000205941 [0,2,0,0,0,0|1,0,0]=3 15725 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)Cl 207a_100011215360_100000743575 [0,2,0,0,0,0|1,0,0]=3 15726 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)Cl 270302a_100011215360_100000743575 [0,2,0,0,0,0|1,0,0]=3 15727 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)Cl 34a_100011215360_100000205941 [0,2,0,0,0,0|1,0,0]=3 15728 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)F 207a_100000211285_100000743575 [0,2,0,0,0,0|1,0,0]=3 15729 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)F 270302a_100000211285_100000743575 [0,2,0,0,0,0|1,0,0]=3 15730 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)F 34a_100000211285_100000205941 [0,2,0,0,0,0|1,0,0]=3 15731 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)I 270302a_100011216686_100000743575 [0,2,0,0,0,0|1,0,0]=3 15732 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)I 34a_100011216686_100000205941 [0,2,0,0,0,0|1,0,0]=3 15733 B16R2.12623 Cc1ccc(c(c1)NCc2cscn2)O 34a_100011215204_100000205941 [0,2,0,0,0,0|1,0,0]=3 15734 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)Br 34a_100000745044_100016991755 [0,2,0,0,0,0|2,0,0]=4 15735 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)C 207a_100000185781_100000743867 [0,2,0,0,0,0|2,0,0]=4 15736 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)C 2230a_100000185781_100016991755 [0,2,0,0,0,0|2,0,0]=4 15737 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)C 34a_100000185781_100016991755 [0,2,0,0,0,0|2,0,0]=4 15738 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)C 7a_100000185781_100000753453 [0,2,0,0,0,0|2,0,0]=4 15739 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)Cl 207a_100011215360_100000743867 [0,2,0,0,0,0|2,0,0]=4 15740 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)Cl 34a_100011215360_100016991755 [0,2,0,0,0,0|2,0,0]=4 15741 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)F 207a_100000211285_100000743867 [0,2,0,0,0,0|2,0,0]=4 15742 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)F 34a_100000211285_100016991755 [0,2,0,0,0,0|2,0,0]=4 15743 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)I 34a_100011216686_100016991755 [0,2,0,0,0,0|2,0,0]=4 15744 B16R2.12623 Cc1ccc(c(c1)NCc2ncc[nH]2)O 34a_100011215204_100016991755 [0,2,0,0,0,0|2,0,0]=4 15745 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)Br 34a_100000745044_103436540062 [0,2,0,0,0,0|2,0,0]=4 15746 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)C 2230a_100000185781_103436540062 [0,2,0,0,0,0|2,0,0]=4 15747 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)C 34a_100000185781_103436540062 [0,2,0,0,0,0|2,0,0]=4 15748 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)C 7a_100000185781_103436540062 [0,2,0,0,0,0|2,0,0]=4 15749 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)Cl 34a_100011215360_103436540062 [0,2,0,0,0,0|2,0,0]=4 15750 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)F 34a_100000211285_103436540062 [0,2,0,0,0,0|2,0,0]=4 15751 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)I 34a_100011216686_103436540062 [0,2,0,0,0,0|2,0,0]=4 15752 B16R2.12623 Cc1ccc(c(c1)NCc2ncco2)O 34a_100011215204_103436540062 [0,2,0,0,0,0|2,0,0]=4 15753 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)Br 270302a_100000745044_100000750902 [0,2,0,0,0,0|2,0,0]=4 15754 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)Br 34a_100000745044_100015184050 [0,2,0,0,0,0|2,0,0]=4 15755 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)C 207a_100000185781_100000750902 [0,2,0,0,0,0|2,0,0]=4 15756 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)C 2230a_100000185781_100015184050 [0,2,0,0,0,0|2,0,0]=4 15757 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)C 270302a_100000185781_100000750902 [0,2,0,0,0,0|2,0,0]=4 15758 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)C 34a_100000185781_100015184050 [0,2,0,0,0,0|2,0,0]=4 15759 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)C 7a_100000185781_100015184050 [0,2,0,0,0,0|2,0,0]=4 15760 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)Cl 207a_100011215360_100000750902 [0,2,0,0,0,0|2,0,0]=4 15761 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)Cl 270302a_100011215360_100000750902 [0,2,0,0,0,0|2,0,0]=4 15762 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)Cl 34a_100011215360_100015184050 [0,2,0,0,0,0|2,0,0]=4 15763 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)F 207a_100000211285_100000750902 [0,2,0,0,0,0|2,0,0]=4 15764 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)F 270302a_100000211285_100000750902 [0,2,0,0,0,0|2,0,0]=4 15765 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)F 34a_100000211285_100015184050 [0,2,0,0,0,0|2,0,0]=4 15766 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)I 270302a_100011216686_100000750902 [0,2,0,0,0,0|2,0,0]=4 15767 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)I 34a_100011216686_100015184050 [0,2,0,0,0,0|2,0,0]=4 15768 B16R2.12623 Cc1ccc(c(c1)NCc2nccs2)O 34a_100011215204_100015184050 [0,2,0,0,0,0|2,0,0]=4 15769 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)Br 34a_100000745044_100000233494 [0,2,0,0,0,0|2,0,0]=4 15770 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)C 34a_100000185781_100000233494 [0,2,0,0,0,0|2,0,0]=4 15771 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)Cl 34a_100011215360_100000233494 [0,2,0,0,0,0|2,0,0]=4 15772 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)F 34a_100000211285_100000233494 [0,2,0,0,0,0|2,0,0]=4 15773 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)I 34a_100011216686_100000233494 [0,2,0,0,0,0|2,0,0]=4 15774 B16R2.12623 Cc1ccc(c(c1)NCc2ncon2)O 34a_100011215204_100000233494 [0,2,0,0,0,0|2,0,0]=4 15775 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)Br 34a_100000745044_200020645497 [0,2,0,0,0,0|1,0,1]=4 15776 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)C 2230a_100000185781_200020645497 [0,2,0,0,0,0|1,0,1]=4 15777 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)C 34a_100000185781_200020645497 [0,2,0,0,0,0|1,0,1]=4 15778 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)C 7a_100000185781_200020645497 [0,2,0,0,0,0|1,0,1]=4 15779 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)Cl 34a_100011215360_200020645497 [0,2,0,0,0,0|1,0,1]=4 15780 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)F 34a_100000211285_200020645497 [0,2,0,0,0,0|1,0,1]=4 15781 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)I 34a_100011216686_200020645497 [0,2,0,0,0,0|1,0,1]=4 15782 B16R2.12623 Cc1ccc(c(c1)NCn2cncn2)O 34a_100011215204_200020645497 [0,2,0,0,0,0|1,0,1]=4 15783 B16R2.12623 Cc1ccc(c(c1)OCc2c[nH]cn2)Br 34a_100012002257_100000707719 [0,2,0,0,0,0|1,0,0]=3 15784 B16R2.12623 Cc1ccc(c(c1)OCc2c[nH]cn2)C 34a_100000210931_100000707719 [0,2,0,0,0,0|1,0,0]=3 15785 B16R2.12623 Cc1ccc(c(c1)OCc2c[nH]cn2)Cl 34a_100000211493_100000707719 [0,2,0,0,0,0|1,0,0]=3 15786 B16R2.12623 Cc1ccc(c(c1)OCc2c[nH]cn2)F 34a_100000759540_100000707719 [0,2,0,0,0,0|1,0,0]=3 15787 B16R2.12623 Cc1ccc(c(c1)OCc2c[nH]cn2)N 34a_100000211527_100000707719 [0,2,0,0,0,0|1,0,0]=3 15788 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)Br 34a_100012002257_100000205941 [0,2,0,0,0,0|2,0,0]=4 15789 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)Br 7a_100012002257_100000205941 [0,2,0,0,0,0|2,0,0]=4 15790 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)C 34a_100000210931_100000205941 [0,2,0,0,0,0|2,0,0]=4 15791 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)C 7a_100000210931_100000205941 [0,2,0,0,0,0|2,0,0]=4 15792 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)Cl 34a_100000211493_100000205941 [0,2,0,0,0,0|2,0,0]=4 15793 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)Cl 7a_100000211493_100000205941 [0,2,0,0,0,0|2,0,0]=4 15794 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)F 34a_100000759540_100000205941 [0,2,0,0,0,0|2,0,0]=4 15795 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)F 7a_100000759540_100000205941 [0,2,0,0,0,0|2,0,0]=4 15796 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)N 34a_100000211527_100000205941 [0,2,0,0,0,0|2,0,0]=4 15797 B16R2.12623 Cc1ccc(c(c1)OCc2cscn2)N 7a_100000211527_100000205941 [0,2,0,0,0,0|2,0,0]=4 15798 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100012353751 [0,2,0,0,0,0|1,0,0]=3 15799 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100012353751_100000707719 [0,2,0,0,0,0|1,0,0]=3 15800 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)C 62a_100000210833_100000707719 [0,2,0,0,0,0|1,0,0]=3 15801 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)C 62a_100000707719_100000210833 [0,2,0,0,0,0|1,0,0]=3 15802 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100012356289 [0,2,0,0,0,0|1,0,0]=3 15803 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100012356289_100000707719 [0,2,0,0,0,0|1,0,0]=3 15804 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100000736223 [0,2,0,0,0,0|1,0,0]=3 15805 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000736223_100000707719 [0,2,0,0,0,0|1,0,0]=3 15806 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)N 62a_100000707719_100011356834 [0,2,0,0,0,0|1,0,0]=3 15807 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)N 62a_100011356834_100000707719 [0,2,0,0,0,0|1,0,0]=3 15808 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)O 62a_100000707719_100000765521 [0,2,0,0,0,0|1,0,0]=3 15809 B16R2.12623 Cc1ccc(c(c1)SCc2c[nH]cn2)O 62a_100000765521_100000707719 [0,2,0,0,0,0|1,0,0]=3 15810 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100012353751 [0,2,0,0,0,0|2,0,0]=4 15811 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)Br 62a_100012353751_100000205941 [0,2,0,0,0,0|2,0,0]=4 15812 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)C 62a_100000205941_100000210833 [0,2,0,0,0,0|2,0,0]=4 15813 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)C 62a_100000210833_100000205941 [0,2,0,0,0,0|2,0,0]=4 15814 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)Cl 62a_100000205941_100012356289 [0,2,0,0,0,0|2,0,0]=4 15815 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)Cl 62a_100012356289_100000205941 [0,2,0,0,0,0|2,0,0]=4 15816 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)F 62a_100000205941_100000736223 [0,2,0,0,0,0|2,0,0]=4 15817 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)F 62a_100000736223_100000205941 [0,2,0,0,0,0|2,0,0]=4 15818 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)N 62a_100000205941_100011356834 [0,2,0,0,0,0|2,0,0]=4 15819 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)N 62a_100011356834_100000205941 [0,2,0,0,0,0|2,0,0]=4 15820 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)O 62a_100000205941_100000765521 [0,2,0,0,0,0|2,0,0]=4 15821 B16R2.12623 Cc1ccc(c(c1)SCc2cscn2)O 62a_100000765521_100000205941 [0,2,0,0,0,0|2,0,0]=4 15822 B16R2.12623 Cc1ccc(c(n1)OCc2c[nH]cn2)Br 34a_100009817604_100000707719 [0,2,0,0,0,0|2,0,0]=4 15823 B16R2.12623 Cc1ccc(c(n1)OCc2c[nH]cn2)N 34a_100000687486_100000707719 [0,2,0,0,0,0|2,0,0]=4 15824 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)C 62a_100000707719_100009854376 [0,2,0,0,0,0|2,0,0]=4 15825 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)C 62a_100009854376_100000707719 [0,2,0,0,0,0|2,0,0]=4 15826 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100000707719_100009817602 [0,2,0,0,0,0|2,0,0]=4 15827 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100009817602_100000707719 [0,2,0,0,0,0|2,0,0]=4 15828 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)N 62a_100000685570_100000707719 [0,2,0,0,0,0|2,0,0]=4 15829 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)N 62a_100000707719_100000685570 [0,2,0,0,0,0|2,0,0]=4 15830 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)O 62a_100000702858_100000707719 [0,2,0,0,0,0|2,0,0]=4 15831 B16R2.12623 Cc1ccc(c(n1)SCc2c[nH]cn2)O 62a_100000707719_100000702858 [0,2,0,0,0,0|2,0,0]=4 15832 B16R2.12623 Cc1ccc(cc1CSc2c[nH]cn2)Cl 62a_100000756875_100012186985 [0,2,0,0,0,0|2,0,0]=4 15833 B16R2.12623 Cc1ccc(cc1CSc2c[nH]cn2)Cl 62a_100012186985_100000756875 [0,2,0,0,0,0|2,0,0]=4 15834 B16R2.12623 Cc1ccc(cc1CSc2c[nH]cn2)F 62a_100000709795_100000756875 [0,2,0,0,0,0|2,0,0]=4 15835 B16R2.12623 Cc1ccc(cc1CSc2c[nH]cn2)F 62a_100000756875_100000709795 [0,2,0,0,0,0|2,0,0]=4 15836 B16R2.12623 Cc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000741167_100000707719 [0,2,0,0,0,0|0,0,0]=2 15837 B16R2.12623 Cc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000211374_100000707719 [0,2,0,0,0,0|0,0,0]=2 15838 B16R2.12623 Cc1ccc(cc1NCc2c[nH]cn2)F 34a_100000211107_100000707719 [0,2,0,0,0,0|0,0,0]=2 15839 B16R2.12623 Cc1ccc(cc1NCc2c[nH]cn2)O 34a_100011216113_100000707719 [0,2,0,0,0,0|0,0,0]=2 15840 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)Br 207a_100000741167_100000738523 [0,2,0,0,0,0|2,0,0]=4 15841 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)Cl 207a_100000211374_100000738523 [0,2,0,0,0,0|2,0,0]=4 15842 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)F 207a_100000211107_100000738523 [0,2,0,0,0,0|2,0,0]=4 15843 B16R2.12623 Cc1ccc(cc1NCc2cc[nH]n2)I 207a_100000761890_100000738523 [0,2,0,0,0,0|2,0,0]=4 15844 B16R2.12623 Cc1ccc(cc1NCc2ccco2)Br 207a_100000741167_100000186105 [0,2,0,0,0,0|2,0,0]=4 15845 B16R2.12623 Cc1ccc(cc1NCc2ccco2)Br 270302a_100000741167_100000186105 [0,2,0,0,0,0|2,0,0]=4 15846 B16R2.12623 Cc1ccc(cc1NCc2ccco2)Cl 207a_100000211374_100000186105 [0,2,0,0,0,0|2,0,0]=4 15847 B16R2.12623 Cc1ccc(cc1NCc2ccco2)Cl 270302a_100000211374_100000186105 [0,2,0,0,0,0|2,0,0]=4 15848 B16R2.12623 Cc1ccc(cc1NCc2ccco2)F 207a_100000211107_100000186105 [0,2,0,0,0,0|2,0,0]=4 15849 B16R2.12623 Cc1ccc(cc1NCc2ccco2)F 270302a_100000211107_100000186105 [0,2,0,0,0,0|2,0,0]=4 15850 B16R2.12623 Cc1ccc(cc1NCc2ccco2)I 207a_100000761890_100000186105 [0,2,0,0,0,0|2,0,0]=4 15851 B16R2.12623 Cc1ccc(cc1NCc2ccco2)I 270302a_100000761890_100000186105 [0,2,0,0,0,0|2,0,0]=4 15852 B16R2.12623 Cc1ccc(cc1NCc2ccco2)O 270302a_100011216113_100000186105 [0,2,0,0,0,0|2,0,0]=4 15853 B16R2.12623 Cc1ccc(cc1NCc2cccs2)Br 207a_100000741167_100000209959 [0,2,0,0,0,0|2,0,0]=4 15854 B16R2.12623 Cc1ccc(cc1NCc2cccs2)Br 270302a_100000741167_100000209959 [0,2,0,0,0,0|2,0,0]=4 15855 B16R2.12623 Cc1ccc(cc1NCc2cccs2)Cl 207a_100000211374_100000209959 [0,2,0,0,0,0|2,0,0]=4 15856 B16R2.12623 Cc1ccc(cc1NCc2cccs2)Cl 270302a_100000211374_100000209959 [0,2,0,0,0,0|2,0,0]=4 15857 B16R2.12623 Cc1ccc(cc1NCc2cccs2)F 207a_100000211107_100000209959 [0,2,0,0,0,0|2,0,0]=4 15858 B16R2.12623 Cc1ccc(cc1NCc2cccs2)F 270302a_100000211107_100000209959 [0,2,0,0,0,0|2,0,0]=4 15859 B16R2.12623 Cc1ccc(cc1NCc2cccs2)I 207a_100000761890_100000209959 [0,2,0,0,0,0|2,0,0]=4 15860 B16R2.12623 Cc1ccc(cc1NCc2cccs2)I 270302a_100000761890_100000209959 [0,2,0,0,0,0|2,0,0]=4 15861 B16R2.12623 Cc1ccc(cc1NCc2cccs2)O 270302a_100011216113_100000209959 [0,2,0,0,0,0|2,0,0]=4 15862 B16R2.12623 Cc1ccc(cc1NCc2ccoc2)Br 207a_100000741167_100011215517 [0,2,0,0,0,0|2,0,0]=4 15863 B16R2.12623 Cc1ccc(cc1NCc2ccoc2)Cl 207a_100000211374_100011215517 [0,2,0,0,0,0|2,0,0]=4 15864 B16R2.12623 Cc1ccc(cc1NCc2ccoc2)F 207a_100000211107_100011215517 [0,2,0,0,0,0|2,0,0]=4 15865 B16R2.12623 Cc1ccc(cc1NCc2ccoc2)I 207a_100000761890_100011215517 [0,2,0,0,0,0|2,0,0]=4 15866 B16R2.12623 Cc1ccc(cc1NCc2ccon2)Br 34a_100000741167_100000234950 [0,2,0,0,0,0|2,0,0]=4 15867 B16R2.12623 Cc1ccc(cc1NCc2ccon2)Br 7a_100000741167_100000234950 [0,2,0,0,0,0|2,0,0]=4 15868 B16R2.12623 Cc1ccc(cc1NCc2ccon2)Cl 34a_100000211374_100000234950 [0,2,0,0,0,0|2,0,0]=4 15869 B16R2.12623 Cc1ccc(cc1NCc2ccon2)Cl 7a_100000211374_100000234950 [0,2,0,0,0,0|2,0,0]=4 15870 B16R2.12623 Cc1ccc(cc1NCc2ccon2)F 34a_100000211107_100000234950 [0,2,0,0,0,0|2,0,0]=4 15871 B16R2.12623 Cc1ccc(cc1NCc2ccon2)F 7a_100000211107_100000234950 [0,2,0,0,0,0|2,0,0]=4 15872 B16R2.12623 Cc1ccc(cc1NCc2ccon2)I 7a_100000761890_100000234950 [0,2,0,0,0,0|2,0,0]=4 15873 B16R2.12623 Cc1ccc(cc1NCc2ccon2)O 34a_100011216113_100000234950 [0,2,0,0,0,0|2,0,0]=4 15874 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Br 207a_100000741167_100000188534 [0,2,0,0,0,0|2,0,0]=4 15875 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Br 270302a_100000741167_100000188534 [0,2,0,0,0,0|2,0,0]=4 15876 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Br 34a_100000741167_100011261437 [0,2,0,0,0,0|2,0,0]=4 15877 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Br 7a_100000741167_100011261437 [0,2,0,0,0,0|2,0,0]=4 15878 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Cl 207a_100000211374_100000188534 [0,2,0,0,0,0|2,0,0]=4 15879 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Cl 270302a_100000211374_100000188534 [0,2,0,0,0,0|2,0,0]=4 15880 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Cl 34a_100000211374_100011261437 [0,2,0,0,0,0|2,0,0]=4 15881 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)Cl 7a_100000211374_100011261437 [0,2,0,0,0,0|2,0,0]=4 15882 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)F 207a_100000211107_100000188534 [0,2,0,0,0,0|2,0,0]=4 15883 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)F 270302a_100000211107_100000188534 [0,2,0,0,0,0|2,0,0]=4 15884 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)F 34a_100000211107_100011261437 [0,2,0,0,0,0|2,0,0]=4 15885 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)F 7a_100000211107_100011261437 [0,2,0,0,0,0|2,0,0]=4 15886 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)I 207a_100000761890_100000188534 [0,2,0,0,0,0|2,0,0]=4 15887 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)I 270302a_100000761890_100000188534 [0,2,0,0,0,0|2,0,0]=4 15888 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)I 7a_100000761890_100011261437 [0,2,0,0,0,0|2,0,0]=4 15889 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)O 270302a_100011216113_100000188534 [0,2,0,0,0,0|2,0,0]=4 15890 B16R2.12623 Cc1ccc(cc1NCc2ccsc2)O 34a_100011216113_100011261437 [0,2,0,0,0,0|2,0,0]=4 15891 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)Br 207a_100000741167_100016992096 [0,2,0,0,0,0|2,0,0]=4 15892 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)Br 270302a_100000741167_100016992096 [0,2,0,0,0,0|2,0,0]=4 15893 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)Cl 207a_100000211374_100016992096 [0,2,0,0,0,0|2,0,0]=4 15894 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)Cl 270302a_100000211374_100016992096 [0,2,0,0,0,0|2,0,0]=4 15895 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)F 207a_100000211107_100016992096 [0,2,0,0,0,0|2,0,0]=4 15896 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)F 270302a_100000211107_100016992096 [0,2,0,0,0,0|2,0,0]=4 15897 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)I 207a_100000761890_100016992096 [0,2,0,0,0,0|2,0,0]=4 15898 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)I 270302a_100000761890_100016992096 [0,2,0,0,0,0|2,0,0]=4 15899 B16R2.12623 Cc1ccc(cc1NCc2cn[nH]c2)O 270302a_100011216113_100016992096 [0,2,0,0,0,0|2,0,0]=4 15900 B16R2.12623 Cc1ccc(cc1NCc2cnc[nH]2)Br 207a_100000741167_100000742939 [0,2,0,0,0,0|0,0,2]=4 15901 B16R2.12623 Cc1ccc(cc1NCc2cnc[nH]2)Cl 207a_100000211374_100000742939 [0,2,0,0,0,0|0,0,2]=4 15902 B16R2.12623 Cc1ccc(cc1NCc2cnc[nH]2)F 207a_100000211107_100000742939 [0,2,0,0,0,0|0,0,2]=4 15903 B16R2.12623 Cc1ccc(cc1NCc2cnc[nH]2)I 207a_100000761890_100000742939 [0,2,0,0,0,0|0,0,2]=4 15904 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Br 207a_100000741167_100000749870 [0,2,0,0,0,0|1,0,1]=4 15905 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Br 270302a_100000741167_100000749870 [0,2,0,0,0,0|1,0,1]=4 15906 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Br 34a_100000741167_100015185245 [0,2,0,0,0,0|1,0,1]=4 15907 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Br 7a_100000741167_100015185245 [0,2,0,0,0,0|1,0,1]=4 15908 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Cl 207a_100000211374_100000749870 [0,2,0,0,0,0|1,0,1]=4 15909 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Cl 270302a_100000211374_100000749870 [0,2,0,0,0,0|1,0,1]=4 15910 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Cl 34a_100000211374_100015185245 [0,2,0,0,0,0|1,0,1]=4 15911 B16R2.12623 Cc1ccc(cc1NCc2cncs2)Cl 7a_100000211374_100015185245 [0,2,0,0,0,0|1,0,1]=4 15912 B16R2.12623 Cc1ccc(cc1NCc2cncs2)F 207a_100000211107_100000749870 [0,2,0,0,0,0|1,0,1]=4 15913 B16R2.12623 Cc1ccc(cc1NCc2cncs2)F 270302a_100000211107_100000749870 [0,2,0,0,0,0|1,0,1]=4 15914 B16R2.12623 Cc1ccc(cc1NCc2cncs2)F 34a_100000211107_100015185245 [0,2,0,0,0,0|1,0,1]=4 15915 B16R2.12623 Cc1ccc(cc1NCc2cncs2)F 7a_100000211107_100015185245 [0,2,0,0,0,0|1,0,1]=4 15916 B16R2.12623 Cc1ccc(cc1NCc2cncs2)I 207a_100000761890_100000749870 [0,2,0,0,0,0|1,0,1]=4 15917 B16R2.12623 Cc1ccc(cc1NCc2cncs2)I 270302a_100000761890_100000749870 [0,2,0,0,0,0|1,0,1]=4 15918 B16R2.12623 Cc1ccc(cc1NCc2cncs2)I 7a_100000761890_100015185245 [0,2,0,0,0,0|1,0,1]=4 15919 B16R2.12623 Cc1ccc(cc1NCc2cncs2)O 270302a_100011216113_100000749870 [0,2,0,0,0,0|1,0,1]=4 15920 B16R2.12623 Cc1ccc(cc1NCc2cncs2)O 34a_100011216113_100015185245 [0,2,0,0,0,0|1,0,1]=4 15921 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Br 207a_100000741167_100000743575 [0,2,0,0,0,0|1,0,0]=3 15922 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Br 270302a_100000741167_100000743575 [0,2,0,0,0,0|1,0,0]=3 15923 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Br 34a_100000741167_100000205941 [0,2,0,0,0,0|1,0,0]=3 15924 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Br 7a_100000741167_100000205941 [0,2,0,0,0,0|1,0,0]=3 15925 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Cl 207a_100000211374_100000743575 [0,2,0,0,0,0|1,0,0]=3 15926 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Cl 270302a_100000211374_100000743575 [0,2,0,0,0,0|1,0,0]=3 15927 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Cl 34a_100000211374_100000205941 [0,2,0,0,0,0|1,0,0]=3 15928 B16R2.12623 Cc1ccc(cc1NCc2cscn2)Cl 7a_100000211374_100000205941 [0,2,0,0,0,0|1,0,0]=3 15929 B16R2.12623 Cc1ccc(cc1NCc2cscn2)F 207a_100000211107_100000743575 [0,2,0,0,0,0|1,0,0]=3 15930 B16R2.12623 Cc1ccc(cc1NCc2cscn2)F 270302a_100000211107_100000743575 [0,2,0,0,0,0|1,0,0]=3 15931 B16R2.12623 Cc1ccc(cc1NCc2cscn2)F 34a_100000211107_100000205941 [0,2,0,0,0,0|1,0,0]=3 15932 B16R2.12623 Cc1ccc(cc1NCc2cscn2)F 7a_100000211107_100000205941 [0,2,0,0,0,0|1,0,0]=3 15933 B16R2.12623 Cc1ccc(cc1NCc2cscn2)I 207a_100000761890_100000743575 [0,2,0,0,0,0|1,0,0]=3 15934 B16R2.12623 Cc1ccc(cc1NCc2cscn2)I 270302a_100000761890_100000743575 [0,2,0,0,0,0|1,0,0]=3 15935 B16R2.12623 Cc1ccc(cc1NCc2cscn2)I 7a_100000761890_100000205941 [0,2,0,0,0,0|1,0,0]=3 15936 B16R2.12623 Cc1ccc(cc1NCc2cscn2)O 270302a_100011216113_100000743575 [0,2,0,0,0,0|1,0,0]=3 15937 B16R2.12623 Cc1ccc(cc1NCc2cscn2)O 34a_100011216113_100000205941 [0,2,0,0,0,0|1,0,0]=3 15938 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Br 207a_100000741167_100000743867 [0,2,0,0,0,0|2,0,0]=4 15939 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Br 34a_100000741167_100016991755 [0,2,0,0,0,0|2,0,0]=4 15940 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Br 7a_100000741167_100000753453 [0,2,0,0,0,0|2,0,0]=4 15941 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Cl 207a_100000211374_100000743867 [0,2,0,0,0,0|2,0,0]=4 15942 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Cl 34a_100000211374_100016991755 [0,2,0,0,0,0|2,0,0]=4 15943 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)Cl 7a_100000211374_100000753453 [0,2,0,0,0,0|2,0,0]=4 15944 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)F 207a_100000211107_100000743867 [0,2,0,0,0,0|2,0,0]=4 15945 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)F 34a_100000211107_100016991755 [0,2,0,0,0,0|2,0,0]=4 15946 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)F 7a_100000211107_100000753453 [0,2,0,0,0,0|2,0,0]=4 15947 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)I 207a_100000761890_100000743867 [0,2,0,0,0,0|2,0,0]=4 15948 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)I 7a_100000761890_100000753453 [0,2,0,0,0,0|2,0,0]=4 15949 B16R2.12623 Cc1ccc(cc1NCc2ncc[nH]2)O 34a_100011216113_100016991755 [0,2,0,0,0,0|2,0,0]=4 15950 B16R2.12623 Cc1ccc(cc1NCc2ncco2)Br 34a_100000741167_103436540062 [0,2,0,0,0,0|2,0,0]=4 15951 B16R2.12623 Cc1ccc(cc1NCc2ncco2)Br 7a_100000741167_103436540062 [0,2,0,0,0,0|2,0,0]=4 15952 B16R2.12623 Cc1ccc(cc1NCc2ncco2)Cl 34a_100000211374_103436540062 [0,2,0,0,0,0|2,0,0]=4 15953 B16R2.12623 Cc1ccc(cc1NCc2ncco2)Cl 7a_100000211374_103436540062 [0,2,0,0,0,0|2,0,0]=4 15954 B16R2.12623 Cc1ccc(cc1NCc2ncco2)F 34a_100000211107_103436540062 [0,2,0,0,0,0|2,0,0]=4 15955 B16R2.12623 Cc1ccc(cc1NCc2ncco2)F 7a_100000211107_103436540062 [0,2,0,0,0,0|2,0,0]=4 15956 B16R2.12623 Cc1ccc(cc1NCc2ncco2)I 7a_100000761890_103436540062 [0,2,0,0,0,0|2,0,0]=4 15957 B16R2.12623 Cc1ccc(cc1NCc2ncco2)O 34a_100011216113_103436540062 [0,2,0,0,0,0|2,0,0]=4 15958 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Br 207a_100000741167_100000750902 [0,2,0,0,0,0|2,0,0]=4 15959 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Br 270302a_100000741167_100000750902 [0,2,0,0,0,0|2,0,0]=4 15960 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Br 34a_100000741167_100015184050 [0,2,0,0,0,0|2,0,0]=4 15961 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Br 7a_100000741167_100015184050 [0,2,0,0,0,0|2,0,0]=4 15962 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Cl 207a_100000211374_100000750902 [0,2,0,0,0,0|2,0,0]=4 15963 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Cl 270302a_100000211374_100000750902 [0,2,0,0,0,0|2,0,0]=4 15964 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Cl 34a_100000211374_100015184050 [0,2,0,0,0,0|2,0,0]=4 15965 B16R2.12623 Cc1ccc(cc1NCc2nccs2)Cl 7a_100000211374_100015184050 [0,2,0,0,0,0|2,0,0]=4 15966 B16R2.12623 Cc1ccc(cc1NCc2nccs2)F 207a_100000211107_100000750902 [0,2,0,0,0,0|2,0,0]=4 15967 B16R2.12623 Cc1ccc(cc1NCc2nccs2)F 270302a_100000211107_100000750902 [0,2,0,0,0,0|2,0,0]=4 15968 B16R2.12623 Cc1ccc(cc1NCc2nccs2)F 34a_100000211107_100015184050 [0,2,0,0,0,0|2,0,0]=4 15969 B16R2.12623 Cc1ccc(cc1NCc2nccs2)F 7a_100000211107_100015184050 [0,2,0,0,0,0|2,0,0]=4 15970 B16R2.12623 Cc1ccc(cc1NCc2nccs2)I 207a_100000761890_100000750902 [0,2,0,0,0,0|2,0,0]=4 15971 B16R2.12623 Cc1ccc(cc1NCc2nccs2)I 270302a_100000761890_100000750902 [0,2,0,0,0,0|2,0,0]=4 15972 B16R2.12623 Cc1ccc(cc1NCc2nccs2)I 7a_100000761890_100015184050 [0,2,0,0,0,0|2,0,0]=4 15973 B16R2.12623 Cc1ccc(cc1NCc2nccs2)O 270302a_100011216113_100000750902 [0,2,0,0,0,0|2,0,0]=4 15974 B16R2.12623 Cc1ccc(cc1NCc2nccs2)O 34a_100011216113_100015184050 [0,2,0,0,0,0|2,0,0]=4 15975 B16R2.12623 Cc1ccc(cc1NCc2ncon2)Br 34a_100000741167_100000233494 [0,2,0,0,0,0|2,0,0]=4 15976 B16R2.12623 Cc1ccc(cc1NCc2ncon2)Cl 34a_100000211374_100000233494 [0,2,0,0,0,0|2,0,0]=4 15977 B16R2.12623 Cc1ccc(cc1NCc2ncon2)F 34a_100000211107_100000233494 [0,2,0,0,0,0|2,0,0]=4 15978 B16R2.12623 Cc1ccc(cc1NCc2ncon2)O 34a_100011216113_100000233494 [0,2,0,0,0,0|2,0,0]=4 15979 B16R2.12623 Cc1ccc(cc1NCn2cncn2)Br 34a_100000741167_200020645497 [0,2,0,0,0,0|1,0,1]=4 15980 B16R2.12623 Cc1ccc(cc1NCn2cncn2)Br 7a_100000741167_200020645497 [0,2,0,0,0,0|1,0,1]=4 15981 B16R2.12623 Cc1ccc(cc1NCn2cncn2)Cl 34a_100000211374_200020645497 [0,2,0,0,0,0|1,0,1]=4 15982 B16R2.12623 Cc1ccc(cc1NCn2cncn2)Cl 7a_100000211374_200020645497 [0,2,0,0,0,0|1,0,1]=4 15983 B16R2.12623 Cc1ccc(cc1NCn2cncn2)F 34a_100000211107_200020645497 [0,2,0,0,0,0|1,0,1]=4 15984 B16R2.12623 Cc1ccc(cc1NCn2cncn2)F 7a_100000211107_200020645497 [0,2,0,0,0,0|1,0,1]=4 15985 B16R2.12623 Cc1ccc(cc1NCn2cncn2)I 7a_100000761890_200020645497 [0,2,0,0,0,0|1,0,1]=4 15986 B16R2.12623 Cc1ccc(cc1NCn2cncn2)O 34a_100011216113_200020645497 [0,2,0,0,0,0|1,0,1]=4 15987 B16R2.12623 Cc1ccc(cc1OCc2c[nH]cn2)Br 34a_100000685420_100000707719 [0,2,0,0,0,0|1,0,0]=3 15988 B16R2.12623 Cc1ccc(cc1OCc2c[nH]cn2)Cl 34a_100000756515_100000707719 [0,2,0,0,0,0|1,0,0]=3 15989 B16R2.12623 Cc1ccc(cc1OCc2c[nH]cn2)F 34a_100000690566_100000707719 [0,2,0,0,0,0|1,0,0]=3 15990 B16R2.12623 Cc1ccc(cc1OCc2c[nH]cn2)N 34a_100000759471_100000707719 [0,2,0,0,0,0|1,0,0]=3 15991 B16R2.12623 Cc1ccc(cc1OCc2cscn2)Br 34a_100000685420_100000205941 [0,2,0,0,0,0|2,0,0]=4 15992 B16R2.12623 Cc1ccc(cc1OCc2cscn2)Br 7a_100000685420_100000205941 [0,2,0,0,0,0|2,0,0]=4 15993 B16R2.12623 Cc1ccc(cc1OCc2cscn2)Cl 34a_100000756515_100000205941 [0,2,0,0,0,0|2,0,0]=4 15994 B16R2.12623 Cc1ccc(cc1OCc2cscn2)Cl 7a_100000756515_100000205941 [0,2,0,0,0,0|2,0,0]=4 15995 B16R2.12623 Cc1ccc(cc1OCc2cscn2)F 34a_100000690566_100000205941 [0,2,0,0,0,0|2,0,0]=4 15996 B16R2.12623 Cc1ccc(cc1OCc2cscn2)F 7a_100000690566_100000205941 [0,2,0,0,0,0|2,0,0]=4 15997 B16R2.12623 Cc1ccc(cc1OCc2cscn2)I 7a_100000766334_100000205941 [0,2,0,0,0,0|2,0,0]=4 15998 B16R2.12623 Cc1ccc(cc1OCc2cscn2)N 34a_100000759471_100000205941 [0,2,0,0,0,0|2,0,0]=4 15999 B16R2.12623 Cc1ccc(cc1OCc2cscn2)N 7a_100000759471_100000205941 [0,2,0,0,0,0|2,0,0]=4 16000 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100011344865 [0,2,0,0,0,0|1,0,0]=3 16001 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)Br 62a_100011344865_100000707719 [0,2,0,0,0,0|1,0,0]=3 16002 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100011263213 [0,2,0,0,0,0|1,0,0]=3 16003 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100011263213_100000707719 [0,2,0,0,0,0|1,0,0]=3 16004 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100011218078 [0,2,0,0,0,0|1,0,0]=3 16005 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)F 62a_100011218078_100000707719 [0,2,0,0,0,0|1,0,0]=3 16006 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)N 62a_100000707719_100000736455 [0,2,0,0,0,0|1,0,0]=3 16007 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)N 62a_100000736455_100000707719 [0,2,0,0,0,0|1,0,0]=3 16008 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)O 62a_100000707719_100011380479 [0,2,0,0,0,0|1,0,0]=3 16009 B16R2.12623 Cc1ccc(cc1SCc2c[nH]cn2)O 62a_100011380479_100000707719 [0,2,0,0,0,0|1,0,0]=3 16010 B16R2.12623 Cc1ccc(cc1SCc2cscn2)Br 62a_100000205941_100011344865 [0,2,0,0,0,0|2,0,0]=4 16011 B16R2.12623 Cc1ccc(cc1SCc2cscn2)Br 62a_100011344865_100000205941 [0,2,0,0,0,0|2,0,0]=4 16012 B16R2.12623 Cc1ccc(cc1SCc2cscn2)Cl 62a_100000205941_100011263213 [0,2,0,0,0,0|2,0,0]=4 16013 B16R2.12623 Cc1ccc(cc1SCc2cscn2)Cl 62a_100011263213_100000205941 [0,2,0,0,0,0|2,0,0]=4 16014 B16R2.12623 Cc1ccc(cc1SCc2cscn2)F 62a_100000205941_100011218078 [0,2,0,0,0,0|2,0,0]=4 16015 B16R2.12623 Cc1ccc(cc1SCc2cscn2)F 62a_100011218078_100000205941 [0,2,0,0,0,0|2,0,0]=4 16016 B16R2.12623 Cc1ccc(cc1SCc2cscn2)N 62a_100000205941_100000736455 [0,2,0,0,0,0|2,0,0]=4 16017 B16R2.12623 Cc1ccc(cc1SCc2cscn2)N 62a_100000736455_100000205941 [0,2,0,0,0,0|2,0,0]=4 16018 B16R2.12623 Cc1ccc(cc1SCc2cscn2)O 62a_100000205941_100011380479 [0,2,0,0,0,0|2,0,0]=4 16019 B16R2.12623 Cc1ccc(cc1SCc2cscn2)O 62a_100011380479_100000205941 [0,2,0,0,0,0|2,0,0]=4 16020 B16R2.12623 Cc1ccc(nc1SCc2c[nH]cn2)N 62a_100000126722_100000707719 [0,2,0,0,0,0|2,0,0]=4 16021 B16R2.12623 Cc1ccc(nc1SCc2c[nH]cn2)N 62a_100000707719_100000126722 [0,2,0,0,0,0|2,0,0]=4 16022 B16R2.12623 Cc1cnc(c(c1)NCc2c[nH]cn2)F 27a_100000758547_100009820679 [0,2,0,0,0,0|1,0,0]=3 16023 B16R2.12623 Cc1cnc(c(c1)NCc2c[nH]nn2)F 27a_100020620823_100009820679 [0,2,0,0,0,0|2,0,0]=4 16024 B16R2.12623 Cc1cnc(c(c1)NCc2cocn2)F 27a_100015188801_100009820679 [0,2,0,0,0,0|2,0,0]=4 16025 B16R2.12623 Cc1cnc(c(c1)NCc2cscn2)F 27a_100015185402_100009820679 [0,2,0,0,0,0|2,0,0]=4 16026 B16R2.12623 Cc1cnc(c(c1)OCc2c[nH]cn2)Cl 34a_100012000487_100000707719 [0,2,0,0,0,0|2,0,0]=4 16027 B16R2.12623 Cc1cnc(c(c1)OCc2c[nH]cn2)F 34a_100009849810_100000707719 [0,2,0,0,0,0|2,0,0]=4 16028 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)C 62a_100000707719_100009817436 [0,2,0,0,0,0|2,0,0]=4 16029 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)C 62a_100009817436_100000707719 [0,2,0,0,0,0|2,0,0]=4 16030 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100010210167 [0,2,0,0,0,0|2,0,0]=4 16031 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_100010210167_100000707719 [0,2,0,0,0,0|2,0,0]=4 16032 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100000049784_100000707719 [0,2,0,0,0,0|2,0,0]=4 16033 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100000049784 [0,2,0,0,0,0|2,0,0]=4 16034 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)N 62a_100000049664_100000707719 [0,2,0,0,0,0|2,0,0]=4 16035 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)N 62a_100000707719_100000049664 [0,2,0,0,0,0|2,0,0]=4 16036 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)O 62a_100000707719_100000719714 [0,2,0,0,0,0|2,0,0]=4 16037 B16R2.12623 Cc1cnc(c(c1)SCc2c[nH]cn2)O 62a_100000719714_100000707719 [0,2,0,0,0,0|2,0,0]=4 16038 B16R2.12623 Cc1cnc(c(n1)NCc2c[nH]cn2)C 27a_100000758547_100000211308 [0,2,0,0,0,0|2,0,0]=4 16039 B16R2.12623 Cc1cnc(cc1NCc2c[nH]cn2)F 27a_100000758547_100000049870 [0,2,0,0,0,0|1,0,0]=3 16040 B16R2.12623 Cc1cnc(cc1NCc2c[nH]nn2)F 27a_100020620823_100000049870 [0,2,0,0,0,0|2,0,0]=4 16041 B16R2.12623 Cc1cnc(cc1NCc2cocn2)F 27a_100015188801_100000049870 [0,2,0,0,0,0|2,0,0]=4 16042 B16R2.12623 Cc1cnc(cc1NCc2cscn2)F 27a_100015185402_100000049870 [0,2,0,0,0,0|2,0,0]=4 16043 B16R2.12623 Cc1cnc(cc1OCc2c[nH]cn2)Br 34a_100000704368_100000707719 [0,2,0,0,0,0|2,0,0]=4 16044 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010067628 [0,2,0,0,0,0|2,0,0]=4 16045 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)Br 62a_100010067628_100000707719 [0,2,0,0,0,0|2,0,0]=4 16046 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100010068021 [0,2,0,0,0,0|2,0,0]=4 16047 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100010068021_100000707719 [0,2,0,0,0,0|2,0,0]=4 16048 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)F 62a_100000049870_100000707719 [0,2,0,0,0,0|2,0,0]=4 16049 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000049870 [0,2,0,0,0,0|2,0,0]=4 16050 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)N 62a_100000707719_100009819938 [0,2,0,0,0,0|2,0,0]=4 16051 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)N 62a_100009819938_100000707719 [0,2,0,0,0,0|2,0,0]=4 16052 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)O 62a_100000707719_100009831917 [0,2,0,0,0,0|2,0,0]=4 16053 B16R2.12623 Cc1cnc(cc1SCc2c[nH]cn2)O 62a_100009831917_100000707719 [0,2,0,0,0,0|2,0,0]=4 16054 B16R2.12623 Cc1cnc(nc1NCc2c[nH]cn2)N 27a_100000758547_100000016107 [0,2,0,0,0,0|2,0,0]=4 16055 B16R2.12623 Cc1ncc(c(n1)NCc2c[nH]cn2)F 27a_100000758547_100000059819 [0,2,0,0,0,0|2,0,0]=4 16056 B16R2.12623 Cc1ncc(c(n1)NCc2c[nH]cn2)N 27a_100000758547_100009873743 [0,2,0,0,0,0|2,0,0]=4 16057 B16R2.12623 Cc1ncc(cc1OCc2c[nH]cn2)Br 34a_100009864810_100000707719 [0,2,0,0,0,0|2,0,0]=4 16058 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000707719_200010090566 [0,2,0,0,0,0|2,0,0]=4 16059 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)Br 62a_200010090566_100000707719 [0,2,0,0,0,0|2,0,0]=4 16060 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)F 62a_100000707719_100009860710 [0,2,0,0,0,0|2,0,0]=4 16061 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)F 62a_100009860710_100000707719 [0,2,0,0,0,0|2,0,0]=4 16062 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)N 62a_100000707719_100011998591 [0,2,0,0,0,0|2,0,0]=4 16063 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)N 62a_100011998591_100000707719 [0,2,0,0,0,0|2,0,0]=4 16064 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)O 62a_100000707719_100009819603 [0,2,0,0,0,0|2,0,0]=4 16065 B16R2.12623 Cc1ncc(cc1SCc2c[nH]cn2)O 62a_100009819603_100000707719 [0,2,0,0,0,0|2,0,0]=4 16066 B16R2.12623 Clc1cc(c(cn1)Br)OCc2c[nH]cn2 34a_100010173860_100000707719 [0,2,0,0,0,0|2,0,0]=4 16067 B16R2.12623 Clc1cc(c(cn1)Br)SCc2c[nH]cn2 62a_100000707719_100009815598 [0,2,0,0,0,0|2,0,0]=4 16068 B16R2.12623 Clc1cc(c(cn1)Br)SCc2c[nH]cn2 62a_100009815598_100000707719 [0,2,0,0,0,0|2,0,0]=4 16069 B16R2.12623 Clc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100000707719_100010172835 [0,2,0,0,0,0|2,0,0]=4 16070 B16R2.12623 Clc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100010172835_100000707719 [0,2,0,0,0,0|2,0,0]=4 16071 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100000733903_100000756875 [0,2,0,0,0,0|2,0,0]=4 16072 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100000756875_100000733903 [0,2,0,0,0,0|2,0,0]=4 16073 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100000756322_100000756875 [0,2,0,0,0,0|2,0,0]=4 16074 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100000756875_100000756322 [0,2,0,0,0,0|2,0,0]=4 16075 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100000756875_100012348826 [0,2,0,0,0,0|2,0,0]=4 16076 B16R2.12623 Clc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100012348826_100000756875 [0,2,0,0,0,0|2,0,0]=4 16077 B16R2.12623 Clc1ccc(c(c1)NCc2c[nH]cn2)Br 34a_100000687073_100000707719 [0,2,0,0,0,0|0,0,0]=2 16078 B16R2.12623 Clc1ccc(c(c1)NCc2c[nH]cn2)Cl 34a_100000184485_100000707719 [0,2,0,0,0,0|0,0,0]=2 16079 B16R2.12623 Clc1ccc(c(c1)NCc2c[nH]cn2)I 34a_100000761886_100000707719 [0,2,0,0,0,0|0,0,0]=2 16080 B16R2.12623 Clc1ccc(c(c1)NCc2ccco2)Cl 270302a_100000184485_100000186105 [0,2,0,0,0,0|2,0,0]=4 16081 B16R2.12623 Clc1ccc(c(c1)NCc2cccs2)Cl 270302a_100000184485_100000209959 [0,2,0,0,0,0|2,0,0]=4 16082 B16R2.12623 Clc1ccc(c(c1)NCc2ccon2)Br 34a_100000687073_100000234950 [0,2,0,0,0,0|2,0,0]=4 16083 B16R2.12623 Clc1ccc(c(c1)NCc2ccon2)Cl 34a_100000184485_100000234950 [0,2,0,0,0,0|2,0,0]=4 16084 B16R2.12623 Clc1ccc(c(c1)NCc2ccon2)I 34a_100000761886_100000234950 [0,2,0,0,0,0|2,0,0]=4 16085 B16R2.12623 Clc1ccc(c(c1)NCc2ccsc2)Br 34a_100000687073_100011261437 [0,2,0,0,0,0|2,0,0]=4 16086 B16R2.12623 Clc1ccc(c(c1)NCc2ccsc2)Cl 270302a_100000184485_100000188534 [0,2,0,0,0,0|2,0,0]=4 16087 B16R2.12623 Clc1ccc(c(c1)NCc2ccsc2)Cl 34a_100000184485_100011261437 [0,2,0,0,0,0|2,0,0]=4 16088 B16R2.12623 Clc1ccc(c(c1)NCc2ccsc2)I 34a_100000761886_100011261437 [0,2,0,0,0,0|2,0,0]=4 16089 B16R2.12623 Clc1ccc(c(c1)NCc2cn[nH]c2)Cl 270302a_100000184485_100016992096 [0,2,0,0,0,0|2,0,0]=4 16090 B16R2.12623 Clc1ccc(c(c1)NCc2cncs2)Br 34a_100000687073_100015185245 [0,2,0,0,0,0|1,0,1]=4 16091 B16R2.12623 Clc1ccc(c(c1)NCc2cncs2)Cl 270302a_100000184485_100000749870 [0,2,0,0,0,0|1,0,1]=4 16092 B16R2.12623 Clc1ccc(c(c1)NCc2cncs2)Cl 34a_100000184485_100015185245 [0,2,0,0,0,0|1,0,1]=4 16093 B16R2.12623 Clc1ccc(c(c1)NCc2cncs2)I 34a_100000761886_100015185245 [0,2,0,0,0,0|1,0,1]=4 16094 B16R2.12623 Clc1ccc(c(c1)NCc2cscn2)Br 34a_100000687073_100000205941 [0,2,0,0,0,0|1,0,0]=3 16095 B16R2.12623 Clc1ccc(c(c1)NCc2cscn2)Cl 270302a_100000184485_100000743575 [0,2,0,0,0,0|1,0,0]=3 16096 B16R2.12623 Clc1ccc(c(c1)NCc2cscn2)Cl 34a_100000184485_100000205941 [0,2,0,0,0,0|1,0,0]=3 16097 B16R2.12623 Clc1ccc(c(c1)NCc2cscn2)I 34a_100000761886_100000205941 [0,2,0,0,0,0|1,0,0]=3 16098 B16R2.12623 Clc1ccc(c(c1)NCc2ncc[nH]2)Br 34a_100000687073_100016991755 [0,2,0,0,0,0|2,0,0]=4 16099 B16R2.12623 Clc1ccc(c(c1)NCc2ncc[nH]2)Cl 34a_100000184485_100016991755 [0,2,0,0,0,0|2,0,0]=4 16100 B16R2.12623 Clc1ccc(c(c1)NCc2ncc[nH]2)I 34a_100000761886_100016991755 [0,2,0,0,0,0|2,0,0]=4 16101 B16R2.12623 Clc1ccc(c(c1)NCc2ncco2)Br 34a_100000687073_103436540062 [0,2,0,0,0,0|2,0,0]=4 16102 B16R2.12623 Clc1ccc(c(c1)NCc2ncco2)Cl 34a_100000184485_103436540062 [0,2,0,0,0,0|2,0,0]=4 16103 B16R2.12623 Clc1ccc(c(c1)NCc2ncco2)I 34a_100000761886_103436540062 [0,2,0,0,0,0|2,0,0]=4 16104 B16R2.12623 Clc1ccc(c(c1)NCc2nccs2)Br 34a_100000687073_100015184050 [0,2,0,0,0,0|2,0,0]=4 16105 B16R2.12623 Clc1ccc(c(c1)NCc2nccs2)Cl 270302a_100000184485_100000750902 [0,2,0,0,0,0|2,0,0]=4 16106 B16R2.12623 Clc1ccc(c(c1)NCc2nccs2)Cl 34a_100000184485_100015184050 [0,2,0,0,0,0|2,0,0]=4 16107 B16R2.12623 Clc1ccc(c(c1)NCc2nccs2)I 34a_100000761886_100015184050 [0,2,0,0,0,0|2,0,0]=4 16108 B16R2.12623 Clc1ccc(c(c1)NCc2ncon2)Br 34a_100000687073_100000233494 [0,2,0,0,0,0|2,0,0]=4 16109 B16R2.12623 Clc1ccc(c(c1)NCc2ncon2)Cl 34a_100000184485_100000233494 [0,2,0,0,0,0|2,0,0]=4 16110 B16R2.12623 Clc1ccc(c(c1)NCc2ncon2)I 34a_100000761886_100000233494 [0,2,0,0,0,0|2,0,0]=4 16111 B16R2.12623 Clc1ccc(c(c1)NCn2cncn2)Br 34a_100000687073_200020645497 [0,2,0,0,0,0|1,0,1]=4 16112 B16R2.12623 Clc1ccc(c(c1)NCn2cncn2)Cl 34a_100000184485_200020645497 [0,2,0,0,0,0|1,0,1]=4 16113 B16R2.12623 Clc1ccc(c(c1)NCn2cncn2)I 34a_100000761886_200020645497 [0,2,0,0,0,0|1,0,1]=4 16114 B16R2.12623 Clc1ccc(c(c1)OCc2c[nH]cn2)Br 34a_100012339455_100000707719 [0,2,0,0,0,0|1,0,0]=3 16115 B16R2.12623 Clc1ccc(c(c1)OCc2c[nH]cn2)Cl 34a_100000211422_100000707719 [0,2,0,0,0,0|1,0,0]=3 16116 B16R2.12623 Clc1ccc(c(c1)OCc2c[nH]cn2)I 34a_100000050036_100000707719 [0,2,0,0,0,0|1,0,0]=3 16117 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)Br 34a_100012339455_100000205941 [0,2,0,0,0,0|2,0,0]=4 16118 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)Br 7a_100012339455_100000205941 [0,2,0,0,0,0|2,0,0]=4 16119 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)Cl 34a_100000211422_100000205941 [0,2,0,0,0,0|2,0,0]=4 16120 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)Cl 7a_100000211422_100000205941 [0,2,0,0,0,0|2,0,0]=4 16121 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)I 34a_100000050036_100000205941 [0,2,0,0,0,0|2,0,0]=4 16122 B16R2.12623 Clc1ccc(c(c1)OCc2cscn2)I 7a_100000050036_100000205941 [0,2,0,0,0,0|2,0,0]=4 16123 B16R2.12623 Clc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100012339723 [0,2,0,0,0,0|1,0,0]=3 16124 B16R2.12623 Clc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100012339723_100000707719 [0,2,0,0,0,0|1,0,0]=3 16125 B16R2.12623 Clc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100000707729 [0,2,0,0,0,0|1,0,0]=3 16126 B16R2.12623 Clc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707729_100000707719 [0,2,0,0,0,0|1,0,0]=3 16127 B16R2.12623 Clc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100012339723 [0,2,0,0,0,0|2,0,0]=4 16128 B16R2.12623 Clc1ccc(c(c1)SCc2cscn2)Br 62a_100012339723_100000205941 [0,2,0,0,0,0|2,0,0]=4 16129 B16R2.12623 Clc1ccc(c(c1)SCc2cscn2)Cl 62a_100000205941_100000707729 [0,2,0,0,0,0|2,0,0]=4 16130 B16R2.12623 Clc1ccc(c(c1)SCc2cscn2)Cl 62a_100000707729_100000205941 [0,2,0,0,0,0|2,0,0]=4 16131 B16R2.12623 Clc1ccc(cc1CSc2c[nH]cn2)Br 62a_100000756875_100000763347 [0,2,0,0,0,0|2,0,0]=4 16132 B16R2.12623 Clc1ccc(cc1CSc2c[nH]cn2)Br 62a_100000763347_100000756875 [0,2,0,0,0,0|2,0,0]=4 16133 B16R2.12623 Clc1ccc(cc1CSc2c[nH]cn2)I 62a_100000756875_100010188191 [0,2,0,0,0,0|2,0,0]=4 16134 B16R2.12623 Clc1ccc(cc1CSc2c[nH]cn2)I 62a_100010188191_100000756875 [0,2,0,0,0,0|2,0,0]=4 16135 B16R2.12623 Clc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000750497_100000707719 [0,2,0,0,0,0|0,0,0]=2 16136 B16R2.12623 Clc1ccc(cc1NCc2c[nH]cn2)I 34a_200000761891_100000707719 [0,2,0,0,0,0|0,0,0]=2 16137 B16R2.12623 Clc1ccc(cc1NCc2ccco2)Br 270302a_100000750497_100000186105 [0,2,0,0,0,0|2,0,0]=4 16138 B16R2.12623 Clc1ccc(cc1NCc2ccco2)I 270302a_200000761891_100000186105 [0,2,0,0,0,0|2,0,0]=4 16139 B16R2.12623 Clc1ccc(cc1NCc2cccs2)Br 270302a_100000750497_100000209959 [0,2,0,0,0,0|2,0,0]=4 16140 B16R2.12623 Clc1ccc(cc1NCc2cccs2)I 270302a_200000761891_100000209959 [0,2,0,0,0,0|2,0,0]=4 16141 B16R2.12623 Clc1ccc(cc1NCc2ccon2)Br 34a_100000750497_100000234950 [0,2,0,0,0,0|2,0,0]=4 16142 B16R2.12623 Clc1ccc(cc1NCc2ccon2)I 34a_200000761891_100000234950 [0,2,0,0,0,0|2,0,0]=4 16143 B16R2.12623 Clc1ccc(cc1NCc2ccsc2)Br 270302a_100000750497_100000188534 [0,2,0,0,0,0|2,0,0]=4 16144 B16R2.12623 Clc1ccc(cc1NCc2ccsc2)Br 34a_100000750497_100011261437 [0,2,0,0,0,0|2,0,0]=4 16145 B16R2.12623 Clc1ccc(cc1NCc2ccsc2)I 270302a_200000761891_100000188534 [0,2,0,0,0,0|2,0,0]=4 16146 B16R2.12623 Clc1ccc(cc1NCc2ccsc2)I 34a_200000761891_100011261437 [0,2,0,0,0,0|2,0,0]=4 16147 B16R2.12623 Clc1ccc(cc1NCc2cn[nH]c2)Br 270302a_100000750497_100016992096 [0,2,0,0,0,0|2,0,0]=4 16148 B16R2.12623 Clc1ccc(cc1NCc2cn[nH]c2)I 270302a_200000761891_100016992096 [0,2,0,0,0,0|2,0,0]=4 16149 B16R2.12623 Clc1ccc(cc1NCc2cncs2)Br 270302a_100000750497_100000749870 [0,2,0,0,0,0|1,0,1]=4 16150 B16R2.12623 Clc1ccc(cc1NCc2cncs2)Br 34a_100000750497_100015185245 [0,2,0,0,0,0|1,0,1]=4 16151 B16R2.12623 Clc1ccc(cc1NCc2cncs2)I 270302a_200000761891_100000749870 [0,2,0,0,0,0|1,0,1]=4 16152 B16R2.12623 Clc1ccc(cc1NCc2cncs2)I 34a_200000761891_100015185245 [0,2,0,0,0,0|1,0,1]=4 16153 B16R2.12623 Clc1ccc(cc1NCc2cscn2)Br 270302a_100000750497_100000743575 [0,2,0,0,0,0|1,0,0]=3 16154 B16R2.12623 Clc1ccc(cc1NCc2cscn2)Br 34a_100000750497_100000205941 [0,2,0,0,0,0|1,0,0]=3 16155 B16R2.12623 Clc1ccc(cc1NCc2cscn2)I 270302a_200000761891_100000743575 [0,2,0,0,0,0|1,0,0]=3 16156 B16R2.12623 Clc1ccc(cc1NCc2cscn2)I 34a_200000761891_100000205941 [0,2,0,0,0,0|1,0,0]=3 16157 B16R2.12623 Clc1ccc(cc1NCc2ncc[nH]2)Br 34a_100000750497_100016991755 [0,2,0,0,0,0|2,0,0]=4 16158 B16R2.12623 Clc1ccc(cc1NCc2ncc[nH]2)I 34a_200000761891_100016991755 [0,2,0,0,0,0|2,0,0]=4 16159 B16R2.12623 Clc1ccc(cc1NCc2ncco2)Br 34a_100000750497_103436540062 [0,2,0,0,0,0|2,0,0]=4 16160 B16R2.12623 Clc1ccc(cc1NCc2ncco2)I 34a_200000761891_103436540062 [0,2,0,0,0,0|2,0,0]=4 16161 B16R2.12623 Clc1ccc(cc1NCc2nccs2)Br 270302a_100000750497_100000750902 [0,2,0,0,0,0|2,0,0]=4 16162 B16R2.12623 Clc1ccc(cc1NCc2nccs2)Br 34a_100000750497_100015184050 [0,2,0,0,0,0|2,0,0]=4 16163 B16R2.12623 Clc1ccc(cc1NCc2nccs2)I 270302a_200000761891_100000750902 [0,2,0,0,0,0|2,0,0]=4 16164 B16R2.12623 Clc1ccc(cc1NCc2nccs2)I 34a_200000761891_100015184050 [0,2,0,0,0,0|2,0,0]=4 16165 B16R2.12623 Clc1ccc(cc1NCc2ncon2)Br 34a_100000750497_100000233494 [0,2,0,0,0,0|2,0,0]=4 16166 B16R2.12623 Clc1ccc(cc1NCc2ncon2)I 34a_200000761891_100000233494 [0,2,0,0,0,0|2,0,0]=4 16167 B16R2.12623 Clc1ccc(cc1NCn2cncn2)Br 34a_100000750497_200020645497 [0,2,0,0,0,0|1,0,1]=4 16168 B16R2.12623 Clc1ccc(cc1NCn2cncn2)I 34a_200000761891_200020645497 [0,2,0,0,0,0|1,0,1]=4 16169 B16R2.12623 Clc1ccc(cc1OCc2c[nH]cn2)Br 34a_100000738945_100000707719 [0,2,0,0,0,0|1,0,0]=3 16170 B16R2.12623 Clc1ccc(cc1OCc2c[nH]cn2)I 34a_100011356854_100000707719 [0,2,0,0,0,0|1,0,0]=3 16171 B16R2.12623 Clc1ccc(cc1OCc2cscn2)Br 34a_100000738945_100000205941 [0,2,0,0,0,0|2,0,0]=4 16172 B16R2.12623 Clc1ccc(cc1OCc2cscn2)Br 7a_100000738945_100000205941 [0,2,0,0,0,0|2,0,0]=4 16173 B16R2.12623 Clc1ccc(cc1OCc2cscn2)I 34a_100011356854_100000205941 [0,2,0,0,0,0|2,0,0]=4 16174 B16R2.12623 Clc1ccc(cc1OCc2cscn2)I 7a_100011356854_100000205941 [0,2,0,0,0,0|2,0,0]=4 16175 B16R2.12623 Clc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100011772130 [0,2,0,0,0,0|1,0,0]=3 16176 B16R2.12623 Clc1ccc(cc1SCc2c[nH]cn2)Br 62a_100011772130_100000707719 [0,2,0,0,0,0|1,0,0]=3 16177 B16R2.12623 Clc1ccc(cc1SCc2cscn2)Br 62a_100000205941_100011772130 [0,2,0,0,0,0|2,0,0]=4 16178 B16R2.12623 Clc1ccc(cc1SCc2cscn2)Br 62a_100011772130_100000205941 [0,2,0,0,0,0|2,0,0]=4 16179 B16R2.12623 Clc1cnc(c(c1)OCc2c[nH]cn2)Br 34a_100000697010_100000707719 [0,2,0,0,0,0|2,0,0]=4 16180 B16R2.12623 Clc1cnc(c(c1)OCc2c[nH]cn2)I 34a_100010233512_100000707719 [0,2,0,0,0,0|2,0,0]=4 16181 B16R2.12623 Clc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_200000062399 [0,2,0,0,0,0|2,0,0]=4 16182 B16R2.12623 Clc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_200000062399_100000707719 [0,2,0,0,0,0|2,0,0]=4 16183 B16R2.12623 Clc1cnc(cc1OCc2c[nH]cn2)Br 34a_100010173861_100000707719 [0,2,0,0,0,0|2,0,0]=4 16184 B16R2.12623 Clc1cnc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010223331 [0,2,0,0,0,0|2,0,0]=4 16185 B16R2.12623 Clc1cnc(cc1SCc2c[nH]cn2)Br 62a_100010223331_100000707719 [0,2,0,0,0,0|2,0,0]=4 16186 B16R2.12623 Clc1ncc(cc1OCc2c[nH]cn2)Br 34a_100012354860_100000707719 [0,2,0,0,0,0|2,0,0]=4 16187 B16R2.12623 Clc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100009814771 [0,2,0,0,0,0|2,0,0]=4 16188 B16R2.12623 Clc1ncc(cc1SCc2c[nH]cn2)Br 62a_100009814771_100000707719 [0,2,0,0,0,0|2,0,0]=4 16189 B16R2.12623 Cn1ccc(=O)c(c1)SCc2c[nH]cn2 62a_100000707719_100010750718 [0,2,0,0,0,0|2,0,0]=4 16190 B16R2.12623 Cn1ccc(=O)c(c1)SCc2c[nH]cn2 62a_100010750718_100000707719 [0,2,0,0,0,0|2,0,0]=4 16191 B16R2.12623 Fc1cc(c(cn1)Cl)NCc2c[nH]cn2 27a_100000758547_100009892587 [0,2,0,0,0,0|1,0,0]=3 16192 B16R2.12623 Fc1cc(c(cn1)Cl)NCc2c[nH]nn2 27a_100020620823_100009892587 [0,2,0,0,0,0|2,0,0]=4 16193 B16R2.12623 Fc1cc(c(cn1)Cl)NCc2cocn2 27a_100015188801_100009892587 [0,2,0,0,0,0|2,0,0]=4 16194 B16R2.12623 Fc1cc(c(cn1)Cl)NCc2cscn2 27a_100015185402_100009892587 [0,2,0,0,0,0|2,0,0]=4 16195 B16R2.12623 Fc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100000707719_100009892587 [0,2,0,0,0,0|2,0,0]=4 16196 B16R2.12623 Fc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100009892587_100000707719 [0,2,0,0,0,0|2,0,0]=4 16197 B16R2.12623 Fc1cc(c(cn1)F)NCc2c[nH]cn2 27a_100000758547_100010233071 [0,2,0,0,0,0|1,0,0]=3 16198 B16R2.12623 Fc1cc(c(cn1)F)NCc2c[nH]nn2 27a_100020620823_100010233071 [0,2,0,0,0,0|2,0,0]=4 16199 B16R2.12623 Fc1cc(c(cn1)F)NCc2cocn2 27a_100015188801_100010233071 [0,2,0,0,0,0|2,0,0]=4 16200 B16R2.12623 Fc1cc(c(cn1)F)NCc2cscn2 27a_100015185402_100010233071 [0,2,0,0,0,0|2,0,0]=4 16201 B16R2.12623 Fc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100000707719_100010233071 [0,2,0,0,0,0|2,0,0]=4 16202 B16R2.12623 Fc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100010233071_100000707719 [0,2,0,0,0,0|2,0,0]=4 16203 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100000736370_100000756875 [0,2,0,0,0,0|2,0,0]=4 16204 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)Br 62a_100000756875_100000736370 [0,2,0,0,0,0|2,0,0]=4 16205 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100000709952_100000756875 [0,2,0,0,0,0|2,0,0]=4 16206 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)Cl 62a_100000756875_100000709952 [0,2,0,0,0,0|2,0,0]=4 16207 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)F 62a_100000685659_100000756875 [0,2,0,0,0,0|2,0,0]=4 16208 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)F 62a_100000756875_100000685659 [0,2,0,0,0,0|2,0,0]=4 16209 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100000756875_100010149606 [0,2,0,0,0,0|2,0,0]=4 16210 B16R2.12623 Fc1ccc(c(c1)CSc2c[nH]cn2)I 62a_100010149606_100000756875 [0,2,0,0,0,0|2,0,0]=4 16211 B16R2.12623 Fc1ccc(c(c1)NCc2c[nH]cn2)Br 34a_100000687223_100000707719 [0,2,0,0,0,0|0,0,0]=2 16212 B16R2.12623 Fc1ccc(c(c1)NCc2c[nH]cn2)Cl 34a_100000751338_100000707719 [0,2,0,0,0,0|0,0,0]=2 16213 B16R2.12623 Fc1ccc(c(c1)NCc2c[nH]cn2)F 34a_100000210742_100000707719 [0,2,0,0,0,0|0,0,0]=2 16214 B16R2.12623 Fc1ccc(c(c1)NCc2c[nH]cn2)I 34a_100011218093_100000707719 [0,2,0,0,0,0|0,0,0]=2 16215 B16R2.12623 Fc1ccc(c(c1)NCc2cc[nH]n2)F 207a_100000210742_100000738523 [0,2,0,0,0,0|2,0,0]=4 16216 B16R2.12623 Fc1ccc(c(c1)NCc2ccco2)Br 270302a_100000687223_100000186105 [0,2,0,0,0,0|2,0,0]=4 16217 B16R2.12623 Fc1ccc(c(c1)NCc2ccco2)Cl 270302a_100000751338_100000186105 [0,2,0,0,0,0|2,0,0]=4 16218 B16R2.12623 Fc1ccc(c(c1)NCc2ccco2)F 207a_100000210742_100000186105 [0,2,0,0,0,0|2,0,0]=4 16219 B16R2.12623 Fc1ccc(c(c1)NCc2ccco2)F 270302a_100000210742_100000186105 [0,2,0,0,0,0|2,0,0]=4 16220 B16R2.12623 Fc1ccc(c(c1)NCc2cccs2)Br 270302a_100000687223_100000209959 [0,2,0,0,0,0|2,0,0]=4 16221 B16R2.12623 Fc1ccc(c(c1)NCc2cccs2)Cl 270302a_100000751338_100000209959 [0,2,0,0,0,0|2,0,0]=4 16222 B16R2.12623 Fc1ccc(c(c1)NCc2cccs2)F 207a_100000210742_100000209959 [0,2,0,0,0,0|2,0,0]=4 16223 B16R2.12623 Fc1ccc(c(c1)NCc2cccs2)F 270302a_100000210742_100000209959 [0,2,0,0,0,0|2,0,0]=4 16224 B16R2.12623 Fc1ccc(c(c1)NCc2ccoc2)F 207a_100000210742_100011215517 [0,2,0,0,0,0|2,0,0]=4 16225 B16R2.12623 Fc1ccc(c(c1)NCc2ccon2)Br 34a_100000687223_100000234950 [0,2,0,0,0,0|2,0,0]=4 16226 B16R2.12623 Fc1ccc(c(c1)NCc2ccon2)Cl 34a_100000751338_100000234950 [0,2,0,0,0,0|2,0,0]=4 16227 B16R2.12623 Fc1ccc(c(c1)NCc2ccon2)F 34a_100000210742_100000234950 [0,2,0,0,0,0|2,0,0]=4 16228 B16R2.12623 Fc1ccc(c(c1)NCc2ccon2)I 34a_100011218093_100000234950 [0,2,0,0,0,0|2,0,0]=4 16229 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)Br 270302a_100000687223_100000188534 [0,2,0,0,0,0|2,0,0]=4 16230 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)Br 34a_100000687223_100011261437 [0,2,0,0,0,0|2,0,0]=4 16231 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)Cl 270302a_100000751338_100000188534 [0,2,0,0,0,0|2,0,0]=4 16232 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)Cl 34a_100000751338_100011261437 [0,2,0,0,0,0|2,0,0]=4 16233 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)F 207a_100000210742_100000188534 [0,2,0,0,0,0|2,0,0]=4 16234 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)F 270302a_100000210742_100000188534 [0,2,0,0,0,0|2,0,0]=4 16235 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)F 34a_100000210742_100011261437 [0,2,0,0,0,0|2,0,0]=4 16236 B16R2.12623 Fc1ccc(c(c1)NCc2ccsc2)I 34a_100011218093_100011261437 [0,2,0,0,0,0|2,0,0]=4 16237 B16R2.12623 Fc1ccc(c(c1)NCc2cn[nH]c2)Br 270302a_100000687223_100016992096 [0,2,0,0,0,0|2,0,0]=4 16238 B16R2.12623 Fc1ccc(c(c1)NCc2cn[nH]c2)Cl 270302a_100000751338_100016992096 [0,2,0,0,0,0|2,0,0]=4 16239 B16R2.12623 Fc1ccc(c(c1)NCc2cn[nH]c2)F 207a_100000210742_100016992096 [0,2,0,0,0,0|2,0,0]=4 16240 B16R2.12623 Fc1ccc(c(c1)NCc2cn[nH]c2)F 270302a_100000210742_100016992096 [0,2,0,0,0,0|2,0,0]=4 16241 B16R2.12623 Fc1ccc(c(c1)NCc2cnc[nH]2)F 207a_100000210742_100000742939 [0,2,0,0,0,0|0,0,2]=4 16242 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)Br 270302a_100000687223_100000749870 [0,2,0,0,0,0|1,0,1]=4 16243 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)Br 34a_100000687223_100015185245 [0,2,0,0,0,0|1,0,1]=4 16244 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)Cl 270302a_100000751338_100000749870 [0,2,0,0,0,0|1,0,1]=4 16245 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)Cl 34a_100000751338_100015185245 [0,2,0,0,0,0|1,0,1]=4 16246 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)F 207a_100000210742_100000749870 [0,2,0,0,0,0|1,0,1]=4 16247 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)F 270302a_100000210742_100000749870 [0,2,0,0,0,0|1,0,1]=4 16248 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)F 34a_100000210742_100015185245 [0,2,0,0,0,0|1,0,1]=4 16249 B16R2.12623 Fc1ccc(c(c1)NCc2cncs2)I 34a_100011218093_100015185245 [0,2,0,0,0,0|1,0,1]=4 16250 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)Br 270302a_100000687223_100000743575 [0,2,0,0,0,0|1,0,0]=3 16251 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)Br 34a_100000687223_100000205941 [0,2,0,0,0,0|1,0,0]=3 16252 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)Cl 270302a_100000751338_100000743575 [0,2,0,0,0,0|1,0,0]=3 16253 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)Cl 34a_100000751338_100000205941 [0,2,0,0,0,0|1,0,0]=3 16254 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)F 207a_100000210742_100000743575 [0,2,0,0,0,0|1,0,0]=3 16255 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)F 270302a_100000210742_100000743575 [0,2,0,0,0,0|1,0,0]=3 16256 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)F 34a_100000210742_100000205941 [0,2,0,0,0,0|1,0,0]=3 16257 B16R2.12623 Fc1ccc(c(c1)NCc2cscn2)I 34a_100011218093_100000205941 [0,2,0,0,0,0|1,0,0]=3 16258 B16R2.12623 Fc1ccc(c(c1)NCc2ncc[nH]2)Br 34a_100000687223_100016991755 [0,2,0,0,0,0|2,0,0]=4 16259 B16R2.12623 Fc1ccc(c(c1)NCc2ncc[nH]2)Cl 34a_100000751338_100016991755 [0,2,0,0,0,0|2,0,0]=4 16260 B16R2.12623 Fc1ccc(c(c1)NCc2ncc[nH]2)F 207a_100000210742_100000743867 [0,2,0,0,0,0|2,0,0]=4 16261 B16R2.12623 Fc1ccc(c(c1)NCc2ncc[nH]2)F 34a_100000210742_100016991755 [0,2,0,0,0,0|2,0,0]=4 16262 B16R2.12623 Fc1ccc(c(c1)NCc2ncc[nH]2)I 34a_100011218093_100016991755 [0,2,0,0,0,0|2,0,0]=4 16263 B16R2.12623 Fc1ccc(c(c1)NCc2ncco2)Br 34a_100000687223_103436540062 [0,2,0,0,0,0|2,0,0]=4 16264 B16R2.12623 Fc1ccc(c(c1)NCc2ncco2)Cl 34a_100000751338_103436540062 [0,2,0,0,0,0|2,0,0]=4 16265 B16R2.12623 Fc1ccc(c(c1)NCc2ncco2)F 34a_100000210742_103436540062 [0,2,0,0,0,0|2,0,0]=4 16266 B16R2.12623 Fc1ccc(c(c1)NCc2ncco2)I 34a_100011218093_103436540062 [0,2,0,0,0,0|2,0,0]=4 16267 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)Br 270302a_100000687223_100000750902 [0,2,0,0,0,0|2,0,0]=4 16268 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)Br 34a_100000687223_100015184050 [0,2,0,0,0,0|2,0,0]=4 16269 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)Cl 270302a_100000751338_100000750902 [0,2,0,0,0,0|2,0,0]=4 16270 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)Cl 34a_100000751338_100015184050 [0,2,0,0,0,0|2,0,0]=4 16271 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)F 207a_100000210742_100000750902 [0,2,0,0,0,0|2,0,0]=4 16272 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)F 270302a_100000210742_100000750902 [0,2,0,0,0,0|2,0,0]=4 16273 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)F 34a_100000210742_100015184050 [0,2,0,0,0,0|2,0,0]=4 16274 B16R2.12623 Fc1ccc(c(c1)NCc2nccs2)I 34a_100011218093_100015184050 [0,2,0,0,0,0|2,0,0]=4 16275 B16R2.12623 Fc1ccc(c(c1)NCc2ncon2)Br 34a_100000687223_100000233494 [0,2,0,0,0,0|2,0,0]=4 16276 B16R2.12623 Fc1ccc(c(c1)NCc2ncon2)Cl 34a_100000751338_100000233494 [0,2,0,0,0,0|2,0,0]=4 16277 B16R2.12623 Fc1ccc(c(c1)NCc2ncon2)F 34a_100000210742_100000233494 [0,2,0,0,0,0|2,0,0]=4 16278 B16R2.12623 Fc1ccc(c(c1)NCc2ncon2)I 34a_100011218093_100000233494 [0,2,0,0,0,0|2,0,0]=4 16279 B16R2.12623 Fc1ccc(c(c1)NCn2cncn2)Br 34a_100000687223_200020645497 [0,2,0,0,0,0|1,0,1]=4 16280 B16R2.12623 Fc1ccc(c(c1)NCn2cncn2)Cl 34a_100000751338_200020645497 [0,2,0,0,0,0|1,0,1]=4 16281 B16R2.12623 Fc1ccc(c(c1)NCn2cncn2)F 34a_100000210742_200020645497 [0,2,0,0,0,0|1,0,1]=4 16282 B16R2.12623 Fc1ccc(c(c1)NCn2cncn2)I 34a_100011218093_200020645497 [0,2,0,0,0,0|1,0,1]=4 16283 B16R2.12623 Fc1ccc(c(c1)OCc2c[nH]cn2)Br 34a_100000690578_100000707719 [0,2,0,0,0,0|1,0,0]=3 16284 B16R2.12623 Fc1ccc(c(c1)OCc2c[nH]cn2)Cl 34a_100000692107_100000707719 [0,2,0,0,0,0|1,0,0]=3 16285 B16R2.12623 Fc1ccc(c(c1)OCc2c[nH]cn2)F 34a_100000752141_100000707719 [0,2,0,0,0,0|1,0,0]=3 16286 B16R2.12623 Fc1ccc(c(c1)OCc2c[nH]cn2)I 34a_100010084537_100000707719 [0,2,0,0,0,0|1,0,0]=3 16287 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)Br 34a_100000690578_100000205941 [0,2,0,0,0,0|2,0,0]=4 16288 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)Br 7a_100000690578_100000205941 [0,2,0,0,0,0|2,0,0]=4 16289 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)Cl 34a_100000692107_100000205941 [0,2,0,0,0,0|2,0,0]=4 16290 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)Cl 7a_100000692107_100000205941 [0,2,0,0,0,0|2,0,0]=4 16291 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)F 34a_100000752141_100000205941 [0,2,0,0,0,0|2,0,0]=4 16292 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)F 7a_100000752141_100000205941 [0,2,0,0,0,0|2,0,0]=4 16293 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)I 34a_100010084537_100000205941 [0,2,0,0,0,0|2,0,0]=4 16294 B16R2.12623 Fc1ccc(c(c1)OCc2cscn2)I 7a_100010084537_100000205941 [0,2,0,0,0,0|2,0,0]=4 16295 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100011217576 [0,2,0,0,0,0|1,0,0]=3 16296 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100011217576_100000707719 [0,2,0,0,0,0|1,0,0]=3 16297 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100011217299 [0,2,0,0,0,0|1,0,0]=3 16298 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100011217299_100000707719 [0,2,0,0,0,0|1,0,0]=3 16299 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100011219198 [0,2,0,0,0,0|1,0,0]=3 16300 B16R2.12623 Fc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100011219198_100000707719 [0,2,0,0,0,0|1,0,0]=3 16301 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100011217576 [0,2,0,0,0,0|2,0,0]=4 16302 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)Br 62a_100011217576_100000205941 [0,2,0,0,0,0|2,0,0]=4 16303 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)Cl 62a_100000205941_100011217299 [0,2,0,0,0,0|2,0,0]=4 16304 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)Cl 62a_100011217299_100000205941 [0,2,0,0,0,0|2,0,0]=4 16305 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)F 62a_100000205941_100011219198 [0,2,0,0,0,0|2,0,0]=4 16306 B16R2.12623 Fc1ccc(c(c1)SCc2cscn2)F 62a_100011219198_100000205941 [0,2,0,0,0,0|2,0,0]=4 16307 B16R2.12623 Fc1ccc(c(n1)NCc2c[nH]cn2)F 27a_100000758547_100010997973 [0,2,0,0,0,0|1,0,0]=3 16308 B16R2.12623 Fc1ccc(c(n1)NCc2c[nH]nn2)F 27a_100020620823_100010997973 [0,2,0,0,0,0|2,0,0]=4 16309 B16R2.12623 Fc1ccc(c(n1)NCc2cocn2)F 27a_100015188801_100010997973 [0,2,0,0,0,0|2,0,0]=4 16310 B16R2.12623 Fc1ccc(c(n1)NCc2cscn2)F 27a_100015185402_100010997973 [0,2,0,0,0,0|2,0,0]=4 16311 B16R2.12623 Fc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100000707719_100010997973 [0,2,0,0,0,0|2,0,0]=4 16312 B16R2.12623 Fc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100010997973_100000707719 [0,2,0,0,0,0|2,0,0]=4 16313 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)Br 62a_100000736399_100000756875 [0,2,0,0,0,0|2,0,0]=4 16314 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)Br 62a_100000756875_100000736399 [0,2,0,0,0,0|2,0,0]=4 16315 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)Cl 62a_100000716957_100000756875 [0,2,0,0,0,0|2,0,0]=4 16316 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)Cl 62a_100000756875_100000716957 [0,2,0,0,0,0|2,0,0]=4 16317 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)I 62a_100000756875_200010149601 [0,2,0,0,0,0|2,0,0]=4 16318 B16R2.12623 Fc1ccc(cc1CSc2c[nH]cn2)I 62a_200010149601_100000756875 [0,2,0,0,0,0|2,0,0]=4 16319 B16R2.12623 Fc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000740924_100000707719 [0,2,0,0,0,0|0,0,0]=2 16320 B16R2.12623 Fc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000212115_100000707719 [0,2,0,0,0,0|0,0,0]=2 16321 B16R2.12623 Fc1ccc(cc1NCc2c[nH]cn2)I 34a_100011464823_100000707719 [0,2,0,0,0,0|0,0,0]=2 16322 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)Br 207a_100000740924_100000738523 [0,2,0,0,0,0|2,0,0]=4 16323 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)Cl 207a_100000212115_100000738523 [0,2,0,0,0,0|2,0,0]=4 16324 B16R2.12623 Fc1ccc(cc1NCc2cc[nH]n2)I 207a_100011464823_100000738523 [0,2,0,0,0,0|2,0,0]=4 16325 B16R2.12623 Fc1ccc(cc1NCc2ccco2)Br 207a_100000740924_100000186105 [0,2,0,0,0,0|2,0,0]=4 16326 B16R2.12623 Fc1ccc(cc1NCc2ccco2)Br 270302a_100000740924_100000186105 [0,2,0,0,0,0|2,0,0]=4 16327 B16R2.12623 Fc1ccc(cc1NCc2ccco2)Cl 207a_100000212115_100000186105 [0,2,0,0,0,0|2,0,0]=4 16328 B16R2.12623 Fc1ccc(cc1NCc2ccco2)Cl 270302a_100000212115_100000186105 [0,2,0,0,0,0|2,0,0]=4 16329 B16R2.12623 Fc1ccc(cc1NCc2ccco2)I 207a_100011464823_100000186105 [0,2,0,0,0,0|2,0,0]=4 16330 B16R2.12623 Fc1ccc(cc1NCc2ccco2)I 270302a_100011464823_100000186105 [0,2,0,0,0,0|2,0,0]=4 16331 B16R2.12623 Fc1ccc(cc1NCc2cccs2)Br 207a_100000740924_100000209959 [0,2,0,0,0,0|2,0,0]=4 16332 B16R2.12623 Fc1ccc(cc1NCc2cccs2)Br 270302a_100000740924_100000209959 [0,2,0,0,0,0|2,0,0]=4 16333 B16R2.12623 Fc1ccc(cc1NCc2cccs2)Cl 207a_100000212115_100000209959 [0,2,0,0,0,0|2,0,0]=4 16334 B16R2.12623 Fc1ccc(cc1NCc2cccs2)Cl 270302a_100000212115_100000209959 [0,2,0,0,0,0|2,0,0]=4 16335 B16R2.12623 Fc1ccc(cc1NCc2cccs2)I 207a_100011464823_100000209959 [0,2,0,0,0,0|2,0,0]=4 16336 B16R2.12623 Fc1ccc(cc1NCc2cccs2)I 270302a_100011464823_100000209959 [0,2,0,0,0,0|2,0,0]=4 16337 B16R2.12623 Fc1ccc(cc1NCc2ccoc2)Br 207a_100000740924_100011215517 [0,2,0,0,0,0|2,0,0]=4 16338 B16R2.12623 Fc1ccc(cc1NCc2ccoc2)Cl 207a_100000212115_100011215517 [0,2,0,0,0,0|2,0,0]=4 16339 B16R2.12623 Fc1ccc(cc1NCc2ccoc2)I 207a_100011464823_100011215517 [0,2,0,0,0,0|2,0,0]=4 16340 B16R2.12623 Fc1ccc(cc1NCc2ccon2)Br 34a_100000740924_100000234950 [0,2,0,0,0,0|2,0,0]=4 16341 B16R2.12623 Fc1ccc(cc1NCc2ccon2)Cl 34a_100000212115_100000234950 [0,2,0,0,0,0|2,0,0]=4 16342 B16R2.12623 Fc1ccc(cc1NCc2ccon2)I 34a_100011464823_100000234950 [0,2,0,0,0,0|2,0,0]=4 16343 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Br 207a_100000740924_100000188534 [0,2,0,0,0,0|2,0,0]=4 16344 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Br 270302a_100000740924_100000188534 [0,2,0,0,0,0|2,0,0]=4 16345 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Br 34a_100000740924_100011261437 [0,2,0,0,0,0|2,0,0]=4 16346 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Cl 207a_100000212115_100000188534 [0,2,0,0,0,0|2,0,0]=4 16347 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Cl 270302a_100000212115_100000188534 [0,2,0,0,0,0|2,0,0]=4 16348 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)Cl 34a_100000212115_100011261437 [0,2,0,0,0,0|2,0,0]=4 16349 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)I 207a_100011464823_100000188534 [0,2,0,0,0,0|2,0,0]=4 16350 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)I 270302a_100011464823_100000188534 [0,2,0,0,0,0|2,0,0]=4 16351 B16R2.12623 Fc1ccc(cc1NCc2ccsc2)I 34a_100011464823_100011261437 [0,2,0,0,0,0|2,0,0]=4 16352 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)Br 207a_100000740924_100016992096 [0,2,0,0,0,0|2,0,0]=4 16353 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)Br 270302a_100000740924_100016992096 [0,2,0,0,0,0|2,0,0]=4 16354 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)Cl 207a_100000212115_100016992096 [0,2,0,0,0,0|2,0,0]=4 16355 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)Cl 270302a_100000212115_100016992096 [0,2,0,0,0,0|2,0,0]=4 16356 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)I 207a_100011464823_100016992096 [0,2,0,0,0,0|2,0,0]=4 16357 B16R2.12623 Fc1ccc(cc1NCc2cn[nH]c2)I 270302a_100011464823_100016992096 [0,2,0,0,0,0|2,0,0]=4 16358 B16R2.12623 Fc1ccc(cc1NCc2cnc[nH]2)Br 207a_100000740924_100000742939 [0,2,0,0,0,0|0,0,2]=4 16359 B16R2.12623 Fc1ccc(cc1NCc2cnc[nH]2)Cl 207a_100000212115_100000742939 [0,2,0,0,0,0|0,0,2]=4 16360 B16R2.12623 Fc1ccc(cc1NCc2cnc[nH]2)I 207a_100011464823_100000742939 [0,2,0,0,0,0|0,0,2]=4 16361 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Br 207a_100000740924_100000749870 [0,2,0,0,0,0|1,0,1]=4 16362 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Br 270302a_100000740924_100000749870 [0,2,0,0,0,0|1,0,1]=4 16363 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Br 34a_100000740924_100015185245 [0,2,0,0,0,0|1,0,1]=4 16364 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Cl 207a_100000212115_100000749870 [0,2,0,0,0,0|1,0,1]=4 16365 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Cl 270302a_100000212115_100000749870 [0,2,0,0,0,0|1,0,1]=4 16366 B16R2.12623 Fc1ccc(cc1NCc2cncs2)Cl 34a_100000212115_100015185245 [0,2,0,0,0,0|1,0,1]=4 16367 B16R2.12623 Fc1ccc(cc1NCc2cncs2)I 207a_100011464823_100000749870 [0,2,0,0,0,0|1,0,1]=4 16368 B16R2.12623 Fc1ccc(cc1NCc2cncs2)I 270302a_100011464823_100000749870 [0,2,0,0,0,0|1,0,1]=4 16369 B16R2.12623 Fc1ccc(cc1NCc2cncs2)I 34a_100011464823_100015185245 [0,2,0,0,0,0|1,0,1]=4 16370 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Br 207a_100000740924_100000743575 [0,2,0,0,0,0|1,0,0]=3 16371 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Br 270302a_100000740924_100000743575 [0,2,0,0,0,0|1,0,0]=3 16372 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Br 34a_100000740924_100000205941 [0,2,0,0,0,0|1,0,0]=3 16373 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Cl 207a_100000212115_100000743575 [0,2,0,0,0,0|1,0,0]=3 16374 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Cl 270302a_100000212115_100000743575 [0,2,0,0,0,0|1,0,0]=3 16375 B16R2.12623 Fc1ccc(cc1NCc2cscn2)Cl 34a_100000212115_100000205941 [0,2,0,0,0,0|1,0,0]=3 16376 B16R2.12623 Fc1ccc(cc1NCc2cscn2)I 207a_100011464823_100000743575 [0,2,0,0,0,0|1,0,0]=3 16377 B16R2.12623 Fc1ccc(cc1NCc2cscn2)I 270302a_100011464823_100000743575 [0,2,0,0,0,0|1,0,0]=3 16378 B16R2.12623 Fc1ccc(cc1NCc2cscn2)I 34a_100011464823_100000205941 [0,2,0,0,0,0|1,0,0]=3 16379 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)Br 207a_100000740924_100000743867 [0,2,0,0,0,0|2,0,0]=4 16380 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)Br 34a_100000740924_100016991755 [0,2,0,0,0,0|2,0,0]=4 16381 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)Cl 207a_100000212115_100000743867 [0,2,0,0,0,0|2,0,0]=4 16382 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)Cl 34a_100000212115_100016991755 [0,2,0,0,0,0|2,0,0]=4 16383 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)I 207a_100011464823_100000743867 [0,2,0,0,0,0|2,0,0]=4 16384 B16R2.12623 Fc1ccc(cc1NCc2ncc[nH]2)I 34a_100011464823_100016991755 [0,2,0,0,0,0|2,0,0]=4 16385 B16R2.12623 Fc1ccc(cc1NCc2ncco2)Br 34a_100000740924_103436540062 [0,2,0,0,0,0|2,0,0]=4 16386 B16R2.12623 Fc1ccc(cc1NCc2ncco2)Cl 34a_100000212115_103436540062 [0,2,0,0,0,0|2,0,0]=4 16387 B16R2.12623 Fc1ccc(cc1NCc2ncco2)I 34a_100011464823_103436540062 [0,2,0,0,0,0|2,0,0]=4 16388 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Br 207a_100000740924_100000750902 [0,2,0,0,0,0|2,0,0]=4 16389 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Br 270302a_100000740924_100000750902 [0,2,0,0,0,0|2,0,0]=4 16390 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Br 34a_100000740924_100015184050 [0,2,0,0,0,0|2,0,0]=4 16391 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Cl 207a_100000212115_100000750902 [0,2,0,0,0,0|2,0,0]=4 16392 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Cl 270302a_100000212115_100000750902 [0,2,0,0,0,0|2,0,0]=4 16393 B16R2.12623 Fc1ccc(cc1NCc2nccs2)Cl 34a_100000212115_100015184050 [0,2,0,0,0,0|2,0,0]=4 16394 B16R2.12623 Fc1ccc(cc1NCc2nccs2)I 207a_100011464823_100000750902 [0,2,0,0,0,0|2,0,0]=4 16395 B16R2.12623 Fc1ccc(cc1NCc2nccs2)I 270302a_100011464823_100000750902 [0,2,0,0,0,0|2,0,0]=4 16396 B16R2.12623 Fc1ccc(cc1NCc2nccs2)I 34a_100011464823_100015184050 [0,2,0,0,0,0|2,0,0]=4 16397 B16R2.12623 Fc1ccc(cc1NCc2ncon2)Br 34a_100000740924_100000233494 [0,2,0,0,0,0|2,0,0]=4 16398 B16R2.12623 Fc1ccc(cc1NCc2ncon2)Cl 34a_100000212115_100000233494 [0,2,0,0,0,0|2,0,0]=4 16399 B16R2.12623 Fc1ccc(cc1NCc2ncon2)I 34a_100011464823_100000233494 [0,2,0,0,0,0|2,0,0]=4 16400 B16R2.12623 Fc1ccc(cc1NCn2cncn2)Br 34a_100000740924_200020645497 [0,2,0,0,0,0|1,0,1]=4 16401 B16R2.12623 Fc1ccc(cc1NCn2cncn2)Cl 34a_100000212115_200020645497 [0,2,0,0,0,0|1,0,1]=4 16402 B16R2.12623 Fc1ccc(cc1NCn2cncn2)I 34a_100011464823_200020645497 [0,2,0,0,0,0|1,0,1]=4 16403 B16R2.12623 Fc1ccc(cc1OCc2c[nH]cn2)Br 34a_100000686035_100000707719 [0,2,0,0,0,0|1,0,0]=3 16404 B16R2.12623 Fc1ccc(cc1OCc2c[nH]cn2)Cl 34a_100000757397_100000707719 [0,2,0,0,0,0|1,0,0]=3 16405 B16R2.12623 Fc1ccc(cc1OCc2c[nH]cn2)I 34a_100009958187_100000707719 [0,2,0,0,0,0|1,0,0]=3 16406 B16R2.12623 Fc1ccc(cc1OCc2cscn2)Br 34a_100000686035_100000205941 [0,2,0,0,0,0|2,0,0]=4 16407 B16R2.12623 Fc1ccc(cc1OCc2cscn2)Br 7a_100000686035_100000205941 [0,2,0,0,0,0|2,0,0]=4 16408 B16R2.12623 Fc1ccc(cc1OCc2cscn2)Cl 34a_100000757397_100000205941 [0,2,0,0,0,0|2,0,0]=4 16409 B16R2.12623 Fc1ccc(cc1OCc2cscn2)Cl 7a_100000757397_100000205941 [0,2,0,0,0,0|2,0,0]=4 16410 B16R2.12623 Fc1ccc(cc1OCc2cscn2)I 34a_100009958187_100000205941 [0,2,0,0,0,0|2,0,0]=4 16411 B16R2.12623 Fc1ccc(cc1OCc2cscn2)I 7a_100009958187_100000205941 [0,2,0,0,0,0|2,0,0]=4 16412 B16R2.12623 Fc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100011217312 [0,2,0,0,0,0|1,0,0]=3 16413 B16R2.12623 Fc1ccc(cc1SCc2c[nH]cn2)Br 62a_100011217312_100000707719 [0,2,0,0,0,0|1,0,0]=3 16414 B16R2.12623 Fc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100011218116 [0,2,0,0,0,0|1,0,0]=3 16415 B16R2.12623 Fc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100011218116_100000707719 [0,2,0,0,0,0|1,0,0]=3 16416 B16R2.12623 Fc1ccc(cc1SCc2cscn2)Br 62a_100000205941_100011217312 [0,2,0,0,0,0|2,0,0]=4 16417 B16R2.12623 Fc1ccc(cc1SCc2cscn2)Br 62a_100011217312_100000205941 [0,2,0,0,0,0|2,0,0]=4 16418 B16R2.12623 Fc1ccc(cc1SCc2cscn2)Cl 62a_100000205941_100011218116 [0,2,0,0,0,0|2,0,0]=4 16419 B16R2.12623 Fc1ccc(cc1SCc2cscn2)Cl 62a_100011218116_100000205941 [0,2,0,0,0,0|2,0,0]=4 16420 B16R2.12623 Fc1ccc(nc1OCc2c[nH]cn2)Cl 34a_100010729010_100000707719 [0,2,0,0,0,0|2,0,0]=4 16421 B16R2.12623 Fc1ccc(nc1SCc2c[nH]cn2)Cl 62a_100000707719_100010136221 [0,2,0,0,0,0|2,0,0]=4 16422 B16R2.12623 Fc1ccc(nc1SCc2c[nH]cn2)Cl 62a_100010136221_100000707719 [0,2,0,0,0,0|2,0,0]=4 16423 B16R2.12623 Fc1cnc(c(c1)OCc2c[nH]cn2)Br 34a_100009820119_100000707719 [0,2,0,0,0,0|2,0,0]=4 16424 B16R2.12623 Fc1cnc(c(c1)OCc2c[nH]cn2)Cl 34a_100000079967_100000707719 [0,2,0,0,0,0|2,0,0]=4 16425 B16R2.12623 Fc1cnc(c(c1)OCc2c[nH]cn2)I 34a_100015624800_100000707719 [0,2,0,0,0,0|2,0,0]=4 16426 B16R2.12623 Fc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100009820768 [0,2,0,0,0,0|2,0,0]=4 16427 B16R2.12623 Fc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100009820768_100000707719 [0,2,0,0,0,0|2,0,0]=4 16428 B16R2.12623 Fc1cnc(cc1OCc2c[nH]cn2)Br 34a_100009854642_100000707719 [0,2,0,0,0,0|2,0,0]=4 16429 B16R2.12623 Fc1cnc(cc1OCc2c[nH]cn2)Cl 34a_100009851168_100000707719 [0,2,0,0,0,0|2,0,0]=4 16430 B16R2.12623 Fc1cnc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010193852 [0,2,0,0,0,0|2,0,0]=4 16431 B16R2.12623 Fc1cnc(cc1SCc2c[nH]cn2)Br 62a_100010193852_100000707719 [0,2,0,0,0,0|2,0,0]=4 16432 B16R2.12623 Fc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000708277 [0,2,0,0,0,0|2,0,0]=4 16433 B16R2.12623 Fc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000708277_100000707719 [0,2,0,0,0,0|2,0,0]=4 16434 B16R2.12623 Fc1ncc(cc1NCc2c[nH]cn2)Br 27a_100000758547_100010172738 [0,2,0,0,0,0|1,0,0]=3 16435 B16R2.12623 Fc1ncc(cc1NCc2c[nH]cn2)Cl 27a_100000758547_100010188783 [0,2,0,0,0,0|1,0,0]=3 16436 B16R2.12623 Fc1ncc(cc1NCc2c[nH]nn2)Br 27a_100020620823_100010172738 [0,2,0,0,0,0|2,0,0]=4 16437 B16R2.12623 Fc1ncc(cc1NCc2c[nH]nn2)Cl 27a_100020620823_100010188783 [0,2,0,0,0,0|2,0,0]=4 16438 B16R2.12623 Fc1ncc(cc1NCc2cocn2)Br 27a_100015188801_100010172738 [0,2,0,0,0,0|2,0,0]=4 16439 B16R2.12623 Fc1ncc(cc1NCc2cocn2)Cl 27a_100015188801_100010188783 [0,2,0,0,0,0|2,0,0]=4 16440 B16R2.12623 Fc1ncc(cc1NCc2cscn2)Br 27a_100015185402_100010172738 [0,2,0,0,0,0|2,0,0]=4 16441 B16R2.12623 Fc1ncc(cc1NCc2cscn2)Cl 27a_100015185402_100010188783 [0,2,0,0,0,0|2,0,0]=4 16442 B16R2.12623 Fc1ncc(cc1OCc2c[nH]cn2)Br 34a_100009819871_100000707719 [0,2,0,0,0,0|2,0,0]=4 16443 B16R2.12623 Fc1ncc(cc1OCc2c[nH]cn2)Cl 34a_100000094372_100000707719 [0,2,0,0,0,0|2,0,0]=4 16444 B16R2.12623 Fc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010172738 [0,2,0,0,0,0|2,0,0]=4 16445 B16R2.12623 Fc1ncc(cc1SCc2c[nH]cn2)Br 62a_100010172738_100000707719 [0,2,0,0,0,0|2,0,0]=4 16446 B16R2.12623 Fc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100010188783 [0,2,0,0,0,0|2,0,0]=4 16447 B16R2.12623 Fc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100010188783_100000707719 [0,2,0,0,0,0|2,0,0]=4 16448 B16R2.12623 Nc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100000707719_100010134119 [0,2,0,0,0,0|2,0,0]=4 16449 B16R2.12623 Nc1cc(c(cn1)Cl)SCc2c[nH]cn2 62a_100010134119_100000707719 [0,2,0,0,0,0|2,0,0]=4 16450 B16R2.12623 Nc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100000707719_100015713587 [0,2,0,0,0,0|2,0,0]=4 16451 B16R2.12623 Nc1cc(c(cn1)F)SCc2c[nH]cn2 62a_100015713587_100000707719 [0,2,0,0,0,0|2,0,0]=4 16452 B16R2.12623 Nc1ccc(c(c1)OCc2c[nH]cn2)Cl 34a_100011934209_100000707719 [0,2,0,0,0,0|1,0,0]=3 16453 B16R2.12623 Nc1ccc(c(c1)OCc2c[nH]cn2)F 34a_100012017398_100000707719 [0,2,0,0,0,0|1,0,0]=3 16454 B16R2.12623 Nc1ccc(c(c1)OCc2c[nH]cn2)N 34a_100025717382_100000707719 [0,2,0,0,0,0|1,0,0]=3 16455 B16R2.12623 Nc1ccc(c(c1)OCc2cscn2)Cl 34a_100011934209_100000205941 [0,2,0,0,0,0|2,0,0]=4 16456 B16R2.12623 Nc1ccc(c(c1)OCc2cscn2)F 34a_100012017398_100000205941 [0,2,0,0,0,0|2,0,0]=4 16457 B16R2.12623 Nc1ccc(c(c1)OCc2cscn2)F 7a_100012017398_100000205941 [0,2,0,0,0,0|2,0,0]=4 16458 B16R2.12623 Nc1ccc(c(c1)OCc2cscn2)N 34a_100025717382_100000205941 [0,2,0,0,0,0|2,0,0]=4 16459 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100000750459 [0,2,0,0,0,0|1,0,0]=3 16460 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000750459_100000707719 [0,2,0,0,0,0|1,0,0]=3 16461 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100012360549 [0,2,0,0,0,0|1,0,0]=3 16462 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100012360549_100000707719 [0,2,0,0,0,0|1,0,0]=3 16463 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100000760356 [0,2,0,0,0,0|1,0,0]=3 16464 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000760356_100000707719 [0,2,0,0,0,0|1,0,0]=3 16465 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)N 62a_100000707719_100011534242 [0,2,0,0,0,0|1,0,0]=3 16466 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)N 62a_100011534242_100000707719 [0,2,0,0,0,0|1,0,0]=3 16467 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)O 62a_100000707719_100011534360 [0,2,0,0,0,0|1,0,0]=3 16468 B16R2.12623 Nc1ccc(c(c1)SCc2c[nH]cn2)O 62a_100011534360_100000707719 [0,2,0,0,0,0|1,0,0]=3 16469 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100000750459 [0,2,0,0,0,0|2,0,0]=4 16470 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)Br 62a_100000750459_100000205941 [0,2,0,0,0,0|2,0,0]=4 16471 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)Cl 62a_100000205941_100012360549 [0,2,0,0,0,0|2,0,0]=4 16472 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)Cl 62a_100012360549_100000205941 [0,2,0,0,0,0|2,0,0]=4 16473 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)F 62a_100000205941_100000760356 [0,2,0,0,0,0|2,0,0]=4 16474 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)F 62a_100000760356_100000205941 [0,2,0,0,0,0|2,0,0]=4 16475 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)N 62a_100000205941_100011534242 [0,2,0,0,0,0|2,0,0]=4 16476 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)N 62a_100011534242_100000205941 [0,2,0,0,0,0|2,0,0]=4 16477 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)O 62a_100000205941_100011534360 [0,2,0,0,0,0|2,0,0]=4 16478 B16R2.12623 Nc1ccc(c(c1)SCc2cscn2)O 62a_100011534360_100000205941 [0,2,0,0,0,0|2,0,0]=4 16479 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)Br 62a_100000707719_100010192275 [0,2,0,0,0,0|2,0,0]=4 16480 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)Br 62a_100010192275_100000707719 [0,2,0,0,0,0|2,0,0]=4 16481 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100000707719_100010892222 [0,2,0,0,0,0|2,0,0]=4 16482 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)F 62a_100010892222_100000707719 [0,2,0,0,0,0|2,0,0]=4 16483 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)N 62a_100000707719_200009884323 [0,2,0,0,0,0|2,0,0]=4 16484 B16R2.12623 Nc1ccc(c(n1)SCc2c[nH]cn2)N 62a_200009884323_100000707719 [0,2,0,0,0,0|2,0,0]=4 16485 B16R2.12623 Nc1ccc(cc1OCc2c[nH]cn2)Br 34a_100000739049_100000707719 [0,2,0,0,0,0|1,0,0]=3 16486 B16R2.12623 Nc1ccc(cc1OCc2c[nH]cn2)Cl 34a_100000185728_100000707719 [0,2,0,0,0,0|1,0,0]=3 16487 B16R2.12623 Nc1ccc(cc1OCc2c[nH]cn2)F 34a_100000753323_100000707719 [0,2,0,0,0,0|1,0,0]=3 16488 B16R2.12623 Nc1ccc(cc1OCc2c[nH]cn2)I 34a_100000057187_100000707719 [0,2,0,0,0,0|1,0,0]=3 16489 B16R2.12623 Nc1ccc(cc1OCc2cscn2)Br 34a_100000739049_100000205941 [0,2,0,0,0,0|2,0,0]=4 16490 B16R2.12623 Nc1ccc(cc1OCc2cscn2)Br 7a_100000739049_100000205941 [0,2,0,0,0,0|2,0,0]=4 16491 B16R2.12623 Nc1ccc(cc1OCc2cscn2)Cl 34a_100000185728_100000205941 [0,2,0,0,0,0|2,0,0]=4 16492 B16R2.12623 Nc1ccc(cc1OCc2cscn2)Cl 7a_100000185728_100000205941 [0,2,0,0,0,0|2,0,0]=4 16493 B16R2.12623 Nc1ccc(cc1OCc2cscn2)F 34a_100000753323_100000205941 [0,2,0,0,0,0|2,0,0]=4 16494 B16R2.12623 Nc1ccc(cc1OCc2cscn2)F 7a_100000753323_100000205941 [0,2,0,0,0,0|2,0,0]=4 16495 B16R2.12623 Nc1ccc(cc1OCc2cscn2)I 34a_100000057187_100000205941 [0,2,0,0,0,0|2,0,0]=4 16496 B16R2.12623 Nc1ccc(cc1OCc2cscn2)I 7a_100000057187_100000205941 [0,2,0,0,0,0|2,0,0]=4 16497 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000187925_100000707719 [0,2,0,0,0,0|1,0,0]=3 16498 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100000187925 [0,2,0,0,0,0|1,0,0]=3 16499 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000761889 [0,2,0,0,0,0|1,0,0]=3 16500 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000761889_100000707719 [0,2,0,0,0,0|1,0,0]=3 16501 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000760547 [0,2,0,0,0,0|1,0,0]=3 16502 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)F 62a_100000760547_100000707719 [0,2,0,0,0,0|1,0,0]=3 16503 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)O 62a_100000707719_100012001276 [0,2,0,0,0,0|1,0,0]=3 16504 B16R2.12623 Nc1ccc(cc1SCc2c[nH]cn2)O 62a_100012001276_100000707719 [0,2,0,0,0,0|1,0,0]=3 16505 B16R2.12623 Nc1ccc(cc1SCc2cscn2)Br 62a_100000187925_100000205941 [0,2,0,0,0,0|2,0,0]=4 16506 B16R2.12623 Nc1ccc(cc1SCc2cscn2)Br 62a_100000205941_100000187925 [0,2,0,0,0,0|2,0,0]=4 16507 B16R2.12623 Nc1ccc(cc1SCc2cscn2)Cl 62a_100000205941_100000761889 [0,2,0,0,0,0|2,0,0]=4 16508 B16R2.12623 Nc1ccc(cc1SCc2cscn2)Cl 62a_100000761889_100000205941 [0,2,0,0,0,0|2,0,0]=4 16509 B16R2.12623 Nc1ccc(cc1SCc2cscn2)F 62a_100000205941_100000760547 [0,2,0,0,0,0|2,0,0]=4 16510 B16R2.12623 Nc1ccc(cc1SCc2cscn2)F 62a_100000760547_100000205941 [0,2,0,0,0,0|2,0,0]=4 16511 B16R2.12623 Nc1ccc(cc1SCc2cscn2)O 62a_100000205941_100012001276 [0,2,0,0,0,0|2,0,0]=4 16512 B16R2.12623 Nc1ccc(cc1SCc2cscn2)O 62a_100012001276_100000205941 [0,2,0,0,0,0|2,0,0]=4 16513 B16R2.12623 Nc1ccc(nc1NCc2c[nH]cn2)F 27a_100000758547_100009879877 [0,2,0,0,0,0|1,0,0]=3 16514 B16R2.12623 Nc1ccc(nc1NCc2c[nH]nn2)F 27a_100020620823_100009879877 [0,2,0,0,0,0|2,0,0]=4 16515 B16R2.12623 Nc1ccc(nc1NCc2cocn2)F 27a_100015188801_100009879877 [0,2,0,0,0,0|2,0,0]=4 16516 B16R2.12623 Nc1ccc(nc1NCc2cscn2)F 27a_100015185402_100009879877 [0,2,0,0,0,0|2,0,0]=4 16517 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)Br 62a_100000707719_100010168765 [0,2,0,0,0,0|2,0,0]=4 16518 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)Br 62a_100010168765_100000707719 [0,2,0,0,0,0|2,0,0]=4 16519 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)Cl 62a_100000707719_100010233647 [0,2,0,0,0,0|2,0,0]=4 16520 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)Cl 62a_100010233647_100000707719 [0,2,0,0,0,0|2,0,0]=4 16521 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)F 62a_100000707719_100009879877 [0,2,0,0,0,0|2,0,0]=4 16522 B16R2.12623 Nc1ccc(nc1SCc2c[nH]cn2)F 62a_100009879877_100000707719 [0,2,0,0,0,0|2,0,0]=4 16523 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100010201102 [0,2,0,0,0,0|2,0,0]=4 16524 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)Br 62a_100010201102_100000707719 [0,2,0,0,0,0|2,0,0]=4 16525 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100010253917 [0,2,0,0,0,0|2,0,0]=4 16526 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)Cl 62a_100010253917_100000707719 [0,2,0,0,0,0|2,0,0]=4 16527 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100009840397 [0,2,0,0,0,0|2,0,0]=4 16528 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100009840397_100000707719 [0,2,0,0,0,0|2,0,0]=4 16529 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)N 62a_100000707719_200011934315 [0,2,0,0,0,0|2,0,0]=4 16530 B16R2.12623 Nc1cnc(c(c1)SCc2c[nH]cn2)N 62a_200011934315_100000707719 [0,2,0,0,0,0|2,0,0]=4 16531 B16R2.12623 Nc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000050123_100000707719 [0,2,0,0,0,0|2,0,0]=4 16532 B16R2.12623 Nc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000050123 [0,2,0,0,0,0|2,0,0]=4 16533 B16R2.12623 Nc1ncc(c(n1)NCc2c[nH]cn2)F 27a_100000758547_200000093006 [0,2,0,0,0,0|2,0,0]=4 16534 B16R2.12623 Nc1ncc(cc1OCc2c[nH]cn2)Br 34a_100009819042_100000707719 [0,2,0,0,0,0|2,0,0]=4 16535 B16R2.12623 Nc1ncc(cc1OCc2c[nH]cn2)Cl 34a_100000123674_100000707719 [0,2,0,0,0,0|2,0,0]=4 16536 B16R2.12623 Nc1ncc(cc1OCc2c[nH]cn2)F 34a_100000094369_100000707719 [0,2,0,0,0,0|2,0,0]=4 16537 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100000760472 [0,2,0,0,0,0|2,0,0]=4 16538 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000760472_100000707719 [0,2,0,0,0,0|2,0,0]=4 16539 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100000050159_100000707719 [0,2,0,0,0,0|2,0,0]=4 16540 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000050159 [0,2,0,0,0,0|2,0,0]=4 16541 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)F 62a_100000707719_100009814671 [0,2,0,0,0,0|2,0,0]=4 16542 B16R2.12623 Nc1ncc(cc1SCc2c[nH]cn2)F 62a_100009814671_100000707719 [0,2,0,0,0,0|2,0,0]=4 16543 B16R2.12623 O=c1[nH]cc(cc1SCc2c[nH]cn2)F 62a_100000707719_100009817720 [0,2,0,0,0,0|2,0,0]=4 16544 B16R2.12623 O=c1[nH]cc(cc1SCc2c[nH]cn2)F 62a_100009817720_100000707719 [0,2,0,0,0,0|2,0,0]=4 16545 B16R2.12623 O=c1cc(c(c[nH]1)Cl)OCc2c[nH]cn2 34a_100000069390_100000707719 [0,2,0,0,0,0|2,0,0]=4 16546 B16R2.12623 O=c1cc(c(c[nH]1)F)SCc2c[nH]cn2 62a_100000707719_100009817642 [0,2,0,0,0,0|2,0,0]=4 16547 B16R2.12623 O=c1cc(c(c[nH]1)F)SCc2c[nH]cn2 62a_100009817642_100000707719 [0,2,0,0,0,0|2,0,0]=4 16548 B16R2.12623 Oc1ccc(c(c1)NCc2c[nH]cn2)Br 34a_100011999798_100000707719 [0,2,0,0,0,0|0,0,0]=2 16549 B16R2.12623 Oc1ccc(c(c1)NCc2c[nH]cn2)Cl 34a_100011934297_100000707719 [0,2,0,0,0,0|0,0,0]=2 16550 B16R2.12623 Oc1ccc(c(c1)NCc2c[nH]cn2)F 34a_100012017239_100000707719 [0,2,0,0,0,0|0,0,0]=2 16551 B16R2.12623 Oc1ccc(c(c1)NCc2ccco2)F 270302a_100012017239_100000186105 [0,2,0,0,0,0|2,0,0]=4 16552 B16R2.12623 Oc1ccc(c(c1)NCc2cccs2)F 270302a_100012017239_100000209959 [0,2,0,0,0,0|2,0,0]=4 16553 B16R2.12623 Oc1ccc(c(c1)NCc2ccon2)Br 34a_100011999798_100000234950 [0,2,0,0,0,0|2,0,0]=4 16554 B16R2.12623 Oc1ccc(c(c1)NCc2ccon2)Cl 34a_100011934297_100000234950 [0,2,0,0,0,0|2,0,0]=4 16555 B16R2.12623 Oc1ccc(c(c1)NCc2ccon2)F 34a_100012017239_100000234950 [0,2,0,0,0,0|2,0,0]=4 16556 B16R2.12623 Oc1ccc(c(c1)NCc2ccsc2)Br 34a_100011999798_100011261437 [0,2,0,0,0,0|2,0,0]=4 16557 B16R2.12623 Oc1ccc(c(c1)NCc2ccsc2)Cl 34a_100011934297_100011261437 [0,2,0,0,0,0|2,0,0]=4 16558 B16R2.12623 Oc1ccc(c(c1)NCc2ccsc2)F 270302a_100012017239_100000188534 [0,2,0,0,0,0|2,0,0]=4 16559 B16R2.12623 Oc1ccc(c(c1)NCc2ccsc2)F 34a_100012017239_100011261437 [0,2,0,0,0,0|2,0,0]=4 16560 B16R2.12623 Oc1ccc(c(c1)NCc2cn[nH]c2)F 270302a_100012017239_100016992096 [0,2,0,0,0,0|2,0,0]=4 16561 B16R2.12623 Oc1ccc(c(c1)NCc2cncs2)Br 34a_100011999798_100015185245 [0,2,0,0,0,0|1,0,1]=4 16562 B16R2.12623 Oc1ccc(c(c1)NCc2cncs2)Cl 34a_100011934297_100015185245 [0,2,0,0,0,0|1,0,1]=4 16563 B16R2.12623 Oc1ccc(c(c1)NCc2cncs2)F 270302a_100012017239_100000749870 [0,2,0,0,0,0|1,0,1]=4 16564 B16R2.12623 Oc1ccc(c(c1)NCc2cncs2)F 34a_100012017239_100015185245 [0,2,0,0,0,0|1,0,1]=4 16565 B16R2.12623 Oc1ccc(c(c1)NCc2cscn2)Br 34a_100011999798_100000205941 [0,2,0,0,0,0|1,0,0]=3 16566 B16R2.12623 Oc1ccc(c(c1)NCc2cscn2)Cl 34a_100011934297_100000205941 [0,2,0,0,0,0|1,0,0]=3 16567 B16R2.12623 Oc1ccc(c(c1)NCc2cscn2)F 270302a_100012017239_100000743575 [0,2,0,0,0,0|1,0,0]=3 16568 B16R2.12623 Oc1ccc(c(c1)NCc2cscn2)F 34a_100012017239_100000205941 [0,2,0,0,0,0|1,0,0]=3 16569 B16R2.12623 Oc1ccc(c(c1)NCc2ncc[nH]2)Br 34a_100011999798_100016991755 [0,2,0,0,0,0|2,0,0]=4 16570 B16R2.12623 Oc1ccc(c(c1)NCc2ncc[nH]2)Cl 34a_100011934297_100016991755 [0,2,0,0,0,0|2,0,0]=4 16571 B16R2.12623 Oc1ccc(c(c1)NCc2ncc[nH]2)F 34a_100012017239_100016991755 [0,2,0,0,0,0|2,0,0]=4 16572 B16R2.12623 Oc1ccc(c(c1)NCc2ncco2)Br 34a_100011999798_103436540062 [0,2,0,0,0,0|2,0,0]=4 16573 B16R2.12623 Oc1ccc(c(c1)NCc2ncco2)Cl 34a_100011934297_103436540062 [0,2,0,0,0,0|2,0,0]=4 16574 B16R2.12623 Oc1ccc(c(c1)NCc2ncco2)F 34a_100012017239_103436540062 [0,2,0,0,0,0|2,0,0]=4 16575 B16R2.12623 Oc1ccc(c(c1)NCc2nccs2)Br 34a_100011999798_100015184050 [0,2,0,0,0,0|2,0,0]=4 16576 B16R2.12623 Oc1ccc(c(c1)NCc2nccs2)Cl 34a_100011934297_100015184050 [0,2,0,0,0,0|2,0,0]=4 16577 B16R2.12623 Oc1ccc(c(c1)NCc2nccs2)F 270302a_100012017239_100000750902 [0,2,0,0,0,0|2,0,0]=4 16578 B16R2.12623 Oc1ccc(c(c1)NCc2nccs2)F 34a_100012017239_100015184050 [0,2,0,0,0,0|2,0,0]=4 16579 B16R2.12623 Oc1ccc(c(c1)NCc2ncon2)Br 34a_100011999798_100000233494 [0,2,0,0,0,0|2,0,0]=4 16580 B16R2.12623 Oc1ccc(c(c1)NCc2ncon2)Cl 34a_100011934297_100000233494 [0,2,0,0,0,0|2,0,0]=4 16581 B16R2.12623 Oc1ccc(c(c1)NCc2ncon2)F 34a_100012017239_100000233494 [0,2,0,0,0,0|2,0,0]=4 16582 B16R2.12623 Oc1ccc(c(c1)NCn2cncn2)Br 34a_100011999798_200020645497 [0,2,0,0,0,0|1,0,1]=4 16583 B16R2.12623 Oc1ccc(c(c1)NCn2cncn2)Cl 34a_100011934297_200020645497 [0,2,0,0,0,0|1,0,1]=4 16584 B16R2.12623 Oc1ccc(c(c1)NCn2cncn2)F 34a_100012017239_200020645497 [0,2,0,0,0,0|1,0,1]=4 16585 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100000707719_100012339312 [0,2,0,0,0,0|1,0,0]=3 16586 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)Br 62a_100012339312_100000707719 [0,2,0,0,0,0|1,0,0]=3 16587 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000049588_100000707719 [0,2,0,0,0,0|1,0,0]=3 16588 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100000049588 [0,2,0,0,0,0|1,0,0]=3 16589 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000693481_100000707719 [0,2,0,0,0,0|1,0,0]=3 16590 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100000693481 [0,2,0,0,0,0|1,0,0]=3 16591 B16R2.12623 Oc1ccc(c(c1)SCc2c[nH]cn2)O 62a_100000707719_100009813629 [0,2,0,0,0,0|1,0,0]=3 16592 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)Br 62a_100000205941_100012339312 [0,2,0,0,0,0|2,0,0]=4 16593 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)Br 62a_100012339312_100000205941 [0,2,0,0,0,0|2,0,0]=4 16594 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)Cl 62a_100000049588_100000205941 [0,2,0,0,0,0|2,0,0]=4 16595 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)Cl 62a_100000205941_100000049588 [0,2,0,0,0,0|2,0,0]=4 16596 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)F 62a_100000205941_100000693481 [0,2,0,0,0,0|2,0,0]=4 16597 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)F 62a_100000693481_100000205941 [0,2,0,0,0,0|2,0,0]=4 16598 B16R2.12623 Oc1ccc(c(c1)SCc2cscn2)O 62a_100000205941_100009813629 [0,2,0,0,0,0|2,0,0]=4 16599 B16R2.12623 Oc1ccc(cc1CSc2c[nH]cn2)F 62a_100000756875_100010161318 [0,2,0,0,0,0|2,0,0]=4 16600 B16R2.12623 Oc1ccc(cc1CSc2c[nH]cn2)F 62a_100010161318_100000756875 [0,2,0,0,0,0|2,0,0]=4 16601 B16R2.12623 Oc1ccc(cc1NCc2c[nH]cn2)Br 34a_100000752626_100000707719 [0,2,0,0,0,0|0,0,0]=2 16602 B16R2.12623 Oc1ccc(cc1NCc2c[nH]cn2)Cl 34a_100000210500_100000707719 [0,2,0,0,0,0|0,0,0]=2 16603 B16R2.12623 Oc1ccc(cc1NCc2c[nH]cn2)F 34a_100000759472_100000707719 [0,2,0,0,0,0|0,0,0]=2 16604 B16R2.12623 Oc1ccc(cc1NCc2ccon2)Br 34a_100000752626_100000234950 [0,2,0,0,0,0|2,0,0]=4 16605 B16R2.12623 Oc1ccc(cc1NCc2ccon2)Cl 34a_100000210500_100000234950 [0,2,0,0,0,0|2,0,0]=4 16606 B16R2.12623 Oc1ccc(cc1NCc2ccon2)F 34a_100000759472_100000234950 [0,2,0,0,0,0|2,0,0]=4 16607 B16R2.12623 Oc1ccc(cc1NCc2ccsc2)Br 34a_100000752626_100011261437 [0,2,0,0,0,0|2,0,0]=4 16608 B16R2.12623 Oc1ccc(cc1NCc2ccsc2)Cl 34a_100000210500_100011261437 [0,2,0,0,0,0|2,0,0]=4 16609 B16R2.12623 Oc1ccc(cc1NCc2ccsc2)F 34a_100000759472_100011261437 [0,2,0,0,0,0|2,0,0]=4 16610 B16R2.12623 Oc1ccc(cc1NCc2cncs2)Br 34a_100000752626_100015185245 [0,2,0,0,0,0|1,0,1]=4 16611 B16R2.12623 Oc1ccc(cc1NCc2cncs2)Cl 34a_100000210500_100015185245 [0,2,0,0,0,0|1,0,1]=4 16612 B16R2.12623 Oc1ccc(cc1NCc2cncs2)F 34a_100000759472_100015185245 [0,2,0,0,0,0|1,0,1]=4 16613 B16R2.12623 Oc1ccc(cc1NCc2cscn2)Br 34a_100000752626_100000205941 [0,2,0,0,0,0|1,0,0]=3 16614 B16R2.12623 Oc1ccc(cc1NCc2cscn2)Cl 34a_100000210500_100000205941 [0,2,0,0,0,0|1,0,0]=3 16615 B16R2.12623 Oc1ccc(cc1NCc2cscn2)F 34a_100000759472_100000205941 [0,2,0,0,0,0|1,0,0]=3 16616 B16R2.12623 Oc1ccc(cc1NCc2ncc[nH]2)Br 34a_100000752626_100016991755 [0,2,0,0,0,0|2,0,0]=4 16617 B16R2.12623 Oc1ccc(cc1NCc2ncc[nH]2)Cl 34a_100000210500_100016991755 [0,2,0,0,0,0|2,0,0]=4 16618 B16R2.12623 Oc1ccc(cc1NCc2ncc[nH]2)F 34a_100000759472_100016991755 [0,2,0,0,0,0|2,0,0]=4 16619 B16R2.12623 Oc1ccc(cc1NCc2ncco2)Br 34a_100000752626_103436540062 [0,2,0,0,0,0|2,0,0]=4 16620 B16R2.12623 Oc1ccc(cc1NCc2ncco2)Cl 34a_100000210500_103436540062 [0,2,0,0,0,0|2,0,0]=4 16621 B16R2.12623 Oc1ccc(cc1NCc2ncco2)F 34a_100000759472_103436540062 [0,2,0,0,0,0|2,0,0]=4 16622 B16R2.12623 Oc1ccc(cc1NCc2nccs2)Br 34a_100000752626_100015184050 [0,2,0,0,0,0|2,0,0]=4 16623 B16R2.12623 Oc1ccc(cc1NCc2nccs2)Cl 34a_100000210500_100015184050 [0,2,0,0,0,0|2,0,0]=4 16624 B16R2.12623 Oc1ccc(cc1NCc2nccs2)F 34a_100000759472_100015184050 [0,2,0,0,0,0|2,0,0]=4 16625 B16R2.12623 Oc1ccc(cc1NCc2ncon2)Br 34a_100000752626_100000233494 [0,2,0,0,0,0|2,0,0]=4 16626 B16R2.12623 Oc1ccc(cc1NCc2ncon2)Cl 34a_100000210500_100000233494 [0,2,0,0,0,0|2,0,0]=4 16627 B16R2.12623 Oc1ccc(cc1NCc2ncon2)F 34a_100000759472_100000233494 [0,2,0,0,0,0|2,0,0]=4 16628 B16R2.12623 Oc1ccc(cc1NCn2cncn2)Br 34a_100000752626_200020645497 [0,2,0,0,0,0|1,0,1]=4 16629 B16R2.12623 Oc1ccc(cc1NCn2cncn2)Cl 34a_100000210500_200020645497 [0,2,0,0,0,0|1,0,1]=4 16630 B16R2.12623 Oc1ccc(cc1NCn2cncn2)F 34a_100000759472_200020645497 [0,2,0,0,0,0|1,0,1]=4 16631 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100012355227 [0,2,0,0,0,0|1,0,0]=3 16632 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)Br 62a_100012355227_100000707719 [0,2,0,0,0,0|1,0,0]=3 16633 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100011356953 [0,2,0,0,0,0|1,0,0]=3 16634 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)Cl 62a_100011356953_100000707719 [0,2,0,0,0,0|1,0,0]=3 16635 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)F 62a_100000211999_100000707719 [0,2,0,0,0,0|1,0,0]=3 16636 B16R2.12623 Oc1ccc(cc1SCc2c[nH]cn2)F 62a_100000707719_100000211999 [0,2,0,0,0,0|1,0,0]=3 16637 B16R2.12623 Oc1ccc(cc1SCc2cscn2)Br 62a_100000205941_100012355227 [0,2,0,0,0,0|2,0,0]=4 16638 B16R2.12623 Oc1ccc(cc1SCc2cscn2)Br 62a_100012355227_100000205941 [0,2,0,0,0,0|2,0,0]=4 16639 B16R2.12623 Oc1ccc(cc1SCc2cscn2)Cl 62a_100000205941_100011356953 [0,2,0,0,0,0|2,0,0]=4 16640 B16R2.12623 Oc1ccc(cc1SCc2cscn2)Cl 62a_100011356953_100000205941 [0,2,0,0,0,0|2,0,0]=4 16641 B16R2.12623 Oc1ccc(cc1SCc2cscn2)F 62a_100000205941_100000211999 [0,2,0,0,0,0|2,0,0]=4 16642 B16R2.12623 Oc1ccc(cc1SCc2cscn2)F 62a_100000211999_100000205941 [0,2,0,0,0,0|2,0,0]=4 16643 B16R2.12623 Oc1ccc(nc1SCc2c[nH]cn2)Br 62a_100000707719_100010253912 [0,2,0,0,0,0|2,0,0]=4 16644 B16R2.12623 Oc1ccc(nc1SCc2c[nH]cn2)Br 62a_100010253912_100000707719 [0,2,0,0,0,0|2,0,0]=4 16645 B16R2.12623 Oc1ccc(nc1SCc2c[nH]cn2)Cl 62a_100000707719_100000696390 [0,2,0,0,0,0|2,0,0]=4 16646 B16R2.12623 Oc1ccc(nc1SCc2c[nH]cn2)F 62a_100000707719_100010382442 [0,2,0,0,0,0|2,0,0]=4 16647 B16R2.12623 Oc1ccc(nc1SCc2c[nH]cn2)F 62a_100010382442_100000707719 [0,2,0,0,0,0|2,0,0]=4 16648 B16R2.12623 Oc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100000707719_100009817267 [0,2,0,0,0,0|2,0,0]=4 16649 B16R2.12623 Oc1cnc(c(c1)SCc2c[nH]cn2)F 62a_100009817267_100000707719 [0,2,0,0,0,0|2,0,0]=4 16650 B16R2.12623 Oc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000698892_100000707719 [0,2,0,0,0,0|2,0,0]=4 16651 B16R2.12623 Oc1cnc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100000698892 [0,2,0,0,0,0|2,0,0]=4 16652 B16R2.12623 Oc1ncc(cc1SCc2c[nH]cn2)Br 62a_100000707719_100010197142 [0,2,0,0,0,0|2,0,0]=4 16653 B16R2.12623 Oc1ncc(cc1SCc2c[nH]cn2)Br 62a_100010197142_100000707719 [0,2,0,0,0,0|2,0,0]=4 16654 B16R2.12623 Oc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100000707719_100010188700 [0,2,0,0,0,0|2,0,0]=4 16655 B16R2.12623 Oc1ncc(cc1SCc2c[nH]cn2)Cl 62a_100010188700_100000707719 [0,2,0,0,0,0|2,0,0]=4 16656 B16R2.25778 Brc1cccc(c1CSc2c[nH]cn2)I 62a_100000756875_100010146611 [0,2,0,0,0,0|2,0,0]=4 16657 B16R2.25778 Brc1cccc(c1CSc2c[nH]cn2)I 62a_100010146611_100000756875 [0,2,0,0,0,0|2,0,0]=4 16658 B16R2.25778 Brc1cccc(c1NCc2c[nH]cn2)Br 34a_100000690995_100000707719 [0,2,0,0,0,0|0,0,0]=2 16659 B16R2.25778 Brc1cccc(c1NCc2ccon2)Br 34a_100000690995_100000234950 [0,2,0,0,0,0|2,0,0]=4 16660 B16R2.25778 Brc1cccc(c1NCc2ccsc2)Br 34a_100000690995_100011261437 [0,2,0,0,0,0|2,0,0]=4 16661 B16R2.25778 Brc1cccc(c1NCc2cncs2)Br 34a_100000690995_100015185245 [0,2,0,0,0,0|1,0,1]=4 16662 B16R2.25778 Brc1cccc(c1NCc2cscn2)Br 34a_100000690995_100000205941 [0,2,0,0,0,0|1,0,0]=3 16663 B16R2.25778 Brc1cccc(c1NCc2ncc[nH]2)Br 34a_100000690995_100016991755 [0,2,0,0,0,0|2,0,0]=4 16664 B16R2.25778 Brc1cccc(c1NCc2ncco2)Br 34a_100000690995_103436540062 [0,2,0,0,0,0|2,0,0]=4 16665 B16R2.25778 Brc1cccc(c1NCc2nccs2)Br 34a_100000690995_100015184050 [0,2,0,0,0,0|2,0,0]=4 16666 B16R2.25778 Brc1cccc(c1NCc2ncon2)Br 34a_100000690995_100000233494 [0,2,0,0,0,0|2,0,0]=4 16667 B16R2.25778 Brc1cccc(c1NCn2cncn2)Br 34a_100000690995_200020645497 [0,2,0,0,0,0|1,0,1]=4 16668 B16R2.25778 Brc1cccc(c1OCc2c[nH]cn2)Br 34a_100000736428_100000707719 [0,2,0,0,0,0|1,0,0]=3 16669 B16R2.25778 Brc1cccc(c1OCc2c[nH]cn2)I 34a_100010084509_100000707719 [0,2,0,0,0,0|1,0,0]=3 16670 B16R2.25778 Brc1cccc(c1OCc2cscn2)Br 34a_100000736428_100000205941 [0,2,0,0,0,0|2,0,0]=4 16671 B16R2.25778 Brc1cccc(c1OCc2cscn2)Br 7a_100000736428_100000205941 [0,2,0,0,0,0|2,0,0]=4 16672 B16R2.25778 Brc1cccc(c1OCc2cscn2)I 34a_100010084509_100000205941 [0,2,0,0,0,0|2,0,0]=4 16673 B16R2.25778 Brc1cccc(c1OCc2cscn2)I 7a_100010084509_100000205941 [0,2,0,0,0,0|2,0,0]=4 16674 B16R2.25778 Brc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100009994525 [0,2,0,0,0,0|1,0,0]=3 16675 B16R2.25778 Brc1cccc(c1SCc2c[nH]cn2)Br 62a_100009994525_100000707719 [0,2,0,0,0,0|1,0,0]=3 16676 B16R2.25778 Brc1cccc(c1SCc2cscn2)Br 62a_100000205941_100009994525 [0,2,0,0,0,0|2,0,0]=4 16677 B16R2.25778 Brc1cccc(c1SCc2cscn2)Br 62a_100009994525_100000205941 [0,2,0,0,0,0|2,0,0]=4 16678 B16R2.25778 Brc1cncc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010172828 [0,2,0,0,0,0|2,0,0]=4 16679 B16R2.25778 Brc1cncc(c1SCc2c[nH]cn2)Br 62a_100010172828_100000707719 [0,2,0,0,0,0|2,0,0]=4 16680 B16R2.25778 Cc1ccc[n+](c1SCc2c[nH]cn2)[O-] 62a_100000707719_100116209805 [0,2,0,0,0,0|2,0,0]=4 16681 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)Br 62a_100000756875_100010146847 [0,2,0,0,0,0|2,0,0]=4 16682 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)Br 62a_100010146847_100000756875 [0,2,0,0,0,0|2,0,0]=4 16683 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)C 62a_100000756875_100000758300 [0,2,0,0,0,0|2,0,0]=4 16684 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)C 62a_100000758300_100000756875 [0,2,0,0,0,0|2,0,0]=4 16685 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)F 62a_100000756875_100009814554 [0,2,0,0,0,0|2,0,0]=4 16686 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)F 62a_100009814554_100000756875 [0,2,0,0,0,0|2,0,0]=4 16687 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)I 62a_100000756875_100010150146 [0,2,0,0,0,0|2,0,0]=4 16688 B16R2.25778 Cc1cccc(c1CSc2c[nH]cn2)I 62a_100010150146_100000756875 [0,2,0,0,0,0|2,0,0]=4 16689 B16R2.25778 Cc1cccc(c1NCc2c[nH]cn2)Br 34a_100011834072_100000707719 [0,2,0,0,0,0|0,0,0]=2 16690 B16R2.25778 Cc1cccc(c1NCc2c[nH]cn2)C 34a_100000185769_100000707719 [0,2,0,0,0,0|0,0,0]=2 16691 B16R2.25778 Cc1cccc(c1NCc2c[nH]cn2)Cl 34a_100000756524_100000707719 [0,2,0,0,0,0|0,0,0]=2 16692 B16R2.25778 Cc1cccc(c1NCc2c[nH]cn2)F 34a_100000766463_100000707719 [0,2,0,0,0,0|0,0,0]=2 16693 B16R2.25778 Cc1cccc(c1NCc2c[nH]cn2)O 34a_100000743429_100000707719 [0,2,0,0,0,0|0,0,0]=2 16694 B16R2.25778 Cc1cccc(c1NCc2cc[nH]n2)C 207a_100000185769_100000738523 [0,2,0,0,0,0|2,0,0]=4 16695 B16R2.25778 Cc1cccc(c1NCc2cc[nH]n2)F 207a_100000766463_100000738523 [0,2,0,0,0,0|2,0,0]=4 16696 B16R2.25778 Cc1cccc(c1NCc2ccco2)C 207a_100000185769_100000186105 [0,2,0,0,0,0|2,0,0]=4 16697 B16R2.25778 Cc1cccc(c1NCc2ccco2)F 207a_100000766463_100000186105 [0,2,0,0,0,0|2,0,0]=4 16698 B16R2.25778 Cc1cccc(c1NCc2cccs2)C 207a_100000185769_100000209959 [0,2,0,0,0,0|2,0,0]=4 16699 B16R2.25778 Cc1cccc(c1NCc2cccs2)F 207a_100000766463_100000209959 [0,2,0,0,0,0|2,0,0]=4 16700 B16R2.25778 Cc1cccc(c1NCc2ccoc2)C 207a_100000185769_100011215517 [0,2,0,0,0,0|2,0,0]=4 16701 B16R2.25778 Cc1cccc(c1NCc2ccoc2)F 207a_100000766463_100011215517 [0,2,0,0,0,0|2,0,0]=4 16702 B16R2.25778 Cc1cccc(c1NCc2ccon2)Br 34a_100011834072_100000234950 [0,2,0,0,0,0|2,0,0]=4 16703 B16R2.25778 Cc1cccc(c1NCc2ccon2)C 34a_100000185769_100000234950 [0,2,0,0,0,0|2,0,0]=4 16704 B16R2.25778 Cc1cccc(c1NCc2ccon2)Cl 34a_100000756524_100000234950 [0,2,0,0,0,0|2,0,0]=4 16705 B16R2.25778 Cc1cccc(c1NCc2ccon2)F 34a_100000766463_100000234950 [0,2,0,0,0,0|2,0,0]=4 16706 B16R2.25778 Cc1cccc(c1NCc2ccon2)O 34a_100000743429_100000234950 [0,2,0,0,0,0|2,0,0]=4 16707 B16R2.25778 Cc1cccc(c1NCc2ccsc2)Br 34a_100011834072_100011261437 [0,2,0,0,0,0|2,0,0]=4 16708 B16R2.25778 Cc1cccc(c1NCc2ccsc2)C 207a_100000185769_100000188534 [0,2,0,0,0,0|2,0,0]=4 16709 B16R2.25778 Cc1cccc(c1NCc2ccsc2)C 34a_100000185769_100011261437 [0,2,0,0,0,0|2,0,0]=4 16710 B16R2.25778 Cc1cccc(c1NCc2ccsc2)Cl 34a_100000756524_100011261437 [0,2,0,0,0,0|2,0,0]=4 16711 B16R2.25778 Cc1cccc(c1NCc2ccsc2)F 207a_100000766463_100000188534 [0,2,0,0,0,0|2,0,0]=4 16712 B16R2.25778 Cc1cccc(c1NCc2ccsc2)F 34a_100000766463_100011261437 [0,2,0,0,0,0|2,0,0]=4 16713 B16R2.25778 Cc1cccc(c1NCc2ccsc2)O 34a_100000743429_100011261437 [0,2,0,0,0,0|2,0,0]=4 16714 B16R2.25778 Cc1cccc(c1NCc2cn[nH]c2)C 207a_100000185769_100016992096 [0,2,0,0,0,0|2,0,0]=4 16715 B16R2.25778 Cc1cccc(c1NCc2cn[nH]c2)F 207a_100000766463_100016992096 [0,2,0,0,0,0|2,0,0]=4 16716 B16R2.25778 Cc1cccc(c1NCc2cnc[nH]2)C 207a_100000185769_100000742939 [0,2,0,0,0,0|0,0,2]=4 16717 B16R2.25778 Cc1cccc(c1NCc2cnc[nH]2)F 207a_100000766463_100000742939 [0,2,0,0,0,0|0,0,2]=4 16718 B16R2.25778 Cc1cccc(c1NCc2cncs2)Br 34a_100011834072_100015185245 [0,2,0,0,0,0|1,0,1]=4 16719 B16R2.25778 Cc1cccc(c1NCc2cncs2)C 207a_100000185769_100000749870 [0,2,0,0,0,0|1,0,1]=4 16720 B16R2.25778 Cc1cccc(c1NCc2cncs2)C 34a_100000185769_100015185245 [0,2,0,0,0,0|1,0,1]=4 16721 B16R2.25778 Cc1cccc(c1NCc2cncs2)Cl 34a_100000756524_100015185245 [0,2,0,0,0,0|1,0,1]=4 16722 B16R2.25778 Cc1cccc(c1NCc2cncs2)F 207a_100000766463_100000749870 [0,2,0,0,0,0|1,0,1]=4 16723 B16R2.25778 Cc1cccc(c1NCc2cncs2)F 34a_100000766463_100015185245 [0,2,0,0,0,0|1,0,1]=4 16724 B16R2.25778 Cc1cccc(c1NCc2cncs2)O 34a_100000743429_100015185245 [0,2,0,0,0,0|1,0,1]=4 16725 B16R2.25778 Cc1cccc(c1NCc2cscn2)Br 34a_100011834072_100000205941 [0,2,0,0,0,0|1,0,0]=3 16726 B16R2.25778 Cc1cccc(c1NCc2cscn2)C 207a_100000185769_100000743575 [0,2,0,0,0,0|1,0,0]=3 16727 B16R2.25778 Cc1cccc(c1NCc2cscn2)C 34a_100000185769_100000205941 [0,2,0,0,0,0|1,0,0]=3 16728 B16R2.25778 Cc1cccc(c1NCc2cscn2)Cl 34a_100000756524_100000205941 [0,2,0,0,0,0|1,0,0]=3 16729 B16R2.25778 Cc1cccc(c1NCc2cscn2)F 207a_100000766463_100000743575 [0,2,0,0,0,0|1,0,0]=3 16730 B16R2.25778 Cc1cccc(c1NCc2cscn2)F 34a_100000766463_100000205941 [0,2,0,0,0,0|1,0,0]=3 16731 B16R2.25778 Cc1cccc(c1NCc2cscn2)O 34a_100000743429_100000205941 [0,2,0,0,0,0|1,0,0]=3 16732 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)Br 34a_100011834072_100016991755 [0,2,0,0,0,0|2,0,0]=4 16733 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)C 207a_100000185769_100000743867 [0,2,0,0,0,0|2,0,0]=4 16734 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)C 34a_100000185769_100016991755 [0,2,0,0,0,0|2,0,0]=4 16735 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000756524_100016991755 [0,2,0,0,0,0|2,0,0]=4 16736 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)F 207a_100000766463_100000743867 [0,2,0,0,0,0|2,0,0]=4 16737 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)F 34a_100000766463_100016991755 [0,2,0,0,0,0|2,0,0]=4 16738 B16R2.25778 Cc1cccc(c1NCc2ncc[nH]2)O 34a_100000743429_100016991755 [0,2,0,0,0,0|2,0,0]=4 16739 B16R2.25778 Cc1cccc(c1NCc2ncco2)Br 34a_100011834072_103436540062 [0,2,0,0,0,0|2,0,0]=4 16740 B16R2.25778 Cc1cccc(c1NCc2ncco2)C 34a_100000185769_103436540062 [0,2,0,0,0,0|2,0,0]=4 16741 B16R2.25778 Cc1cccc(c1NCc2ncco2)Cl 34a_100000756524_103436540062 [0,2,0,0,0,0|2,0,0]=4 16742 B16R2.25778 Cc1cccc(c1NCc2ncco2)F 34a_100000766463_103436540062 [0,2,0,0,0,0|2,0,0]=4 16743 B16R2.25778 Cc1cccc(c1NCc2ncco2)O 34a_100000743429_103436540062 [0,2,0,0,0,0|2,0,0]=4 16744 B16R2.25778 Cc1cccc(c1NCc2nccs2)Br 34a_100011834072_100015184050 [0,2,0,0,0,0|2,0,0]=4 16745 B16R2.25778 Cc1cccc(c1NCc2nccs2)C 207a_100000185769_100000750902 [0,2,0,0,0,0|2,0,0]=4 16746 B16R2.25778 Cc1cccc(c1NCc2nccs2)C 34a_100000185769_100015184050 [0,2,0,0,0,0|2,0,0]=4 16747 B16R2.25778 Cc1cccc(c1NCc2nccs2)Cl 34a_100000756524_100015184050 [0,2,0,0,0,0|2,0,0]=4 16748 B16R2.25778 Cc1cccc(c1NCc2nccs2)F 207a_100000766463_100000750902 [0,2,0,0,0,0|2,0,0]=4 16749 B16R2.25778 Cc1cccc(c1NCc2nccs2)F 34a_100000766463_100015184050 [0,2,0,0,0,0|2,0,0]=4 16750 B16R2.25778 Cc1cccc(c1NCc2nccs2)O 34a_100000743429_100015184050 [0,2,0,0,0,0|2,0,0]=4 16751 B16R2.25778 Cc1cccc(c1NCc2ncon2)Br 34a_100011834072_100000233494 [0,2,0,0,0,0|2,0,0]=4 16752 B16R2.25778 Cc1cccc(c1NCc2ncon2)C 34a_100000185769_100000233494 [0,2,0,0,0,0|2,0,0]=4 16753 B16R2.25778 Cc1cccc(c1NCc2ncon2)Cl 34a_100000756524_100000233494 [0,2,0,0,0,0|2,0,0]=4 16754 B16R2.25778 Cc1cccc(c1NCc2ncon2)F 34a_100000766463_100000233494 [0,2,0,0,0,0|2,0,0]=4 16755 B16R2.25778 Cc1cccc(c1NCc2ncon2)O 34a_100000743429_100000233494 [0,2,0,0,0,0|2,0,0]=4 16756 B16R2.25778 Cc1cccc(c1NCn2cncn2)Br 34a_100011834072_200020645497 [0,2,0,0,0,0|1,0,1]=4 16757 B16R2.25778 Cc1cccc(c1NCn2cncn2)C 34a_100000185769_200020645497 [0,2,0,0,0,0|1,0,1]=4 16758 B16R2.25778 Cc1cccc(c1NCn2cncn2)Cl 34a_100000756524_200020645497 [0,2,0,0,0,0|1,0,1]=4 16759 B16R2.25778 Cc1cccc(c1NCn2cncn2)F 34a_100000766463_200020645497 [0,2,0,0,0,0|1,0,1]=4 16760 B16R2.25778 Cc1cccc(c1NCn2cncn2)O 34a_100000743429_200020645497 [0,2,0,0,0,0|1,0,1]=4 16761 B16R2.25778 Cc1cccc(c1OCc2c[nH]cn2)Br 34a_100009817157_100000707719 [0,2,0,0,0,0|1,0,0]=3 16762 B16R2.25778 Cc1cccc(c1OCc2c[nH]cn2)C 34a_100000210341_100000707719 [0,2,0,0,0,0|1,0,0]=3 16763 B16R2.25778 Cc1cccc(c1OCc2c[nH]cn2)Cl 34a_100000033731_100000707719 [0,2,0,0,0,0|1,0,0]=3 16764 B16R2.25778 Cc1cccc(c1OCc2c[nH]cn2)F 34a_100011659162_100000707719 [0,2,0,0,0,0|1,0,0]=3 16765 B16R2.25778 Cc1cccc(c1OCc2c[nH]cn2)N 34a_100000756359_100000707719 [0,2,0,0,0,0|1,0,0]=3 16766 B16R2.25778 Cc1cccc(c1OCc2cscn2)Br 34a_100009817157_100000205941 [0,2,0,0,0,0|2,0,0]=4 16767 B16R2.25778 Cc1cccc(c1OCc2cscn2)Br 7a_100009817157_100000205941 [0,2,0,0,0,0|2,0,0]=4 16768 B16R2.25778 Cc1cccc(c1OCc2cscn2)C 34a_100000210341_100000205941 [0,2,0,0,0,0|2,0,0]=4 16769 B16R2.25778 Cc1cccc(c1OCc2cscn2)C 7a_100000210341_100000205941 [0,2,0,0,0,0|2,0,0]=4 16770 B16R2.25778 Cc1cccc(c1OCc2cscn2)Cl 34a_100000033731_100000205941 [0,2,0,0,0,0|2,0,0]=4 16771 B16R2.25778 Cc1cccc(c1OCc2cscn2)Cl 7a_100000033731_100000205941 [0,2,0,0,0,0|2,0,0]=4 16772 B16R2.25778 Cc1cccc(c1OCc2cscn2)F 34a_100011659162_100000205941 [0,2,0,0,0,0|2,0,0]=4 16773 B16R2.25778 Cc1cccc(c1OCc2cscn2)F 7a_100011659162_100000205941 [0,2,0,0,0,0|2,0,0]=4 16774 B16R2.25778 Cc1cccc(c1OCc2cscn2)N 34a_100000756359_100000205941 [0,2,0,0,0,0|2,0,0]=4 16775 B16R2.25778 Cc1cccc(c1OCc2cscn2)N 7a_100000756359_100000205941 [0,2,0,0,0,0|2,0,0]=4 16776 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010141302 [0,2,0,0,0,0|1,0,0]=3 16777 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)Br 62a_100010141302_100000707719 [0,2,0,0,0,0|1,0,0]=3 16778 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)C 62a_100000033847_100000707719 [0,2,0,0,0,0|1,0,0]=3 16779 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)C 62a_100000707719_100000033847 [0,2,0,0,0,0|1,0,0]=3 16780 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000043165_100000707719 [0,2,0,0,0,0|1,0,0]=3 16781 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000043165 [0,2,0,0,0,0|1,0,0]=3 16782 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100011218421 [0,2,0,0,0,0|1,0,0]=3 16783 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)F 62a_100011218421_100000707719 [0,2,0,0,0,0|1,0,0]=3 16784 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)N 62a_100000684715_100000707719 [0,2,0,0,0,0|1,0,0]=3 16785 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)N 62a_100000707719_100000684715 [0,2,0,0,0,0|1,0,0]=3 16786 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)O 62a_100000686692_100000707719 [0,2,0,0,0,0|1,0,0]=3 16787 B16R2.25778 Cc1cccc(c1SCc2c[nH]cn2)O 62a_100000707719_100000686692 [0,2,0,0,0,0|1,0,0]=3 16788 B16R2.25778 Cc1cccc(c1SCc2cscn2)Br 62a_100000205941_100010141302 [0,2,0,0,0,0|2,0,0]=4 16789 B16R2.25778 Cc1cccc(c1SCc2cscn2)Br 62a_100010141302_100000205941 [0,2,0,0,0,0|2,0,0]=4 16790 B16R2.25778 Cc1cccc(c1SCc2cscn2)C 62a_100000033847_100000205941 [0,2,0,0,0,0|2,0,0]=4 16791 B16R2.25778 Cc1cccc(c1SCc2cscn2)C 62a_100000205941_100000033847 [0,2,0,0,0,0|2,0,0]=4 16792 B16R2.25778 Cc1cccc(c1SCc2cscn2)Cl 62a_100000043165_100000205941 [0,2,0,0,0,0|2,0,0]=4 16793 B16R2.25778 Cc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000043165 [0,2,0,0,0,0|2,0,0]=4 16794 B16R2.25778 Cc1cccc(c1SCc2cscn2)F 62a_100000205941_100011218421 [0,2,0,0,0,0|2,0,0]=4 16795 B16R2.25778 Cc1cccc(c1SCc2cscn2)F 62a_100011218421_100000205941 [0,2,0,0,0,0|2,0,0]=4 16796 B16R2.25778 Cc1cccc(c1SCc2cscn2)N 62a_100000205941_100000684715 [0,2,0,0,0,0|2,0,0]=4 16797 B16R2.25778 Cc1cccc(c1SCc2cscn2)N 62a_100000684715_100000205941 [0,2,0,0,0,0|2,0,0]=4 16798 B16R2.25778 Cc1cccc(c1SCc2cscn2)O 62a_100000205941_100000686692 [0,2,0,0,0,0|2,0,0]=4 16799 B16R2.25778 Cc1cccc(c1SCc2cscn2)O 62a_100000686692_100000205941 [0,2,0,0,0,0|2,0,0]=4 16800 B16R2.25778 Cc1ccnc(c1NCc2c[nH]cn2)F 27a_100000758547_100009818256 [0,2,0,0,0,0|1,0,0]=3 16801 B16R2.25778 Cc1ccnc(c1NCc2c[nH]nn2)F 27a_100020620823_100009818256 [0,2,0,0,0,0|2,0,0]=4 16802 B16R2.25778 Cc1ccnc(c1NCc2cocn2)F 27a_100015188801_100009818256 [0,2,0,0,0,0|2,0,0]=4 16803 B16R2.25778 Cc1ccnc(c1NCc2cscn2)F 27a_100015185402_100009818256 [0,2,0,0,0,0|2,0,0]=4 16804 B16R2.25778 Cc1ccnc(c1OCc2c[nH]cn2)C 34a_100011934651_100000707719 [0,2,0,0,0,0|2,0,0]=4 16805 B16R2.25778 Cc1ccnc(c1OCc2c[nH]cn2)Cl 34a_100000696282_100000707719 [0,2,0,0,0,0|2,0,0]=4 16806 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)C 62a_100000707719_100012000501 [0,2,0,0,0,0|2,0,0]=4 16807 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)C 62a_100012000501_100000707719 [0,2,0,0,0,0|2,0,0]=4 16808 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100010248874 [0,2,0,0,0,0|2,0,0]=4 16809 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100010248874_100000707719 [0,2,0,0,0,0|2,0,0]=4 16810 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)F 62a_100000707719_100009818256 [0,2,0,0,0,0|2,0,0]=4 16811 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)F 62a_100009818256_100000707719 [0,2,0,0,0,0|2,0,0]=4 16812 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)N 62a_100000707719_100011998619 [0,2,0,0,0,0|2,0,0]=4 16813 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)N 62a_100011998619_100000707719 [0,2,0,0,0,0|2,0,0]=4 16814 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)O 62a_100000707719_100012000493 [0,2,0,0,0,0|2,0,0]=4 16815 B16R2.25778 Cc1ccnc(c1SCc2c[nH]cn2)O 62a_100012000493_100000707719 [0,2,0,0,0,0|2,0,0]=4 16816 B16R2.25778 Cc1cncc(c1SCc2c[nH]cn2)C 62a_100000707719_100009817138 [0,2,0,0,0,0|2,0,0]=4 16817 B16R2.25778 Cc1cncc(c1SCc2c[nH]cn2)C 62a_100009817138_100000707719 [0,2,0,0,0,0|2,0,0]=4 16818 B16R2.25778 Cc1nccc(c1SCc2c[nH]cn2)N 62a_100000707719_100010243816 [0,2,0,0,0,0|2,0,0]=4 16819 B16R2.25778 Cc1nccc(c1SCc2c[nH]cn2)N 62a_100010243816_100000707719 [0,2,0,0,0,0|2,0,0]=4 16820 B16R2.25778 Cc1ncnc(c1NCc2c[nH]cn2)C 27a_100000758547_100009820708 [0,2,0,0,0,0|2,0,0]=4 16821 B16R2.25778 Cc1occc(=O)c1OCc2c[nH]cn2 34a_100000031901_100000707719 [0,2,0,0,0,0|2,0,0]=4 16822 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Br 62a_100000756875_100010138402 [0,2,0,0,0,0|2,0,0]=4 16823 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Br 62a_100010138402_100000756875 [0,2,0,0,0,0|2,0,0]=4 16824 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000187851_100000756875 [0,2,0,0,0,0|2,0,0]=4 16825 B16R2.25778 Clc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000756875_100000187851 [0,2,0,0,0,0|2,0,0]=4 16826 B16R2.25778 Clc1cccc(c1NCc2c[nH]cn2)Br 34a_100102946385_100000707719 [0,2,0,0,0,0|0,0,0]=2 16827 B16R2.25778 Clc1cccc(c1NCc2c[nH]cn2)Cl 34a_100000210028_100000707719 [0,2,0,0,0,0|0,0,0]=2 16828 B16R2.25778 Clc1cccc(c1NCc2ccon2)Br 34a_100102946385_100000234950 [0,2,0,0,0,0|2,0,0]=4 16829 B16R2.25778 Clc1cccc(c1NCc2ccon2)Cl 34a_100000210028_100000234950 [0,2,0,0,0,0|2,0,0]=4 16830 B16R2.25778 Clc1cccc(c1NCc2ccsc2)Br 34a_100102946385_100011261437 [0,2,0,0,0,0|2,0,0]=4 16831 B16R2.25778 Clc1cccc(c1NCc2ccsc2)Cl 34a_100000210028_100011261437 [0,2,0,0,0,0|2,0,0]=4 16832 B16R2.25778 Clc1cccc(c1NCc2cncs2)Br 34a_100102946385_100015185245 [0,2,0,0,0,0|1,0,1]=4 16833 B16R2.25778 Clc1cccc(c1NCc2cncs2)Cl 34a_100000210028_100015185245 [0,2,0,0,0,0|1,0,1]=4 16834 B16R2.25778 Clc1cccc(c1NCc2cscn2)Br 34a_100102946385_100000205941 [0,2,0,0,0,0|1,0,0]=3 16835 B16R2.25778 Clc1cccc(c1NCc2cscn2)Cl 34a_100000210028_100000205941 [0,2,0,0,0,0|1,0,0]=3 16836 B16R2.25778 Clc1cccc(c1NCc2ncc[nH]2)Br 34a_100102946385_100016991755 [0,2,0,0,0,0|2,0,0]=4 16837 B16R2.25778 Clc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000210028_100016991755 [0,2,0,0,0,0|2,0,0]=4 16838 B16R2.25778 Clc1cccc(c1NCc2ncco2)Br 34a_100102946385_103436540062 [0,2,0,0,0,0|2,0,0]=4 16839 B16R2.25778 Clc1cccc(c1NCc2ncco2)Cl 34a_100000210028_103436540062 [0,2,0,0,0,0|2,0,0]=4 16840 B16R2.25778 Clc1cccc(c1NCc2nccs2)Br 34a_100102946385_100015184050 [0,2,0,0,0,0|2,0,0]=4 16841 B16R2.25778 Clc1cccc(c1NCc2nccs2)Cl 34a_100000210028_100015184050 [0,2,0,0,0,0|2,0,0]=4 16842 B16R2.25778 Clc1cccc(c1NCc2ncon2)Br 34a_100102946385_100000233494 [0,2,0,0,0,0|2,0,0]=4 16843 B16R2.25778 Clc1cccc(c1NCc2ncon2)Cl 34a_100000210028_100000233494 [0,2,0,0,0,0|2,0,0]=4 16844 B16R2.25778 Clc1cccc(c1NCn2cncn2)Br 34a_100102946385_200020645497 [0,2,0,0,0,0|1,0,1]=4 16845 B16R2.25778 Clc1cccc(c1NCn2cncn2)Cl 34a_100000210028_200020645497 [0,2,0,0,0,0|1,0,1]=4 16846 B16R2.25778 Clc1cccc(c1OCc2c[nH]cn2)Br 34a_100010214474_100000707719 [0,2,0,0,0,0|1,0,0]=3 16847 B16R2.25778 Clc1cccc(c1OCc2c[nH]cn2)Cl 34a_100000211709_100000707719 [0,2,0,0,0,0|1,0,0]=3 16848 B16R2.25778 Clc1cccc(c1OCc2c[nH]cn2)I 34a_100010202889_100000707719 [0,2,0,0,0,0|1,0,0]=3 16849 B16R2.25778 Clc1cccc(c1OCc2cscn2)Br 34a_100010214474_100000205941 [0,2,0,0,0,0|2,0,0]=4 16850 B16R2.25778 Clc1cccc(c1OCc2cscn2)Br 7a_100010214474_100000205941 [0,2,0,0,0,0|2,0,0]=4 16851 B16R2.25778 Clc1cccc(c1OCc2cscn2)Cl 34a_100000211709_100000205941 [0,2,0,0,0,0|2,0,0]=4 16852 B16R2.25778 Clc1cccc(c1OCc2cscn2)Cl 7a_100000211709_100000205941 [0,2,0,0,0,0|2,0,0]=4 16853 B16R2.25778 Clc1cccc(c1OCc2cscn2)I 34a_100010202889_100000205941 [0,2,0,0,0,0|2,0,0]=4 16854 B16R2.25778 Clc1cccc(c1OCc2cscn2)I 7a_100010202889_100000205941 [0,2,0,0,0,0|2,0,0]=4 16855 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010214488 [0,2,0,0,0,0|1,0,0]=3 16856 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Br 62a_100010214488_100000707719 [0,2,0,0,0,0|1,0,0]=3 16857 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000034237_100000707719 [0,2,0,0,0,0|1,0,0]=3 16858 B16R2.25778 Clc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000034237 [0,2,0,0,0,0|1,0,0]=3 16859 B16R2.25778 Clc1cccc(c1SCc2cscn2)Br 62a_100000205941_100010214488 [0,2,0,0,0,0|2,0,0]=4 16860 B16R2.25778 Clc1cccc(c1SCc2cscn2)Br 62a_100010214488_100000205941 [0,2,0,0,0,0|2,0,0]=4 16861 B16R2.25778 Clc1cccc(c1SCc2cscn2)Cl 62a_100000034237_100000205941 [0,2,0,0,0,0|2,0,0]=4 16862 B16R2.25778 Clc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000034237 [0,2,0,0,0,0|2,0,0]=4 16863 B16R2.25778 Clc1ccnc(c1OCc2c[nH]cn2)Cl 34a_100000118450_100000707719 [0,2,0,0,0,0|2,0,0]=4 16864 B16R2.25778 Clc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000050019_100000707719 [0,2,0,0,0,0|2,0,0]=4 16865 B16R2.25778 Clc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000050019 [0,2,0,0,0,0|2,0,0]=4 16866 B16R2.25778 Clc1cncc(c1SCc2c[nH]cn2)Cl 62a_100000036193_100000707719 [0,2,0,0,0,0|2,0,0]=4 16867 B16R2.25778 Clc1cncc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000036193 [0,2,0,0,0,0|2,0,0]=4 16868 B16R2.25778 Clc1nccc(c1OCc2c[nH]cn2)I 34a_100010067911_100000707719 [0,2,0,0,0,0|2,0,0]=4 16869 B16R2.25778 Clc1nccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100009814607 [0,2,0,0,0,0|2,0,0]=4 16870 B16R2.25778 Clc1nccc(c1SCc2c[nH]cn2)Br 62a_100009814607_100000707719 [0,2,0,0,0,0|2,0,0]=4 16871 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)Br 62a_100000756875_100012145669 [0,2,0,0,0,0|2,0,0]=4 16872 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)Br 62a_100012145669_100000756875 [0,2,0,0,0,0|2,0,0]=4 16873 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000187852_100000756875 [0,2,0,0,0,0|2,0,0]=4 16874 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)Cl 62a_100000756875_100000187852 [0,2,0,0,0,0|2,0,0]=4 16875 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)F 62a_100000709179_100000756875 [0,2,0,0,0,0|2,0,0]=4 16876 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)F 62a_100000756875_100000698325 [0,2,0,0,0,0|2,0,0]=4 16877 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)I 62a_100000756875_100010149602 [0,2,0,0,0,0|2,0,0]=4 16878 B16R2.25778 Fc1cccc(c1CSc2c[nH]cn2)I 62a_100010149602_100000756875 [0,2,0,0,0,0|2,0,0]=4 16879 B16R2.25778 Fc1cccc(c1NCc2c[nH]cn2)Br 34a_100000684712_100000707719 [0,2,0,0,0,0|0,0,0]=2 16880 B16R2.25778 Fc1cccc(c1NCc2c[nH]cn2)Cl 34a_100000760031_100000707719 [0,2,0,0,0,0|0,0,0]=2 16881 B16R2.25778 Fc1cccc(c1NCc2c[nH]cn2)F 2230a_100000210704_100000707719 [0,2,0,0,0,0|0,0,0]=2 16882 B16R2.25778 Fc1cccc(c1NCc2c[nH]cn2)F 34a_100000210704_100000707719 [0,2,0,0,0,0|0,0,0]=2 16883 B16R2.25778 Fc1cccc(c1NCc2c[nH]cn2)I 34a_100000042321_100000707719 [0,2,0,0,0,0|0,0,0]=2 16884 B16R2.25778 Fc1cccc(c1NCc2cc[nH]n2)F 207a_100000210704_100000738523 [0,2,0,0,0,0|2,0,0]=4 16885 B16R2.25778 Fc1cccc(c1NCc2ccco2)F 207a_100000210704_100000186105 [0,2,0,0,0,0|2,0,0]=4 16886 B16R2.25778 Fc1cccc(c1NCc2cccs2)F 207a_100000210704_100000209959 [0,2,0,0,0,0|2,0,0]=4 16887 B16R2.25778 Fc1cccc(c1NCc2ccoc2)F 207a_100000210704_100011215517 [0,2,0,0,0,0|2,0,0]=4 16888 B16R2.25778 Fc1cccc(c1NCc2ccon2)Br 34a_100000684712_100000234950 [0,2,0,0,0,0|2,0,0]=4 16889 B16R2.25778 Fc1cccc(c1NCc2ccon2)Cl 34a_100000760031_100000234950 [0,2,0,0,0,0|2,0,0]=4 16890 B16R2.25778 Fc1cccc(c1NCc2ccon2)F 2230a_100000210704_100000234950 [0,2,0,0,0,0|2,0,0]=4 16891 B16R2.25778 Fc1cccc(c1NCc2ccon2)F 34a_100000210704_100000234950 [0,2,0,0,0,0|2,0,0]=4 16892 B16R2.25778 Fc1cccc(c1NCc2ccon2)I 34a_100000042321_100000234950 [0,2,0,0,0,0|2,0,0]=4 16893 B16R2.25778 Fc1cccc(c1NCc2ccsc2)Br 34a_100000684712_100011261437 [0,2,0,0,0,0|2,0,0]=4 16894 B16R2.25778 Fc1cccc(c1NCc2ccsc2)Cl 34a_100000760031_100011261437 [0,2,0,0,0,0|2,0,0]=4 16895 B16R2.25778 Fc1cccc(c1NCc2ccsc2)F 207a_100000210704_100000188534 [0,2,0,0,0,0|2,0,0]=4 16896 B16R2.25778 Fc1cccc(c1NCc2ccsc2)F 2230a_100000210704_100011261437 [0,2,0,0,0,0|2,0,0]=4 16897 B16R2.25778 Fc1cccc(c1NCc2ccsc2)F 34a_100000210704_100011261437 [0,2,0,0,0,0|2,0,0]=4 16898 B16R2.25778 Fc1cccc(c1NCc2ccsc2)I 34a_100000042321_100011261437 [0,2,0,0,0,0|2,0,0]=4 16899 B16R2.25778 Fc1cccc(c1NCc2cn[nH]c2)F 207a_100000210704_100016992096 [0,2,0,0,0,0|2,0,0]=4 16900 B16R2.25778 Fc1cccc(c1NCc2cnc[nH]2)F 207a_100000210704_100000742939 [0,2,0,0,0,0|0,0,2]=4 16901 B16R2.25778 Fc1cccc(c1NCc2cncs2)Br 34a_100000684712_100015185245 [0,2,0,0,0,0|1,0,1]=4 16902 B16R2.25778 Fc1cccc(c1NCc2cncs2)Cl 34a_100000760031_100015185245 [0,2,0,0,0,0|1,0,1]=4 16903 B16R2.25778 Fc1cccc(c1NCc2cncs2)F 207a_100000210704_100000749870 [0,2,0,0,0,0|1,0,1]=4 16904 B16R2.25778 Fc1cccc(c1NCc2cncs2)F 2230a_100000210704_100015185245 [0,2,0,0,0,0|1,0,1]=4 16905 B16R2.25778 Fc1cccc(c1NCc2cncs2)F 34a_100000210704_100015185245 [0,2,0,0,0,0|1,0,1]=4 16906 B16R2.25778 Fc1cccc(c1NCc2cncs2)I 34a_100000042321_100015185245 [0,2,0,0,0,0|1,0,1]=4 16907 B16R2.25778 Fc1cccc(c1NCc2cscn2)Br 34a_100000684712_100000205941 [0,2,0,0,0,0|1,0,0]=3 16908 B16R2.25778 Fc1cccc(c1NCc2cscn2)Cl 34a_100000760031_100000205941 [0,2,0,0,0,0|1,0,0]=3 16909 B16R2.25778 Fc1cccc(c1NCc2cscn2)F 207a_100000210704_100000743575 [0,2,0,0,0,0|1,0,0]=3 16910 B16R2.25778 Fc1cccc(c1NCc2cscn2)F 2230a_100000210704_100000205941 [0,2,0,0,0,0|1,0,0]=3 16911 B16R2.25778 Fc1cccc(c1NCc2cscn2)F 34a_100000210704_100000205941 [0,2,0,0,0,0|1,0,0]=3 16912 B16R2.25778 Fc1cccc(c1NCc2cscn2)I 34a_100000042321_100000205941 [0,2,0,0,0,0|1,0,0]=3 16913 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)Br 34a_100000684712_100016991755 [0,2,0,0,0,0|2,0,0]=4 16914 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)Cl 34a_100000760031_100016991755 [0,2,0,0,0,0|2,0,0]=4 16915 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)F 207a_100000210704_100000743867 [0,2,0,0,0,0|2,0,0]=4 16916 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)F 2230a_100000210704_100016991755 [0,2,0,0,0,0|2,0,0]=4 16917 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)F 34a_100000210704_100016991755 [0,2,0,0,0,0|2,0,0]=4 16918 B16R2.25778 Fc1cccc(c1NCc2ncc[nH]2)I 34a_100000042321_100016991755 [0,2,0,0,0,0|2,0,0]=4 16919 B16R2.25778 Fc1cccc(c1NCc2ncco2)Br 34a_100000684712_103436540062 [0,2,0,0,0,0|2,0,0]=4 16920 B16R2.25778 Fc1cccc(c1NCc2ncco2)Cl 34a_100000760031_103436540062 [0,2,0,0,0,0|2,0,0]=4 16921 B16R2.25778 Fc1cccc(c1NCc2ncco2)F 2230a_100000210704_103436540062 [0,2,0,0,0,0|2,0,0]=4 16922 B16R2.25778 Fc1cccc(c1NCc2ncco2)F 34a_100000210704_103436540062 [0,2,0,0,0,0|2,0,0]=4 16923 B16R2.25778 Fc1cccc(c1NCc2ncco2)I 34a_100000042321_103436540062 [0,2,0,0,0,0|2,0,0]=4 16924 B16R2.25778 Fc1cccc(c1NCc2nccs2)Br 34a_100000684712_100015184050 [0,2,0,0,0,0|2,0,0]=4 16925 B16R2.25778 Fc1cccc(c1NCc2nccs2)Cl 34a_100000760031_100015184050 [0,2,0,0,0,0|2,0,0]=4 16926 B16R2.25778 Fc1cccc(c1NCc2nccs2)F 207a_100000210704_100000750902 [0,2,0,0,0,0|2,0,0]=4 16927 B16R2.25778 Fc1cccc(c1NCc2nccs2)F 2230a_100000210704_100015184050 [0,2,0,0,0,0|2,0,0]=4 16928 B16R2.25778 Fc1cccc(c1NCc2nccs2)F 34a_100000210704_100015184050 [0,2,0,0,0,0|2,0,0]=4 16929 B16R2.25778 Fc1cccc(c1NCc2nccs2)I 34a_100000042321_100015184050 [0,2,0,0,0,0|2,0,0]=4 16930 B16R2.25778 Fc1cccc(c1NCc2ncon2)Br 34a_100000684712_100000233494 [0,2,0,0,0,0|2,0,0]=4 16931 B16R2.25778 Fc1cccc(c1NCc2ncon2)Cl 34a_100000760031_100000233494 [0,2,0,0,0,0|2,0,0]=4 16932 B16R2.25778 Fc1cccc(c1NCc2ncon2)F 34a_100000210704_100000233494 [0,2,0,0,0,0|2,0,0]=4 16933 B16R2.25778 Fc1cccc(c1NCc2ncon2)I 34a_100000042321_100000233494 [0,2,0,0,0,0|2,0,0]=4 16934 B16R2.25778 Fc1cccc(c1NCn2cncn2)Br 34a_100000684712_200020645497 [0,2,0,0,0,0|1,0,1]=4 16935 B16R2.25778 Fc1cccc(c1NCn2cncn2)Cl 34a_100000760031_200020645497 [0,2,0,0,0,0|1,0,1]=4 16936 B16R2.25778 Fc1cccc(c1NCn2cncn2)F 2230a_100000210704_200020645497 [0,2,0,0,0,0|1,0,1]=4 16937 B16R2.25778 Fc1cccc(c1NCn2cncn2)F 34a_100000210704_200020645497 [0,2,0,0,0,0|1,0,1]=4 16938 B16R2.25778 Fc1cccc(c1NCn2cncn2)I 34a_100000042321_200020645497 [0,2,0,0,0,0|1,0,1]=4 16939 B16R2.25778 Fc1cccc(c1OCc2c[nH]cn2)Br 34a_100009813666_100000707719 [0,2,0,0,0,0|1,0,0]=3 16940 B16R2.25778 Fc1cccc(c1OCc2c[nH]cn2)Cl 34a_100000694953_100000707719 [0,2,0,0,0,0|1,0,0]=3 16941 B16R2.25778 Fc1cccc(c1OCc2c[nH]cn2)F 34a_100000230165_100000707719 [0,2,0,0,0,0|1,0,0]=3 16942 B16R2.25778 Fc1cccc(c1OCc2c[nH]cn2)I 34a_100010186298_100000707719 [0,2,0,0,0,0|1,0,0]=3 16943 B16R2.25778 Fc1cccc(c1OCc2cscn2)Br 34a_100009813666_100000205941 [0,2,0,0,0,0|2,0,0]=4 16944 B16R2.25778 Fc1cccc(c1OCc2cscn2)Br 7a_100009813666_100000205941 [0,2,0,0,0,0|2,0,0]=4 16945 B16R2.25778 Fc1cccc(c1OCc2cscn2)Cl 34a_100000694953_100000205941 [0,2,0,0,0,0|2,0,0]=4 16946 B16R2.25778 Fc1cccc(c1OCc2cscn2)Cl 7a_100000694953_100000205941 [0,2,0,0,0,0|2,0,0]=4 16947 B16R2.25778 Fc1cccc(c1OCc2cscn2)F 34a_100000230165_100000205941 [0,2,0,0,0,0|2,0,0]=4 16948 B16R2.25778 Fc1cccc(c1OCc2cscn2)F 7a_100000230165_100000205941 [0,2,0,0,0,0|2,0,0]=4 16949 B16R2.25778 Fc1cccc(c1OCc2cscn2)I 34a_100010186298_100000205941 [0,2,0,0,0,0|2,0,0]=4 16950 B16R2.25778 Fc1cccc(c1OCc2cscn2)I 7a_100010186298_100000205941 [0,2,0,0,0,0|2,0,0]=4 16951 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100011219512 [0,2,0,0,0,0|1,0,0]=3 16952 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)Br 62a_100011219512_100000707719 [0,2,0,0,0,0|1,0,0]=3 16953 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000050007_100000707719 [0,2,0,0,0,0|1,0,0]=3 16954 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000050007 [0,2,0,0,0,0|1,0,0]=3 16955 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)F 62a_100000693133_100000707719 [0,2,0,0,0,0|1,0,0]=3 16956 B16R2.25778 Fc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100000693133 [0,2,0,0,0,0|1,0,0]=3 16957 B16R2.25778 Fc1cccc(c1SCc2cscn2)Br 62a_100000205941_100011219512 [0,2,0,0,0,0|2,0,0]=4 16958 B16R2.25778 Fc1cccc(c1SCc2cscn2)Br 62a_100011219512_100000205941 [0,2,0,0,0,0|2,0,0]=4 16959 B16R2.25778 Fc1cccc(c1SCc2cscn2)Cl 62a_100000050007_100000205941 [0,2,0,0,0,0|2,0,0]=4 16960 B16R2.25778 Fc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000050007 [0,2,0,0,0,0|2,0,0]=4 16961 B16R2.25778 Fc1cccc(c1SCc2cscn2)F 62a_100000205941_100000693133 [0,2,0,0,0,0|2,0,0]=4 16962 B16R2.25778 Fc1cccc(c1SCc2cscn2)F 62a_100000693133_100000205941 [0,2,0,0,0,0|2,0,0]=4 16963 B16R2.25778 Fc1ccnc(c1NCc2c[nH]cn2)F 27a_100000758547_100009874084 [0,2,0,0,0,0|1,0,0]=3 16964 B16R2.25778 Fc1ccnc(c1NCc2c[nH]nn2)F 27a_100020620823_100009874084 [0,2,0,0,0,0|2,0,0]=4 16965 B16R2.25778 Fc1ccnc(c1NCc2cocn2)F 27a_100015188801_100009874084 [0,2,0,0,0,0|2,0,0]=4 16966 B16R2.25778 Fc1ccnc(c1NCc2cscn2)F 27a_100015185402_100009874084 [0,2,0,0,0,0|2,0,0]=4 16967 B16R2.25778 Fc1ccnc(c1OCc2c[nH]cn2)Cl 34a_100009867227_100000707719 [0,2,0,0,0,0|2,0,0]=4 16968 B16R2.25778 Fc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000716511 [0,2,0,0,0,0|2,0,0]=4 16969 B16R2.25778 Fc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000716511_100000707719 [0,2,0,0,0,0|2,0,0]=4 16970 B16R2.25778 Fc1ccnc(c1SCc2c[nH]cn2)F 62a_100000707719_100009874084 [0,2,0,0,0,0|2,0,0]=4 16971 B16R2.25778 Fc1ccnc(c1SCc2c[nH]cn2)F 62a_100009874084_100000707719 [0,2,0,0,0,0|2,0,0]=4 16972 B16R2.25778 Fc1cncc(c1SCc2c[nH]cn2)F 62a_100000707719_100000760538 [0,2,0,0,0,0|2,0,0]=4 16973 B16R2.25778 Fc1cncc(c1SCc2c[nH]cn2)F 62a_100000760538_100000707719 [0,2,0,0,0,0|2,0,0]=4 16974 B16R2.25778 Nc1cccc(c1OCc2c[nH]cn2)Br 34a_100011934915_100000707719 [0,2,0,0,0,0|1,0,0]=3 16975 B16R2.25778 Nc1cccc(c1OCc2c[nH]cn2)Cl 34a_100000754742_100000707719 [0,2,0,0,0,0|1,0,0]=3 16976 B16R2.25778 Nc1cccc(c1OCc2c[nH]cn2)F 34a_100011934987_100000707719 [0,2,0,0,0,0|1,0,0]=3 16977 B16R2.25778 Nc1cccc(c1OCc2c[nH]cn2)I 34a_100010084371_100000707719 [0,2,0,0,0,0|1,0,0]=3 16978 B16R2.25778 Nc1cccc(c1OCc2c[nH]cn2)N 34a_200016994477_100000707719 [0,2,0,0,0,0|1,0,0]=3 16979 B16R2.25778 Nc1cccc(c1OCc2cscn2)Br 34a_100011934915_100000205941 [0,2,0,0,0,0|2,0,0]=4 16980 B16R2.25778 Nc1cccc(c1OCc2cscn2)Cl 34a_100000754742_100000205941 [0,2,0,0,0,0|2,0,0]=4 16981 B16R2.25778 Nc1cccc(c1OCc2cscn2)F 34a_100011934987_100000205941 [0,2,0,0,0,0|2,0,0]=4 16982 B16R2.25778 Nc1cccc(c1OCc2cscn2)I 34a_100010084371_100000205941 [0,2,0,0,0,0|2,0,0]=4 16983 B16R2.25778 Nc1cccc(c1OCc2cscn2)N 34a_200016994477_100000205941 [0,2,0,0,0,0|2,0,0]=4 16984 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100020590159 [0,2,0,0,0,0|1,0,0]=3 16985 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)Br 62a_100020590159_100000707719 [0,2,0,0,0,0|1,0,0]=3 16986 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000049713_100000707719 [0,2,0,0,0,0|1,0,0]=3 16987 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000049713 [0,2,0,0,0,0|1,0,0]=3 16988 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)F 62a_100000690935_100000707719 [0,2,0,0,0,0|1,0,0]=3 16989 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100000690935 [0,2,0,0,0,0|1,0,0]=3 16990 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)O 62a_100000707719_100012183704 [0,2,0,0,0,0|1,0,0]=3 16991 B16R2.25778 Nc1cccc(c1SCc2c[nH]cn2)O 62a_100012183704_100000707719 [0,2,0,0,0,0|1,0,0]=3 16992 B16R2.25778 Nc1cccc(c1SCc2cscn2)Br 62a_100000205941_100020590159 [0,2,0,0,0,0|2,0,0]=4 16993 B16R2.25778 Nc1cccc(c1SCc2cscn2)Br 62a_100020590159_100000205941 [0,2,0,0,0,0|2,0,0]=4 16994 B16R2.25778 Nc1cccc(c1SCc2cscn2)Cl 62a_100000049713_100000205941 [0,2,0,0,0,0|2,0,0]=4 16995 B16R2.25778 Nc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000049713 [0,2,0,0,0,0|2,0,0]=4 16996 B16R2.25778 Nc1cccc(c1SCc2cscn2)F 62a_100000205941_100000690935 [0,2,0,0,0,0|2,0,0]=4 16997 B16R2.25778 Nc1cccc(c1SCc2cscn2)F 62a_100000690935_100000205941 [0,2,0,0,0,0|2,0,0]=4 16998 B16R2.25778 Nc1cccc(c1SCc2cscn2)O 62a_100000205941_100012183704 [0,2,0,0,0,0|2,0,0]=4 16999 B16R2.25778 Nc1cccc(c1SCc2cscn2)O 62a_100012183704_100000205941 [0,2,0,0,0,0|2,0,0]=4 17000 B16R2.25778 Nc1ccnc(c1OCc2c[nH]cn2)Cl 34a_100009844647_100000707719 [0,2,0,0,0,0|2,0,0]=4 17001 B16R2.25778 Nc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100010208016 [0,2,0,0,0,0|2,0,0]=4 17002 B16R2.25778 Nc1ccnc(c1SCc2c[nH]cn2)Cl 62a_100010208016_100000707719 [0,2,0,0,0,0|2,0,0]=4 17003 B16R2.25778 Nc1ccnc(c1SCc2c[nH]cn2)F 62a_100000707719_100010381272 [0,2,0,0,0,0|2,0,0]=4 17004 B16R2.25778 Nc1ccnc(c1SCc2c[nH]cn2)F 62a_100010381272_100000707719 [0,2,0,0,0,0|2,0,0]=4 17005 B16R2.25778 Nc1nccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100010199028 [0,2,0,0,0,0|2,0,0]=4 17006 B16R2.25778 Nc1nccc(c1SCc2c[nH]cn2)Cl 62a_100010199028_100000707719 [0,2,0,0,0,0|2,0,0]=4 17007 B16R2.25778 Oc1cccc(c1NCc2c[nH]cn2)Br 34a_100011934926_100000707719 [0,2,0,0,0,0|0,0,0]=2 17008 B16R2.25778 Oc1cccc(c1NCc2c[nH]cn2)Cl 34a_100012022510_100000707719 [0,2,0,0,0,0|0,0,0]=2 17009 B16R2.25778 Oc1cccc(c1NCc2c[nH]cn2)F 34a_100020591140_100000707719 [0,2,0,0,0,0|0,0,0]=2 17010 B16R2.25778 Oc1cccc(c1NCc2ccon2)Br 34a_100011934926_100000234950 [0,2,0,0,0,0|2,0,0]=4 17011 B16R2.25778 Oc1cccc(c1NCc2ccon2)Cl 34a_100012022510_100000234950 [0,2,0,0,0,0|2,0,0]=4 17012 B16R2.25778 Oc1cccc(c1NCc2ccon2)F 34a_100020591140_100000234950 [0,2,0,0,0,0|2,0,0]=4 17013 B16R2.25778 Oc1cccc(c1NCc2ccsc2)Br 34a_100011934926_100011261437 [0,2,0,0,0,0|2,0,0]=4 17014 B16R2.25778 Oc1cccc(c1NCc2ccsc2)Cl 34a_100012022510_100011261437 [0,2,0,0,0,0|2,0,0]=4 17015 B16R2.25778 Oc1cccc(c1NCc2ccsc2)F 34a_100020591140_100011261437 [0,2,0,0,0,0|2,0,0]=4 17016 B16R2.25778 Oc1cccc(c1NCc2cncs2)Br 34a_100011934926_100015185245 [0,2,0,0,0,0|1,0,1]=4 17017 B16R2.25778 Oc1cccc(c1NCc2cncs2)Cl 34a_100012022510_100015185245 [0,2,0,0,0,0|1,0,1]=4 17018 B16R2.25778 Oc1cccc(c1NCc2cncs2)F 34a_100020591140_100015185245 [0,2,0,0,0,0|1,0,1]=4 17019 B16R2.25778 Oc1cccc(c1NCc2cscn2)Br 34a_100011934926_100000205941 [0,2,0,0,0,0|1,0,0]=3 17020 B16R2.25778 Oc1cccc(c1NCc2cscn2)Cl 34a_100012022510_100000205941 [0,2,0,0,0,0|1,0,0]=3 17021 B16R2.25778 Oc1cccc(c1NCc2cscn2)F 34a_100020591140_100000205941 [0,2,0,0,0,0|1,0,0]=3 17022 B16R2.25778 Oc1cccc(c1NCc2ncc[nH]2)Br 34a_100011934926_100016991755 [0,2,0,0,0,0|2,0,0]=4 17023 B16R2.25778 Oc1cccc(c1NCc2ncc[nH]2)Cl 34a_100012022510_100016991755 [0,2,0,0,0,0|2,0,0]=4 17024 B16R2.25778 Oc1cccc(c1NCc2ncc[nH]2)F 34a_100020591140_100016991755 [0,2,0,0,0,0|2,0,0]=4 17025 B16R2.25778 Oc1cccc(c1NCc2ncco2)Br 34a_100011934926_103436540062 [0,2,0,0,0,0|2,0,0]=4 17026 B16R2.25778 Oc1cccc(c1NCc2ncco2)Cl 34a_100012022510_103436540062 [0,2,0,0,0,0|2,0,0]=4 17027 B16R2.25778 Oc1cccc(c1NCc2ncco2)F 34a_100020591140_103436540062 [0,2,0,0,0,0|2,0,0]=4 17028 B16R2.25778 Oc1cccc(c1NCc2nccs2)Br 34a_100011934926_100015184050 [0,2,0,0,0,0|2,0,0]=4 17029 B16R2.25778 Oc1cccc(c1NCc2nccs2)Cl 34a_100012022510_100015184050 [0,2,0,0,0,0|2,0,0]=4 17030 B16R2.25778 Oc1cccc(c1NCc2nccs2)F 34a_100020591140_100015184050 [0,2,0,0,0,0|2,0,0]=4 17031 B16R2.25778 Oc1cccc(c1NCc2ncon2)Br 34a_100011934926_100000233494 [0,2,0,0,0,0|2,0,0]=4 17032 B16R2.25778 Oc1cccc(c1NCc2ncon2)Cl 34a_100012022510_100000233494 [0,2,0,0,0,0|2,0,0]=4 17033 B16R2.25778 Oc1cccc(c1NCc2ncon2)F 34a_100020591140_100000233494 [0,2,0,0,0,0|2,0,0]=4 17034 B16R2.25778 Oc1cccc(c1NCn2cncn2)Br 34a_100011934926_200020645497 [0,2,0,0,0,0|1,0,1]=4 17035 B16R2.25778 Oc1cccc(c1NCn2cncn2)Cl 34a_100012022510_200020645497 [0,2,0,0,0,0|1,0,1]=4 17036 B16R2.25778 Oc1cccc(c1NCn2cncn2)F 34a_100020591140_200020645497 [0,2,0,0,0,0|1,0,1]=4 17037 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)Br 62a_100000707719_100010187912 [0,2,0,0,0,0|1,0,0]=3 17038 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)Br 62a_100010187912_100000707719 [0,2,0,0,0,0|1,0,0]=3 17039 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)Cl 62a_100000707719_100000050174 [0,2,0,0,0,0|1,0,0]=3 17040 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)F 62a_100000707719_100009820682 [0,2,0,0,0,0|1,0,0]=3 17041 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)F 62a_100009820682_100000707719 [0,2,0,0,0,0|1,0,0]=3 17042 B16R2.25778 Oc1cccc(c1SCc2c[nH]cn2)O 62a_100000707719_100010205330 [0,2,0,0,0,0|1,0,0]=3 17043 B16R2.25778 Oc1cccc(c1SCc2cscn2)Br 62a_100000205941_100010187912 [0,2,0,0,0,0|2,0,0]=4 17044 B16R2.25778 Oc1cccc(c1SCc2cscn2)Br 62a_100010187912_100000205941 [0,2,0,0,0,0|2,0,0]=4 17045 B16R2.25778 Oc1cccc(c1SCc2cscn2)Cl 62a_100000205941_100000050174 [0,2,0,0,0,0|2,0,0]=4 17046 B16R2.25778 Oc1cccc(c1SCc2cscn2)F 62a_100000205941_100009820682 [0,2,0,0,0,0|2,0,0]=4 17047 B16R2.25778 Oc1cccc(c1SCc2cscn2)F 62a_100009820682_100000205941 [0,2,0,0,0,0|2,0,0]=4 17048 B16R2.25778 Oc1cccc(c1SCc2cscn2)O 62a_100000205941_100010205330 [0,2,0,0,0,0|2,0,0]=4 17049 B16R2.25778 Oc1ccnc(c1SCc2c[nH]cn2)O 62a_100000707719_200009817435 [0,2,0,0,0,0|2,0,0]=4 17050 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Br 2230a_100000219648_100000707719 [0,2,0,0,0,0|0,0,0]=2 17051 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Br 269982a_100000219648_100000707719 [0,2,0,0,0,0|0,0,0]=2 17052 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Br 34a_100000219648_100000707719 [0,2,0,0,0,0|0,0,0]=2 17053 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Cl 2230a_100000220044_100000707719 [0,2,0,0,0,0|0,0,0]=2 17054 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Cl 269982a_100000220044_100000707719 [0,2,0,0,0,0|0,0,0]=2 17055 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)Cl 34a_100000220044_100000707719 [0,2,0,0,0,0|0,0,0]=2 17056 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)F 2230a_100020633736_100000707719 [0,2,0,0,0,0|0,0,0]=2 17057 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)F 269982a_100020633736_100000707719 [0,2,0,0,0,0|0,0,0]=2 17058 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)F 34a_100020633736_100000707719 [0,2,0,0,0,0|0,0,0]=2 17059 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)I 2230a_100000221217_100000707719 [0,2,0,0,0,0|0,0,0]=2 17060 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)I 269982a_100000221217_100000707719 [0,2,0,0,0,0|0,0,0]=2 17061 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)I 34a_100000221217_100000707719 [0,2,0,0,0,0|0,0,0]=2 17062 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)O 2230a_100000756613_100000707719 [0,2,0,0,0,0|0,0,0]=2 17063 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)O 269982a_100000756613_100000707719 [0,2,0,0,0,0|0,0,0]=2 17064 B16R2.243 CN(Cc1c[nH]cn1)c2cccc(c2)O 34a_100000756613_100000707719 [0,2,0,0,0,0|0,0,0]=2 17065 B16R2.243 CN(Cc1ccco1)c2cccc(c2)Cl 2230a_100011231625_200000210301 [0,2,0,0,0,0|2,0,0]=4 17066 B16R2.243 CN(Cc1ccco1)c2cccc(c2)Cl 269982a_100011231625_200000210301 [0,2,0,0,0,0|2,0,0]=4 17067 B16R2.243 CN(Cc1ccco1)c2cccc(c2)Cl 34a_100011231625_200000210301 [0,2,0,0,0,0|2,0,0]=4 17068 B16R2.243 CN(Cc1ccco1)c2cccc(c2)F 2230a_100011231644_200000210301 [0,2,0,0,0,0|2,0,0]=4 17069 B16R2.243 CN(Cc1ccco1)c2cccc(c2)F 269982a_100011231644_200000210301 [0,2,0,0,0,0|2,0,0]=4 17070 B16R2.243 CN(Cc1ccco1)c2cccc(c2)F 34a_100011231644_200000210301 [0,2,0,0,0,0|2,0,0]=4 17071 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Br 2230a_100000219648_100000234950 [0,2,0,0,0,0|2,0,0]=4 17072 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Br 269982a_100000219648_100000234950 [0,2,0,0,0,0|2,0,0]=4 17073 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Br 34a_100000219648_100000234950 [0,2,0,0,0,0|2,0,0]=4 17074 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Cl 2230a_100000220044_100000234950 [0,2,0,0,0,0|2,0,0]=4 17075 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Cl 269982a_100000220044_100000234950 [0,2,0,0,0,0|2,0,0]=4 17076 B16R2.243 CN(Cc1ccon1)c2cccc(c2)Cl 34a_100000220044_100000234950 [0,2,0,0,0,0|2,0,0]=4 17077 B16R2.243 CN(Cc1ccon1)c2cccc(c2)F 2230a_100020633736_100000234950 [0,2,0,0,0,0|2,0,0]=4 17078 B16R2.243 CN(Cc1ccon1)c2cccc(c2)F 269982a_100020633736_100000234950 [0,2,0,0,0,0|2,0,0]=4 17079 B16R2.243 CN(Cc1ccon1)c2cccc(c2)F 34a_100020633736_100000234950 [0,2,0,0,0,0|2,0,0]=4 17080 B16R2.243 CN(Cc1ccon1)c2cccc(c2)I 2230a_100000221217_100000234950 [0,2,0,0,0,0|2,0,0]=4 17081 B16R2.243 CN(Cc1ccon1)c2cccc(c2)I 269982a_100000221217_100000234950 [0,2,0,0,0,0|2,0,0]=4 17082 B16R2.243 CN(Cc1ccon1)c2cccc(c2)I 34a_100000221217_100000234950 [0,2,0,0,0,0|2,0,0]=4 17083 B16R2.243 CN(Cc1ccon1)c2cccc(c2)O 2230a_100000756613_100000234950 [0,2,0,0,0,0|2,0,0]=4 17084 B16R2.243 CN(Cc1ccon1)c2cccc(c2)O 269982a_100000756613_100000234950 [0,2,0,0,0,0|2,0,0]=4 17085 B16R2.243 CN(Cc1ccon1)c2cccc(c2)O 34a_100000756613_100000234950 [0,2,0,0,0,0|2,0,0]=4 17086 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Br 2230a_100000219648_100011261437 [0,2,0,0,0,0|2,0,0]=4 17087 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Br 269982a_100000219648_100011233845 [0,2,0,0,0,0|2,0,0]=4 17088 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Br 34a_100000219648_100011261437 [0,2,0,0,0,0|2,0,0]=4 17089 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Cl 2230a_100000220044_100011261437 [0,2,0,0,0,0|2,0,0]=4 17090 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Cl 269982a_100000220044_100011233845 [0,2,0,0,0,0|2,0,0]=4 17091 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)Cl 34a_100000220044_100011261437 [0,2,0,0,0,0|2,0,0]=4 17092 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)F 2230a_100020633736_100011261437 [0,2,0,0,0,0|2,0,0]=4 17093 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)F 269982a_100020633736_100011233845 [0,2,0,0,0,0|2,0,0]=4 17094 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)F 34a_100020633736_100011261437 [0,2,0,0,0,0|2,0,0]=4 17095 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)I 2230a_100000221217_100011261437 [0,2,0,0,0,0|2,0,0]=4 17096 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)I 269982a_100000221217_100011233845 [0,2,0,0,0,0|2,0,0]=4 17097 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)I 34a_100000221217_100011261437 [0,2,0,0,0,0|2,0,0]=4 17098 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)O 2230a_100000756613_100011261437 [0,2,0,0,0,0|2,0,0]=4 17099 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)O 269982a_100000756613_100011233845 [0,2,0,0,0,0|2,0,0]=4 17100 B16R2.243 CN(Cc1ccsc1)c2cccc(c2)O 34a_100000756613_100011261437 [0,2,0,0,0,0|2,0,0]=4 17101 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Br 2230a_100000219648_100015185245 [0,2,0,0,0,0|1,0,1]=4 17102 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Br 269982a_100000219648_100015185245 [0,2,0,0,0,0|1,0,1]=4 17103 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Br 34a_100000219648_100015185245 [0,2,0,0,0,0|1,0,1]=4 17104 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Cl 2230a_100000220044_100015185245 [0,2,0,0,0,0|1,0,1]=4 17105 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Cl 269982a_100000220044_100015185245 [0,2,0,0,0,0|1,0,1]=4 17106 B16R2.243 CN(Cc1cncs1)c2cccc(c2)Cl 34a_100000220044_100015185245 [0,2,0,0,0,0|1,0,1]=4 17107 B16R2.243 CN(Cc1cncs1)c2cccc(c2)F 2230a_100020633736_100015185245 [0,2,0,0,0,0|1,0,1]=4 17108 B16R2.243 CN(Cc1cncs1)c2cccc(c2)F 269982a_100020633736_100015185245 [0,2,0,0,0,0|1,0,1]=4 17109 B16R2.243 CN(Cc1cncs1)c2cccc(c2)F 34a_100020633736_100015185245 [0,2,0,0,0,0|1,0,1]=4 17110 B16R2.243 CN(Cc1cncs1)c2cccc(c2)I 2230a_100000221217_100015185245 [0,2,0,0,0,0|1,0,1]=4 17111 B16R2.243 CN(Cc1cncs1)c2cccc(c2)I 269982a_100000221217_100015185245 [0,2,0,0,0,0|1,0,1]=4 17112 B16R2.243 CN(Cc1cncs1)c2cccc(c2)I 34a_100000221217_100015185245 [0,2,0,0,0,0|1,0,1]=4 17113 B16R2.243 CN(Cc1cncs1)c2cccc(c2)O 2230a_100000756613_100015185245 [0,2,0,0,0,0|1,0,1]=4 17114 B16R2.243 CN(Cc1cncs1)c2cccc(c2)O 269982a_100000756613_100015185245 [0,2,0,0,0,0|1,0,1]=4 17115 B16R2.243 CN(Cc1cncs1)c2cccc(c2)O 34a_100000756613_100015185245 [0,2,0,0,0,0|1,0,1]=4 17116 B16R2.243 CN(Cc1cscn1)c2cc(ccn2)F 27a_100000225794_100000764206 [0,2,0,0,0,0|2,0,0]=4 17117 B16R2.243 CN(Cc1cscn1)c2cc[nH]c(=O)c2 27a_100000225794_100000061649 [0,2,0,0,0,0|2,0,0]=4 17118 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Br 2230a_100000219648_100000205941 [0,2,0,0,0,0|1,0,0]=3 17119 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Br 269982a_100000219648_100000205941 [0,2,0,0,0,0|1,0,0]=3 17120 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Br 34a_100000219648_100000205941 [0,2,0,0,0,0|1,0,0]=3 17121 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Cl 2230a_100000220044_100000205941 [0,2,0,0,0,0|1,0,0]=3 17122 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Cl 269982a_100000220044_100000205941 [0,2,0,0,0,0|1,0,0]=3 17123 B16R2.243 CN(Cc1cscn1)c2cccc(c2)Cl 34a_100000220044_100000205941 [0,2,0,0,0,0|1,0,0]=3 17124 B16R2.243 CN(Cc1cscn1)c2cccc(c2)F 2230a_100020633736_100000205941 [0,2,0,0,0,0|1,0,0]=3 17125 B16R2.243 CN(Cc1cscn1)c2cccc(c2)F 269982a_100020633736_100000205941 [0,2,0,0,0,0|1,0,0]=3 17126 B16R2.243 CN(Cc1cscn1)c2cccc(c2)F 34a_100020633736_100000205941 [0,2,0,0,0,0|1,0,0]=3 17127 B16R2.243 CN(Cc1cscn1)c2cccc(c2)I 2230a_100000221217_100000205941 [0,2,0,0,0,0|1,0,0]=3 17128 B16R2.243 CN(Cc1cscn1)c2cccc(c2)I 269982a_100000221217_100000205941 [0,2,0,0,0,0|1,0,0]=3 17129 B16R2.243 CN(Cc1cscn1)c2cccc(c2)I 34a_100000221217_100000205941 [0,2,0,0,0,0|1,0,0]=3 17130 B16R2.243 CN(Cc1cscn1)c2cccc(c2)O 2230a_100000756613_100000205941 [0,2,0,0,0,0|1,0,0]=3 17131 B16R2.243 CN(Cc1cscn1)c2cccc(c2)O 269982a_100000756613_100000205941 [0,2,0,0,0,0|1,0,0]=3 17132 B16R2.243 CN(Cc1cscn1)c2cccc(c2)O 34a_100000756613_100000205941 [0,2,0,0,0,0|1,0,0]=3 17133 B16R2.243 CN(Cc1cscn1)c2cccc(n2)F 27a_100000225794_100009815982 [0,2,0,0,0,0|2,0,0]=4 17134 B16R2.243 CN(Cc1cscn1)c2ccnc(c2)F 27a_100000225794_100009816116 [0,2,0,0,0,0|2,0,0]=4 17135 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Br 2230a_100000219648_100016991755 [0,2,0,0,0,0|2,0,0]=4 17136 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Br 269982a_100000219648_100016991755 [0,2,0,0,0,0|2,0,0]=4 17137 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Br 34a_100000219648_100016991755 [0,2,0,0,0,0|2,0,0]=4 17138 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Cl 2230a_100000220044_100016991755 [0,2,0,0,0,0|2,0,0]=4 17139 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Cl 269982a_100000220044_100016991755 [0,2,0,0,0,0|2,0,0]=4 17140 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)Cl 34a_100000220044_100016991755 [0,2,0,0,0,0|2,0,0]=4 17141 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)F 2230a_100020633736_100016991755 [0,2,0,0,0,0|2,0,0]=4 17142 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)F 269982a_100020633736_100016991755 [0,2,0,0,0,0|2,0,0]=4 17143 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)F 34a_100020633736_100016991755 [0,2,0,0,0,0|2,0,0]=4 17144 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)I 2230a_100000221217_100016991755 [0,2,0,0,0,0|2,0,0]=4 17145 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)I 269982a_100000221217_100016991755 [0,2,0,0,0,0|2,0,0]=4 17146 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)I 34a_100000221217_100016991755 [0,2,0,0,0,0|2,0,0]=4 17147 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)O 2230a_100000756613_100016991755 [0,2,0,0,0,0|2,0,0]=4 17148 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)O 269982a_100000756613_100016991755 [0,2,0,0,0,0|2,0,0]=4 17149 B16R2.243 CN(Cc1ncc[nH]1)c2cccc(c2)O 34a_100000756613_100016991755 [0,2,0,0,0,0|2,0,0]=4 17150 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Br 2230a_100000219648_103436540062 [0,2,0,0,0,0|2,0,0]=4 17151 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Br 269982a_100000219648_103436540062 [0,2,0,0,0,0|2,0,0]=4 17152 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Br 34a_100000219648_103436540062 [0,2,0,0,0,0|2,0,0]=4 17153 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Cl 2230a_100000220044_103436540062 [0,2,0,0,0,0|2,0,0]=4 17154 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Cl 269982a_100000220044_103436540062 [0,2,0,0,0,0|2,0,0]=4 17155 B16R2.243 CN(Cc1ncco1)c2cccc(c2)Cl 34a_100000220044_103436540062 [0,2,0,0,0,0|2,0,0]=4 17156 B16R2.243 CN(Cc1ncco1)c2cccc(c2)F 2230a_100020633736_103436540062 [0,2,0,0,0,0|2,0,0]=4 17157 B16R2.243 CN(Cc1ncco1)c2cccc(c2)F 269982a_100020633736_103436540062 [0,2,0,0,0,0|2,0,0]=4 17158 B16R2.243 CN(Cc1ncco1)c2cccc(c2)F 34a_100020633736_103436540062 [0,2,0,0,0,0|2,0,0]=4 17159 B16R2.243 CN(Cc1ncco1)c2cccc(c2)I 2230a_100000221217_103436540062 [0,2,0,0,0,0|2,0,0]=4 17160 B16R2.243 CN(Cc1ncco1)c2cccc(c2)I 269982a_100000221217_103436540062 [0,2,0,0,0,0|2,0,0]=4 17161 B16R2.243 CN(Cc1ncco1)c2cccc(c2)I 34a_100000221217_103436540062 [0,2,0,0,0,0|2,0,0]=4 17162 B16R2.243 CN(Cc1ncco1)c2cccc(c2)O 2230a_100000756613_103436540062 [0,2,0,0,0,0|2,0,0]=4 17163 B16R2.243 CN(Cc1ncco1)c2cccc(c2)O 269982a_100000756613_103436540062 [0,2,0,0,0,0|2,0,0]=4 17164 B16R2.243 CN(Cc1ncco1)c2cccc(c2)O 34a_100000756613_103436540062 [0,2,0,0,0,0|2,0,0]=4 17165 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Br 2230a_100000219648_100015184050 [0,2,0,0,0,0|2,0,0]=4 17166 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Br 269982a_100000219648_100015184050 [0,2,0,0,0,0|2,0,0]=4 17167 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Br 34a_100000219648_100015184050 [0,2,0,0,0,0|2,0,0]=4 17168 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Cl 2230a_100000220044_100015184050 [0,2,0,0,0,0|2,0,0]=4 17169 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Cl 269982a_100000220044_100015184050 [0,2,0,0,0,0|2,0,0]=4 17170 B16R2.243 CN(Cc1nccs1)c2cccc(c2)Cl 34a_100000220044_100015184050 [0,2,0,0,0,0|2,0,0]=4 17171 B16R2.243 CN(Cc1nccs1)c2cccc(c2)F 2230a_100020633736_100015184050 [0,2,0,0,0,0|2,0,0]=4 17172 B16R2.243 CN(Cc1nccs1)c2cccc(c2)F 269982a_100020633736_100015184050 [0,2,0,0,0,0|2,0,0]=4 17173 B16R2.243 CN(Cc1nccs1)c2cccc(c2)F 34a_100020633736_100015184050 [0,2,0,0,0,0|2,0,0]=4 17174 B16R2.243 CN(Cc1nccs1)c2cccc(c2)I 2230a_100000221217_100015184050 [0,2,0,0,0,0|2,0,0]=4 17175 B16R2.243 CN(Cc1nccs1)c2cccc(c2)I 269982a_100000221217_100015184050 [0,2,0,0,0,0|2,0,0]=4 17176 B16R2.243 CN(Cc1nccs1)c2cccc(c2)I 34a_100000221217_100015184050 [0,2,0,0,0,0|2,0,0]=4 17177 B16R2.243 CN(Cc1nccs1)c2cccc(c2)O 2230a_100000756613_100015184050 [0,2,0,0,0,0|2,0,0]=4 17178 B16R2.243 CN(Cc1nccs1)c2cccc(c2)O 269982a_100000756613_100015184050 [0,2,0,0,0,0|2,0,0]=4 17179 B16R2.243 CN(Cc1nccs1)c2cccc(c2)O 34a_100000756613_100015184050 [0,2,0,0,0,0|2,0,0]=4 17180 B16R2.243 CN(Cc1ncon1)c2cccc(c2)Br 269982a_100000219648_100000233494 [0,2,0,0,0,0|2,0,0]=4 17181 B16R2.243 CN(Cc1ncon1)c2cccc(c2)Br 34a_100000219648_100000233494 [0,2,0,0,0,0|2,0,0]=4 17182 B16R2.243 CN(Cc1ncon1)c2cccc(c2)Cl 269982a_100000220044_100000233494 [0,2,0,0,0,0|2,0,0]=4 17183 B16R2.243 CN(Cc1ncon1)c2cccc(c2)Cl 34a_100000220044_100000233494 [0,2,0,0,0,0|2,0,0]=4 17184 B16R2.243 CN(Cc1ncon1)c2cccc(c2)F 269982a_100020633736_100000233494 [0,2,0,0,0,0|2,0,0]=4 17185 B16R2.243 CN(Cc1ncon1)c2cccc(c2)F 34a_100020633736_100000233494 [0,2,0,0,0,0|2,0,0]=4 17186 B16R2.243 CN(Cc1ncon1)c2cccc(c2)I 269982a_100000221217_100000233494 [0,2,0,0,0,0|2,0,0]=4 17187 B16R2.243 CN(Cc1ncon1)c2cccc(c2)I 34a_100000221217_100000233494 [0,2,0,0,0,0|2,0,0]=4 17188 B16R2.243 CN(Cc1ncon1)c2cccc(c2)O 269982a_100000756613_100000233494 [0,2,0,0,0,0|2,0,0]=4 17189 B16R2.243 CN(Cc1ncon1)c2cccc(c2)O 34a_100000756613_100000233494 [0,2,0,0,0,0|2,0,0]=4 17190 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Br 2230a_100000219648_200020645497 [0,2,0,0,0,0|1,0,1]=4 17191 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Br 269982a_100000219648_200020645497 [0,2,0,0,0,0|1,0,1]=4 17192 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Br 34a_100000219648_200020645497 [0,2,0,0,0,0|1,0,1]=4 17193 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Cl 2230a_100000220044_200020645497 [0,2,0,0,0,0|1,0,1]=4 17194 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Cl 269982a_100000220044_200020645497 [0,2,0,0,0,0|1,0,1]=4 17195 B16R2.243 CN(Cn1cncn1)c2cccc(c2)Cl 34a_100000220044_200020645497 [0,2,0,0,0,0|1,0,1]=4 17196 B16R2.243 CN(Cn1cncn1)c2cccc(c2)F 2230a_100020633736_200020645497 [0,2,0,0,0,0|1,0,1]=4 17197 B16R2.243 CN(Cn1cncn1)c2cccc(c2)F 269982a_100020633736_200020645497 [0,2,0,0,0,0|1,0,1]=4 17198 B16R2.243 CN(Cn1cncn1)c2cccc(c2)F 34a_100020633736_200020645497 [0,2,0,0,0,0|1,0,1]=4 17199 B16R2.243 CN(Cn1cncn1)c2cccc(c2)I 2230a_100000221217_200020645497 [0,2,0,0,0,0|1,0,1]=4 17200 B16R2.243 CN(Cn1cncn1)c2cccc(c2)I 269982a_100000221217_200020645497 [0,2,0,0,0,0|1,0,1]=4 17201 B16R2.243 CN(Cn1cncn1)c2cccc(c2)I 34a_100000221217_200020645497 [0,2,0,0,0,0|1,0,1]=4 17202 B16R2.243 CN(Cn1cncn1)c2cccc(c2)O 2230a_100000756613_200020645497 [0,2,0,0,0,0|1,0,1]=4 17203 B16R2.243 CN(Cn1cncn1)c2cccc(c2)O 269982a_100000756613_200020645497 [0,2,0,0,0,0|1,0,1]=4 17204 B16R2.243 CN(Cn1cncn1)c2cccc(c2)O 34a_100000756613_200020645497 [0,2,0,0,0,0|1,0,1]=4 17205 B16R2.243 Cc1cc(ccn1)N(C)Cc2cscn2 27a_100000225794_100000758586 [0,2,0,0,0,0|2,0,0]=4 17206 B16R2.243 Cc1cccc(c1)C(=O)Cc2c[nH]cn2 1458a_100000189346_100000707719 [0,2,0,0,0,0|1,0,0]=3 17207 B16R2.243 Cc1cccc(c1)C(=O)Cc2cscn2 1458a_100000189346_100000205941 [0,2,0,0,0,0|2,0,0]=4 17208 B16R2.243 Cc1cccc(c1)N(C)Cc2c[nH]cn2 2230a_100000219674_100000707719 [0,2,0,0,0,0|0,0,0]=2 17209 B16R2.243 Cc1cccc(c1)N(C)Cc2c[nH]cn2 269982a_100000219674_100000707719 [0,2,0,0,0,0|0,0,0]=2 17210 B16R2.243 Cc1cccc(c1)N(C)Cc2c[nH]cn2 34a_100000219674_100000707719 [0,2,0,0,0,0|0,0,0]=2 17211 B16R2.243 Cc1cccc(c1)N(C)Cc2ccon2 2230a_100000219674_100000234950 [0,2,0,0,0,0|2,0,0]=4 17212 B16R2.243 Cc1cccc(c1)N(C)Cc2ccon2 269982a_100000219674_100000234950 [0,2,0,0,0,0|2,0,0]=4 17213 B16R2.243 Cc1cccc(c1)N(C)Cc2ccon2 34a_100000219674_100000234950 [0,2,0,0,0,0|2,0,0]=4 17214 B16R2.243 Cc1cccc(c1)N(C)Cc2ccsc2 2230a_100000219674_100011261437 [0,2,0,0,0,0|2,0,0]=4 17215 B16R2.243 Cc1cccc(c1)N(C)Cc2ccsc2 269982a_100000219674_100011233845 [0,2,0,0,0,0|2,0,0]=4 17216 B16R2.243 Cc1cccc(c1)N(C)Cc2ccsc2 34a_100000219674_100011261437 [0,2,0,0,0,0|2,0,0]=4 17217 B16R2.243 Cc1cccc(c1)N(C)Cc2cncs2 2230a_100000219674_100015185245 [0,2,0,0,0,0|1,0,1]=4 17218 B16R2.243 Cc1cccc(c1)N(C)Cc2cncs2 269982a_100000219674_100015185245 [0,2,0,0,0,0|1,0,1]=4 17219 B16R2.243 Cc1cccc(c1)N(C)Cc2cncs2 34a_100000219674_100015185245 [0,2,0,0,0,0|1,0,1]=4 17220 B16R2.243 Cc1cccc(c1)N(C)Cc2cscn2 2230a_100000219674_100000205941 [0,2,0,0,0,0|1,0,0]=3 17221 B16R2.243 Cc1cccc(c1)N(C)Cc2cscn2 269982a_100000219674_100000205941 [0,2,0,0,0,0|1,0,0]=3 17222 B16R2.243 Cc1cccc(c1)N(C)Cc2cscn2 34a_100000219674_100000205941 [0,2,0,0,0,0|1,0,0]=3 17223 B16R2.243 Cc1cccc(c1)N(C)Cc2ncc[nH]2 2230a_100000219674_100016991755 [0,2,0,0,0,0|2,0,0]=4 17224 B16R2.243 Cc1cccc(c1)N(C)Cc2ncc[nH]2 269982a_100000219674_100016991755 [0,2,0,0,0,0|2,0,0]=4 17225 B16R2.243 Cc1cccc(c1)N(C)Cc2ncc[nH]2 34a_100000219674_100016991755 [0,2,0,0,0,0|2,0,0]=4 17226 B16R2.243 Cc1cccc(c1)N(C)Cc2ncco2 2230a_100000219674_103436540062 [0,2,0,0,0,0|2,0,0]=4 17227 B16R2.243 Cc1cccc(c1)N(C)Cc2ncco2 269982a_100000219674_103436540062 [0,2,0,0,0,0|2,0,0]=4 17228 B16R2.243 Cc1cccc(c1)N(C)Cc2ncco2 34a_100000219674_103436540062 [0,2,0,0,0,0|2,0,0]=4 17229 B16R2.243 Cc1cccc(c1)N(C)Cc2nccs2 2230a_100000219674_100015184050 [0,2,0,0,0,0|2,0,0]=4 17230 B16R2.243 Cc1cccc(c1)N(C)Cc2nccs2 269982a_100000219674_100015184050 [0,2,0,0,0,0|2,0,0]=4 17231 B16R2.243 Cc1cccc(c1)N(C)Cc2nccs2 34a_100000219674_100015184050 [0,2,0,0,0,0|2,0,0]=4 17232 B16R2.243 Cc1cccc(c1)N(C)Cc2ncon2 269982a_100000219674_100000233494 [0,2,0,0,0,0|2,0,0]=4 17233 B16R2.243 Cc1cccc(c1)N(C)Cc2ncon2 34a_100000219674_100000233494 [0,2,0,0,0,0|2,0,0]=4 17234 B16R2.243 Cc1cccc(c1)N(C)Cn2cncn2 2230a_100000219674_200020645497 [0,2,0,0,0,0|1,0,1]=4 17235 B16R2.243 Cc1cccc(c1)N(C)Cn2cncn2 269982a_100000219674_200020645497 [0,2,0,0,0,0|1,0,1]=4 17236 B16R2.243 Cc1cccc(c1)N(C)Cn2cncn2 34a_100000219674_200020645497 [0,2,0,0,0,0|1,0,1]=4 17237 B16R2.243 O=C(Cc1c[nH]cn1)c2cccc(c2)Br 1458a_100000210664_100000707719 [0,2,0,0,0,0|1,0,0]=3 17238 B16R2.243 O=C(Cc1c[nH]cn1)c2cccc(c2)Cl 1458a_100000210390_100000707719 [0,2,0,0,0,0|1,0,0]=3 17239 B16R2.243 O=C(Cc1c[nH]cn1)c2cccc(c2)F 1458a_100000210950_100000707719 [0,2,0,0,0,0|1,0,0]=3 17240 B16R2.243 O=C(Cc1c[nH]cn1)c2cccc(c2)I 1458a_100000184098_100000707719 [0,2,0,0,0,0|1,0,0]=3 17241 B16R2.243 O=C(Cc1c[nH]cn1)c2cccc(c2)O 1458a_100000183914_100000707719 [0,2,0,0,0,0|1,0,0]=3 17242 B16R2.243 O=C(Cc1cscn1)c2cccc(c2)Br 1458a_100000210664_100000205941 [0,2,0,0,0,0|2,0,0]=4 17243 B16R2.243 O=C(Cc1cscn1)c2cccc(c2)Cl 1458a_100000210390_100000205941 [0,2,0,0,0,0|2,0,0]=4 17244 B16R2.243 O=C(Cc1cscn1)c2cccc(c2)F 1458a_100000210950_100000205941 [0,2,0,0,0,0|2,0,0]=4 17245 B16R2.243 O=C(Cc1cscn1)c2cccc(c2)I 1458a_100000184098_100000205941 [0,2,0,0,0,0|2,0,0]=4 17246 B16R2.243 O=C(Cc1cscn1)c2cccc(c2)O 1458a_100000183914_100000205941 [0,2,0,0,0,0|2,0,0]=4 17247 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)Cl 2230a_100011231625_200025704644 [0,2,0,0,0,0|2,0,0]=4 17248 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)Cl 269982a_100011231625_200025704644 [0,2,0,0,0,0|2,0,0]=4 17249 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)Cl 34a_100011231625_200025704644 [0,2,0,0,0,0|2,0,0]=4 17250 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)F 2230a_100011231644_200025704644 [0,2,0,0,0,0|2,0,0]=4 17251 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)F 269982a_100011231644_200025704644 [0,2,0,0,0,0|2,0,0]=4 17252 B16R2.243 [13CH3]N(Cc1ccco1)c2cccc(c2)F 34a_100011231644_200025704644 [0,2,0,0,0,0|2,0,0]=4 17253 B16R2.1973 BrCc1cccc(c1)OCc2c[nH]cn2 34a_100011660834_100000707719 [0,2,0,0,0,0|1,0,0]=3 17254 B16R2.1973 BrCc1cccc(c1)OCc2cscn2 34a_100011660834_100000205941 [0,2,0,0,0,0|2,0,0]=4 17255 B16R2.1973 BrCc1cccc(c1)OCc2cscn2 7a_100011660834_100000205941 [0,2,0,0,0,0|2,0,0]=4 17256 B16R2.1973 C#Cc1cccc(c1)NCc2c[nH]cn2 2230a_100000735509_100000707719 [0,2,0,0,0,0|0,0,0]=2 17257 B16R2.1973 C#Cc1cccc(c1)NCc2c[nH]cn2 34a_100000735509_100000707719 [0,2,0,0,0,0|0,0,0]=2 17258 B16R2.1973 C#Cc1cccc(c1)NCc2cc[nH]n2 207a_100000735509_100000738523 [0,2,0,0,0,0|2,0,0]=4 17259 B16R2.1973 C#Cc1cccc(c1)NCc2ccco2 207a_100000735509_100000186105 [0,2,0,0,0,0|2,0,0]=4 17260 B16R2.1973 C#Cc1cccc(c1)NCc2cccs2 207a_100000735509_100000209959 [0,2,0,0,0,0|2,0,0]=4 17261 B16R2.1973 C#Cc1cccc(c1)NCc2ccoc2 207a_100000735509_100011215517 [0,2,0,0,0,0|2,0,0]=4 17262 B16R2.1973 C#Cc1cccc(c1)NCc2ccon2 2230a_100000735509_100000234950 [0,2,0,0,0,0|2,0,0]=4 17263 B16R2.1973 C#Cc1cccc(c1)NCc2ccon2 34a_100000735509_100000234950 [0,2,0,0,0,0|2,0,0]=4 17264 B16R2.1973 C#Cc1cccc(c1)NCc2ccsc2 207a_100000735509_100000188534 [0,2,0,0,0,0|2,0,0]=4 17265 B16R2.1973 C#Cc1cccc(c1)NCc2ccsc2 2230a_100000735509_100011261437 [0,2,0,0,0,0|2,0,0]=4 17266 B16R2.1973 C#Cc1cccc(c1)NCc2ccsc2 34a_100000735509_100011261437 [0,2,0,0,0,0|2,0,0]=4 17267 B16R2.1973 C#Cc1cccc(c1)NCc2cn[nH]c2 207a_100000735509_100016992096 [0,2,0,0,0,0|2,0,0]=4 17268 B16R2.1973 C#Cc1cccc(c1)NCc2cnc[nH]2 207a_100000735509_100000742939 [0,2,0,0,0,0|0,0,2]=4 17269 B16R2.1973 C#Cc1cccc(c1)NCc2cncs2 207a_100000735509_100000749870 [0,2,0,0,0,0|1,0,1]=4 17270 B16R2.1973 C#Cc1cccc(c1)NCc2cncs2 2230a_100000735509_100015185245 [0,2,0,0,0,0|1,0,1]=4 17271 B16R2.1973 C#Cc1cccc(c1)NCc2cncs2 34a_100000735509_100015185245 [0,2,0,0,0,0|1,0,1]=4 17272 B16R2.1973 C#Cc1cccc(c1)NCc2cscn2 207a_100000735509_100000743575 [0,2,0,0,0,0|1,0,0]=3 17273 B16R2.1973 C#Cc1cccc(c1)NCc2cscn2 2230a_100000735509_100000205941 [0,2,0,0,0,0|1,0,0]=3 17274 B16R2.1973 C#Cc1cccc(c1)NCc2cscn2 34a_100000735509_100000205941 [0,2,0,0,0,0|1,0,0]=3 17275 B16R2.1973 C#Cc1cccc(c1)NCc2ncc[nH]2 207a_100000735509_100000743867 [0,2,0,0,0,0|2,0,0]=4 17276 B16R2.1973 C#Cc1cccc(c1)NCc2ncc[nH]2 2230a_100000735509_100016991755 [0,2,0,0,0,0|2,0,0]=4 17277 B16R2.1973 C#Cc1cccc(c1)NCc2ncc[nH]2 34a_100000735509_100016991755 [0,2,0,0,0,0|2,0,0]=4 17278 B16R2.1973 C#Cc1cccc(c1)NCc2ncco2 2230a_100000735509_103436540062 [0,2,0,0,0,0|2,0,0]=4 17279 B16R2.1973 C#Cc1cccc(c1)NCc2ncco2 34a_100000735509_103436540062 [0,2,0,0,0,0|2,0,0]=4 17280 B16R2.1973 C#Cc1cccc(c1)NCc2nccs2 207a_100000735509_100000750902 [0,2,0,0,0,0|2,0,0]=4 17281 B16R2.1973 C#Cc1cccc(c1)NCc2nccs2 2230a_100000735509_100015184050 [0,2,0,0,0,0|2,0,0]=4 17282 B16R2.1973 C#Cc1cccc(c1)NCc2nccs2 34a_100000735509_100015184050 [0,2,0,0,0,0|2,0,0]=4 17283 B16R2.1973 C#Cc1cccc(c1)NCc2ncon2 34a_100000735509_100000233494 [0,2,0,0,0,0|2,0,0]=4 17284 B16R2.1973 C#Cc1cccc(c1)NCn2cncn2 2230a_100000735509_200020645497 [0,2,0,0,0,0|1,0,1]=4 17285 B16R2.1973 C#Cc1cccc(c1)NCn2cncn2 34a_100000735509_200020645497 [0,2,0,0,0,0|1,0,1]=4 17286 B16R2.1973 C#Cc1cccc(c1)OCc2c[nH]cn2 34a_100011216014_100000707719 [0,2,0,0,0,0|1,0,0]=3 17287 B16R2.1973 C#Cc1cccc(c1)OCc2cscn2 34a_100011216014_100000205941 [0,2,0,0,0,0|2,0,0]=4 17288 B16R2.1973 C#Cc1cccc(c1)OCc2cscn2 7a_100011216014_100000205941 [0,2,0,0,0,0|2,0,0]=4 17289 B16R2.1973 C=Cc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100009845566 [0,2,0,0,0,0|2,0,0]=4 17290 B16R2.1973 C=Cc1cc(ccn1)SCc2c[nH]cn2 62a_100009845566_100000707719 [0,2,0,0,0,0|2,0,0]=4 17291 B16R2.1973 C=Cc1cccc(c1)NCc2c[nH]cn2 34a_100011827668_100000707719 [0,2,0,0,0,0|0,0,0]=2 17292 B16R2.1973 C=Cc1cccc(c1)NCc2cc[nH]n2 207a_100011827668_100000738523 [0,2,0,0,0,0|2,0,0]=4 17293 B16R2.1973 C=Cc1cccc(c1)NCc2ccco2 207a_100011827668_100000186105 [0,2,0,0,0,0|2,0,0]=4 17294 B16R2.1973 C=Cc1cccc(c1)NCc2ccco2 270302a_100011827668_100000186105 [0,2,0,0,0,0|2,0,0]=4 17295 B16R2.1973 C=Cc1cccc(c1)NCc2cccs2 207a_100011827668_100000209959 [0,2,0,0,0,0|2,0,0]=4 17296 B16R2.1973 C=Cc1cccc(c1)NCc2cccs2 270302a_100011827668_100000209959 [0,2,0,0,0,0|2,0,0]=4 17297 B16R2.1973 C=Cc1cccc(c1)NCc2ccoc2 207a_100011827668_100011215517 [0,2,0,0,0,0|2,0,0]=4 17298 B16R2.1973 C=Cc1cccc(c1)NCc2ccon2 34a_100011827668_100000234950 [0,2,0,0,0,0|2,0,0]=4 17299 B16R2.1973 C=Cc1cccc(c1)NCc2ccsc2 207a_100011827668_100000188534 [0,2,0,0,0,0|2,0,0]=4 17300 B16R2.1973 C=Cc1cccc(c1)NCc2ccsc2 270302a_100011827668_100000188534 [0,2,0,0,0,0|2,0,0]=4 17301 B16R2.1973 C=Cc1cccc(c1)NCc2ccsc2 34a_100011827668_100011261437 [0,2,0,0,0,0|2,0,0]=4 17302 B16R2.1973 C=Cc1cccc(c1)NCc2cn[nH]c2 207a_100011827668_100016992096 [0,2,0,0,0,0|2,0,0]=4 17303 B16R2.1973 C=Cc1cccc(c1)NCc2cn[nH]c2 270302a_100011827668_100016992096 [0,2,0,0,0,0|2,0,0]=4 17304 B16R2.1973 C=Cc1cccc(c1)NCc2cnc[nH]2 207a_100011827668_100000742939 [0,2,0,0,0,0|0,0,2]=4 17305 B16R2.1973 C=Cc1cccc(c1)NCc2cncs2 207a_100011827668_100000749870 [0,2,0,0,0,0|1,0,1]=4 17306 B16R2.1973 C=Cc1cccc(c1)NCc2cncs2 270302a_100011827668_100000749870 [0,2,0,0,0,0|1,0,1]=4 17307 B16R2.1973 C=Cc1cccc(c1)NCc2cncs2 34a_100011827668_100015185245 [0,2,0,0,0,0|1,0,1]=4 17308 B16R2.1973 C=Cc1cccc(c1)NCc2cscn2 207a_100011827668_100000743575 [0,2,0,0,0,0|1,0,0]=3 17309 B16R2.1973 C=Cc1cccc(c1)NCc2cscn2 270302a_100011827668_100000743575 [0,2,0,0,0,0|1,0,0]=3 17310 B16R2.1973 C=Cc1cccc(c1)NCc2cscn2 34a_100011827668_100000205941 [0,2,0,0,0,0|1,0,0]=3 17311 B16R2.1973 C=Cc1cccc(c1)NCc2ncc[nH]2 207a_100011827668_100000743867 [0,2,0,0,0,0|2,0,0]=4 17312 B16R2.1973 C=Cc1cccc(c1)NCc2ncc[nH]2 34a_100011827668_100016991755 [0,2,0,0,0,0|2,0,0]=4 17313 B16R2.1973 C=Cc1cccc(c1)NCc2ncco2 34a_100011827668_103436540062 [0,2,0,0,0,0|2,0,0]=4 17314 B16R2.1973 C=Cc1cccc(c1)NCc2nccs2 207a_100011827668_100000750902 [0,2,0,0,0,0|2,0,0]=4 17315 B16R2.1973 C=Cc1cccc(c1)NCc2nccs2 270302a_100011827668_100000750902 [0,2,0,0,0,0|2,0,0]=4 17316 B16R2.1973 C=Cc1cccc(c1)NCc2nccs2 34a_100011827668_100015184050 [0,2,0,0,0,0|2,0,0]=4 17317 B16R2.1973 C=Cc1cccc(c1)NCc2ncon2 34a_100011827668_100000233494 [0,2,0,0,0,0|2,0,0]=4 17318 B16R2.1973 C=Cc1cccc(c1)NCn2cncn2 34a_100011827668_200020645497 [0,2,0,0,0,0|1,0,1]=4 17319 B16R2.1973 C=Cc1cccc(c1)OCc2c[nH]cn2 34a_100011309434_100000707719 [0,2,0,0,0,0|1,0,0]=3 17320 B16R2.1973 C=Cc1cccc(c1)OCc2cscn2 34a_100011309434_100000205941 [0,2,0,0,0,0|2,0,0]=4 17321 B16R2.1973 C=Cc1cccc(c1)OCc2cscn2 7a_100011309434_100000205941 [0,2,0,0,0,0|2,0,0]=4 17322 B16R2.1973 C=Cc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100011215241 [0,2,0,0,0,0|1,0,0]=3 17323 B16R2.1973 C=Cc1cccc(c1)SCc2c[nH]cn2 62a_100011215241_100000707719 [0,2,0,0,0,0|1,0,0]=3 17324 B16R2.1973 C=Cc1cccc(c1)SCc2cscn2 62a_100000205941_100011215241 [0,2,0,0,0,0|2,0,0]=4 17325 B16R2.1973 C=Cc1cccc(c1)SCc2cscn2 62a_100011215241_100000205941 [0,2,0,0,0,0|2,0,0]=4 17326 B16R2.1973 C=Cc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_200012180632 [0,2,0,0,0,0|2,0,0]=4 17327 B16R2.1973 C=Cc1cncc(c1)SCc2c[nH]cn2 62a_200012180632_100000707719 [0,2,0,0,0,0|2,0,0]=4 17328 B16R2.1973 CC[n+]1cccc(c1)OCc2c[nH]cn2 34a_100000731997_100000707719 [0,2,0,0,0,0|2,0,0]=4 17329 B16R2.1973 CCc1cc(ccn1)NCc2c[nH]cn2 27a_100000758547_100009820011 [0,2,0,0,0,0|1,0,0]=3 17330 B16R2.1973 CCc1cc(ccn1)NCc2c[nH]nn2 27a_100020620823_100009820011 [0,2,0,0,0,0|2,0,0]=4 17331 B16R2.1973 CCc1cc(ccn1)NCc2cocn2 27a_100015188801_100009820011 [0,2,0,0,0,0|2,0,0]=4 17332 B16R2.1973 CCc1cc(ccn1)NCc2cscn2 27a_100015185402_100009820011 [0,2,0,0,0,0|2,0,0]=4 17333 B16R2.1973 CCc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100009820011 [0,2,0,0,0,0|2,0,0]=4 17334 B16R2.1973 CCc1cc(ccn1)SCc2c[nH]cn2 62a_100009820011_100000707719 [0,2,0,0,0,0|2,0,0]=4 17335 B16R2.1973 CCc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000744278 [0,2,0,0,0,0|2,0,0]=4 17336 B16R2.1973 CCc1cccc(c1)NCc2c[nH]cn2 2230a_100000211250_100000707719 [0,2,0,0,0,0|0,0,0]=2 17337 B16R2.1973 CCc1cccc(c1)NCc2c[nH]cn2 34a_100000211250_100000707719 [0,2,0,0,0,0|0,0,0]=2 17338 B16R2.1973 CCc1cccc(c1)NCc2cc[nH]n2 207a_100000211250_100000738523 [0,2,0,0,0,0|2,0,0]=4 17339 B16R2.1973 CCc1cccc(c1)NCc2ccco2 207a_100000211250_100000186105 [0,2,0,0,0,0|2,0,0]=4 17340 B16R2.1973 CCc1cccc(c1)NCc2ccco2 270302a_100000211250_100000186105 [0,2,0,0,0,0|2,0,0]=4 17341 B16R2.1973 CCc1cccc(c1)NCc2cccs2 207a_100000211250_100000209959 [0,2,0,0,0,0|2,0,0]=4 17342 B16R2.1973 CCc1cccc(c1)NCc2cccs2 270302a_100000211250_100000209959 [0,2,0,0,0,0|2,0,0]=4 17343 B16R2.1973 CCc1cccc(c1)NCc2ccoc2 207a_100000211250_100011215517 [0,2,0,0,0,0|2,0,0]=4 17344 B16R2.1973 CCc1cccc(c1)NCc2ccon2 2230a_100000211250_100000234950 [0,2,0,0,0,0|2,0,0]=4 17345 B16R2.1973 CCc1cccc(c1)NCc2ccon2 34a_100000211250_100000234950 [0,2,0,0,0,0|2,0,0]=4 17346 B16R2.1973 CCc1cccc(c1)NCc2ccon2 7a_100000211250_100000234950 [0,2,0,0,0,0|2,0,0]=4 17347 B16R2.1973 CCc1cccc(c1)NCc2ccsc2 207a_100000211250_100000188534 [0,2,0,0,0,0|2,0,0]=4 17348 B16R2.1973 CCc1cccc(c1)NCc2ccsc2 2230a_100000211250_100011261437 [0,2,0,0,0,0|2,0,0]=4 17349 B16R2.1973 CCc1cccc(c1)NCc2ccsc2 270302a_100000211250_100000188534 [0,2,0,0,0,0|2,0,0]=4 17350 B16R2.1973 CCc1cccc(c1)NCc2ccsc2 34a_100000211250_100011261437 [0,2,0,0,0,0|2,0,0]=4 17351 B16R2.1973 CCc1cccc(c1)NCc2ccsc2 7a_100000211250_100011261437 [0,2,0,0,0,0|2,0,0]=4 17352 B16R2.1973 CCc1cccc(c1)NCc2cn[nH]c2 207a_100000211250_100016992096 [0,2,0,0,0,0|2,0,0]=4 17353 B16R2.1973 CCc1cccc(c1)NCc2cn[nH]c2 270302a_100000211250_100016992096 [0,2,0,0,0,0|2,0,0]=4 17354 B16R2.1973 CCc1cccc(c1)NCc2cnc[nH]2 207a_100000211250_100000742939 [0,2,0,0,0,0|0,0,2]=4 17355 B16R2.1973 CCc1cccc(c1)NCc2cncs2 207a_100000211250_100000749870 [0,2,0,0,0,0|1,0,1]=4 17356 B16R2.1973 CCc1cccc(c1)NCc2cncs2 2230a_100000211250_100015185245 [0,2,0,0,0,0|1,0,1]=4 17357 B16R2.1973 CCc1cccc(c1)NCc2cncs2 270302a_100000211250_100000749870 [0,2,0,0,0,0|1,0,1]=4 17358 B16R2.1973 CCc1cccc(c1)NCc2cncs2 34a_100000211250_100015185245 [0,2,0,0,0,0|1,0,1]=4 17359 B16R2.1973 CCc1cccc(c1)NCc2cncs2 7a_100000211250_100015185245 [0,2,0,0,0,0|1,0,1]=4 17360 B16R2.1973 CCc1cccc(c1)NCc2cscn2 207a_100000211250_100000743575 [0,2,0,0,0,0|1,0,0]=3 17361 B16R2.1973 CCc1cccc(c1)NCc2cscn2 2230a_100000211250_100000205941 [0,2,0,0,0,0|1,0,0]=3 17362 B16R2.1973 CCc1cccc(c1)NCc2cscn2 270302a_100000211250_100000743575 [0,2,0,0,0,0|1,0,0]=3 17363 B16R2.1973 CCc1cccc(c1)NCc2cscn2 34a_100000211250_100000205941 [0,2,0,0,0,0|1,0,0]=3 17364 B16R2.1973 CCc1cccc(c1)NCc2cscn2 7a_100000211250_100000205941 [0,2,0,0,0,0|1,0,0]=3 17365 B16R2.1973 CCc1cccc(c1)NCc2ncc[nH]2 207a_100000211250_100000743867 [0,2,0,0,0,0|2,0,0]=4 17366 B16R2.1973 CCc1cccc(c1)NCc2ncc[nH]2 2230a_100000211250_100016991755 [0,2,0,0,0,0|2,0,0]=4 17367 B16R2.1973 CCc1cccc(c1)NCc2ncc[nH]2 34a_100000211250_100016991755 [0,2,0,0,0,0|2,0,0]=4 17368 B16R2.1973 CCc1cccc(c1)NCc2ncc[nH]2 7a_100000211250_100000753453 [0,2,0,0,0,0|2,0,0]=4 17369 B16R2.1973 CCc1cccc(c1)NCc2ncco2 2230a_100000211250_103436540062 [0,2,0,0,0,0|2,0,0]=4 17370 B16R2.1973 CCc1cccc(c1)NCc2ncco2 34a_100000211250_103436540062 [0,2,0,0,0,0|2,0,0]=4 17371 B16R2.1973 CCc1cccc(c1)NCc2ncco2 7a_100000211250_103436540062 [0,2,0,0,0,0|2,0,0]=4 17372 B16R2.1973 CCc1cccc(c1)NCc2nccs2 207a_100000211250_100000750902 [0,2,0,0,0,0|2,0,0]=4 17373 B16R2.1973 CCc1cccc(c1)NCc2nccs2 2230a_100000211250_100015184050 [0,2,0,0,0,0|2,0,0]=4 17374 B16R2.1973 CCc1cccc(c1)NCc2nccs2 270302a_100000211250_100000750902 [0,2,0,0,0,0|2,0,0]=4 17375 B16R2.1973 CCc1cccc(c1)NCc2nccs2 34a_100000211250_100015184050 [0,2,0,0,0,0|2,0,0]=4 17376 B16R2.1973 CCc1cccc(c1)NCc2nccs2 7a_100000211250_100015184050 [0,2,0,0,0,0|2,0,0]=4 17377 B16R2.1973 CCc1cccc(c1)NCc2ncon2 34a_100000211250_100000233494 [0,2,0,0,0,0|2,0,0]=4 17378 B16R2.1973 CCc1cccc(c1)NCn2cncn2 2230a_100000211250_200020645497 [0,2,0,0,0,0|1,0,1]=4 17379 B16R2.1973 CCc1cccc(c1)NCn2cncn2 34a_100000211250_200020645497 [0,2,0,0,0,0|1,0,1]=4 17380 B16R2.1973 CCc1cccc(c1)NCn2cncn2 7a_100000211250_200020645497 [0,2,0,0,0,0|1,0,1]=4 17381 B16R2.1973 CCc1cccc(c1)OCc2c[nH]cn2 34a_100000211550_100000707719 [0,2,0,0,0,0|1,0,0]=3 17382 B16R2.1973 CCc1cccc(c1)OCc2cscn2 34a_100000211550_100000205941 [0,2,0,0,0,0|2,0,0]=4 17383 B16R2.1973 CCc1cccc(c1)OCc2cscn2 7a_100000211550_100000205941 [0,2,0,0,0,0|2,0,0]=4 17384 B16R2.1973 CCc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100011263222 [0,2,0,0,0,0|1,0,0]=3 17385 B16R2.1973 CCc1cccc(c1)SCc2c[nH]cn2 62a_100011263222_100000707719 [0,2,0,0,0,0|1,0,0]=3 17386 B16R2.1973 CCc1cccc(c1)SCc2cscn2 62a_100000205941_100011263222 [0,2,0,0,0,0|2,0,0]=4 17387 B16R2.1973 CCc1cccc(c1)SCc2cscn2 62a_100011263222_100000205941 [0,2,0,0,0,0|2,0,0]=4 17388 B16R2.1973 CCc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100009856026 [0,2,0,0,0,0|2,0,0]=4 17389 B16R2.1973 CCc1cccc(n1)SCc2c[nH]cn2 62a_100009856026_100000707719 [0,2,0,0,0,0|2,0,0]=4 17390 B16R2.1973 CCc1ccnc(c1)NCc2c[nH]cn2 27a_100000758547_100009817561 [0,2,0,0,0,0|1,0,0]=3 17391 B16R2.1973 CCc1ccnc(c1)NCc2c[nH]nn2 27a_100020620823_100009817561 [0,2,0,0,0,0|2,0,0]=4 17392 B16R2.1973 CCc1ccnc(c1)NCc2cocn2 27a_100015188801_100009817561 [0,2,0,0,0,0|2,0,0]=4 17393 B16R2.1973 CCc1ccnc(c1)NCc2cscn2 27a_100015185402_100009817561 [0,2,0,0,0,0|2,0,0]=4 17394 B16R2.1973 CCc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100009817561 [0,2,0,0,0,0|2,0,0]=4 17395 B16R2.1973 CCc1ccnc(c1)SCc2c[nH]cn2 62a_100009817561_100000707719 [0,2,0,0,0,0|2,0,0]=4 17396 B16R2.1973 CCc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100000100215 [0,2,0,0,0,0|2,0,0]=4 17397 B16R2.1973 CCc1cncc(c1)OCc2c[nH]cn2 34a_200009861530_100000707719 [0,2,0,0,0,0|2,0,0]=4 17398 B16R2.1973 CCc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_200009819073 [0,2,0,0,0,0|2,0,0]=4 17399 B16R2.1973 CCc1cncc(c1)SCc2c[nH]cn2 62a_200009819073_100000707719 [0,2,0,0,0,0|2,0,0]=4 17400 B16R2.1973 CNc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100009819592 [0,2,0,0,0,0|2,0,0]=4 17401 B16R2.1973 CNc1cc(ccn1)SCc2c[nH]cn2 62a_100009819592_100000707719 [0,2,0,0,0,0|2,0,0]=4 17402 B16R2.1973 CNc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000756605 [0,2,0,0,0,0|2,0,0]=4 17403 B16R2.1973 CNc1cccc(c1)OCc2c[nH]cn2 34a_100000756613_100000707719 [0,2,0,0,0,0|1,0,0]=3 17404 B16R2.1973 CNc1cccc(c1)OCc2cscn2 34a_100000756613_100000205941 [0,2,0,0,0,0|2,0,0]=4 17405 B16R2.1973 CNc1cccc(c1)OCc2cscn2 7a_100000756613_100000205941 [0,2,0,0,0,0|2,0,0]=4 17406 B16R2.1973 CNc1cccc(c1)SCc2c[nH]cn2 62a_100000219648_100000707719 [0,2,0,0,0,0|1,0,0]=3 17407 B16R2.1973 CNc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000219648 [0,2,0,0,0,0|1,0,0]=3 17408 B16R2.1973 CNc1cccc(c1)SCc2cscn2 62a_100000205941_100000219648 [0,2,0,0,0,0|2,0,0]=4 17409 B16R2.1973 CNc1cccc(c1)SCc2cscn2 62a_100000219648_100000205941 [0,2,0,0,0,0|2,0,0]=4 17410 B16R2.1973 CNc1cccc(n1)SCc2c[nH]cn2 62a_100000703281_100000707719 [0,2,0,0,0,0|2,0,0]=4 17411 B16R2.1973 CNc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000703281 [0,2,0,0,0,0|2,0,0]=4 17412 B16R2.1973 CNc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100009869472 [0,2,0,0,0,0|2,0,0]=4 17413 B16R2.1973 CNc1ccnc(c1)SCc2c[nH]cn2 62a_100009869472_100000707719 [0,2,0,0,0,0|2,0,0]=4 17414 B16R2.1973 CNc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100011649947 [0,2,0,0,0,0|2,0,0]=4 17415 B16R2.1973 CNc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100012184536 [0,2,0,0,0,0|2,0,0]=4 17416 B16R2.1973 CNc1cncc(c1)SCc2c[nH]cn2 62a_100012184536_100000707719 [0,2,0,0,0,0|2,0,0]=4 17417 B16R2.1973 CNc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100012000420 [0,2,0,0,0,0|2,0,0]=4 17418 B16R2.1973 COc1cc(ccn1)OCc2c[nH]cn2 34a_100012181050_100000707719 [0,2,0,0,0,0|2,0,0]=4 17419 B16R2.1973 COc1cc(ccn1)SCc2c[nH]cn2 62a_100000117307_100000707719 [0,2,0,0,0,0|2,0,0]=4 17420 B16R2.1973 COc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000117307 [0,2,0,0,0,0|2,0,0]=4 17421 B16R2.1973 COc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000049997 [0,2,0,0,0,0|2,0,0]=4 17422 B16R2.1973 COc1cccc(c1)C=Cc2c[nH]cn2 271570a_100010186523_100000756875 [0,2,0,0,0,0|1,0,1]=4 17423 B16R2.1973 COc1cccc(c1)CSc2c[nH]cn2 62a_100000688526_100000756875 [0,2,0,0,0,0|2,0,0]=4 17424 B16R2.1973 COc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000211672 [0,2,0,0,0,0|2,0,0]=4 17425 B16R2.1973 COc1cccc(c1)NCc2c[nH]cn2 34a_100000210024_100000707719 [0,2,0,0,0,0|0,0,0]=2 17426 B16R2.1973 COc1cccc(c1)NCc2cc[nH]n2 207a_100000210024_100000738523 [0,2,0,0,0,0|2,0,0]=4 17427 B16R2.1973 COc1cccc(c1)NCc2ccco2 207a_100000210024_100000186105 [0,2,0,0,0,0|2,0,0]=4 17428 B16R2.1973 COc1cccc(c1)NCc2ccco2 270302a_100000210024_100000186105 [0,2,0,0,0,0|2,0,0]=4 17429 B16R2.1973 COc1cccc(c1)NCc2cccs2 207a_100000210024_100000209959 [0,2,0,0,0,0|2,0,0]=4 17430 B16R2.1973 COc1cccc(c1)NCc2cccs2 270302a_100000210024_100000209959 [0,2,0,0,0,0|2,0,0]=4 17431 B16R2.1973 COc1cccc(c1)NCc2ccoc2 207a_100000210024_100011215517 [0,2,0,0,0,0|2,0,0]=4 17432 B16R2.1973 COc1cccc(c1)NCc2ccon2 34a_100000210024_100000234950 [0,2,0,0,0,0|2,0,0]=4 17433 B16R2.1973 COc1cccc(c1)NCc2ccsc2 207a_100000210024_100000188534 [0,2,0,0,0,0|2,0,0]=4 17434 B16R2.1973 COc1cccc(c1)NCc2ccsc2 270302a_100000210024_100000188534 [0,2,0,0,0,0|2,0,0]=4 17435 B16R2.1973 COc1cccc(c1)NCc2ccsc2 34a_100000210024_100011261437 [0,2,0,0,0,0|2,0,0]=4 17436 B16R2.1973 COc1cccc(c1)NCc2cn[nH]c2 207a_100000210024_100016992096 [0,2,0,0,0,0|2,0,0]=4 17437 B16R2.1973 COc1cccc(c1)NCc2cn[nH]c2 270302a_100000210024_100016992096 [0,2,0,0,0,0|2,0,0]=4 17438 B16R2.1973 COc1cccc(c1)NCc2cnc[nH]2 207a_100000210024_100000742939 [0,2,0,0,0,0|0,0,2]=4 17439 B16R2.1973 COc1cccc(c1)NCc2cncs2 207a_100000210024_100000749870 [0,2,0,0,0,0|1,0,1]=4 17440 B16R2.1973 COc1cccc(c1)NCc2cncs2 270302a_100000210024_100000749870 [0,2,0,0,0,0|1,0,1]=4 17441 B16R2.1973 COc1cccc(c1)NCc2cncs2 34a_100000210024_100015185245 [0,2,0,0,0,0|1,0,1]=4 17442 B16R2.1973 COc1cccc(c1)NCc2cscn2 207a_100000210024_100000743575 [0,2,0,0,0,0|1,0,0]=3 17443 B16R2.1973 COc1cccc(c1)NCc2cscn2 270302a_100000210024_100000743575 [0,2,0,0,0,0|1,0,0]=3 17444 B16R2.1973 COc1cccc(c1)NCc2cscn2 34a_100000210024_100000205941 [0,2,0,0,0,0|1,0,0]=3 17445 B16R2.1973 COc1cccc(c1)NCc2ncc[nH]2 207a_100000210024_100000743867 [0,2,0,0,0,0|2,0,0]=4 17446 B16R2.1973 COc1cccc(c1)NCc2ncc[nH]2 34a_100000210024_100016991755 [0,2,0,0,0,0|2,0,0]=4 17447 B16R2.1973 COc1cccc(c1)NCc2ncco2 34a_100000210024_103436540062 [0,2,0,0,0,0|2,0,0]=4 17448 B16R2.1973 COc1cccc(c1)NCc2nccs2 207a_100000210024_100000750902 [0,2,0,0,0,0|2,0,0]=4 17449 B16R2.1973 COc1cccc(c1)NCc2nccs2 270302a_100000210024_100000750902 [0,2,0,0,0,0|2,0,0]=4 17450 B16R2.1973 COc1cccc(c1)NCc2nccs2 34a_100000210024_100015184050 [0,2,0,0,0,0|2,0,0]=4 17451 B16R2.1973 COc1cccc(c1)NCc2ncon2 34a_100000210024_100000233494 [0,2,0,0,0,0|2,0,0]=4 17452 B16R2.1973 COc1cccc(c1)NCn2cncn2 34a_100000210024_200020645497 [0,2,0,0,0,0|1,0,1]=4 17453 B16R2.1973 COc1cccc(c1)OCc2c[nH]cn2 34a_100000211255_100000707719 [0,2,0,0,0,0|1,0,0]=3 17454 B16R2.1973 COc1cccc(c1)OCc2cscn2 34a_100000211255_100000205941 [0,2,0,0,0,0|2,0,0]=4 17455 B16R2.1973 COc1cccc(c1)OCc2cscn2 7a_100000211255_100000205941 [0,2,0,0,0,0|2,0,0]=4 17456 B16R2.1973 COc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000170001 [0,2,0,0,0,0|1,0,0]=3 17457 B16R2.1973 COc1cccc(c1)SCc2cscn2 62a_100000205941_100000170001 [0,2,0,0,0,0|2,0,0]=4 17458 B16R2.1973 COc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000760917 [0,2,0,0,0,0|2,0,0]=4 17459 B16R2.1973 COc1cccc(n1)SCc2c[nH]cn2 62a_100000760917_100000707719 [0,2,0,0,0,0|2,0,0]=4 17460 B16R2.1973 COc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100011216251 [0,2,0,0,0,0|2,0,0]=4 17461 B16R2.1973 COc1ccnc(c1)SCc2c[nH]cn2 62a_100009817693_100000707719 [0,2,0,0,0,0|2,0,0]=4 17462 B16R2.1973 COc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100000182009 [0,2,0,0,0,0|2,0,0]=4 17463 B16R2.1973 COc1cncc(c1)OCc2c[nH]cn2 34a_100000084572_100000707719 [0,2,0,0,0,0|2,0,0]=4 17464 B16R2.1973 COc1cncc(c1)SCc2c[nH]cn2 62a_100000050176_100000707719 [0,2,0,0,0,0|2,0,0]=4 17465 B16R2.1973 COc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000050176 [0,2,0,0,0,0|2,0,0]=4 17466 B16R2.1973 COc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_100009819700 [0,2,0,0,0,0|2,0,0]=4 17467 B16R2.1973 COc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100000069072 [0,2,0,0,0,0|2,0,0]=4 17468 B16R2.1973 CSc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100011443430 [0,2,0,0,0,0|2,0,0]=4 17469 B16R2.1973 CSc1cccc(c1)NCc2c[nH]cn2 2230a_100000210049_100000707719 [0,2,0,0,0,0|0,0,0]=2 17470 B16R2.1973 CSc1cccc(c1)NCc2c[nH]cn2 34a_100000210049_100000707719 [0,2,0,0,0,0|0,0,0]=2 17471 B16R2.1973 CSc1cccc(c1)NCc2cc[nH]n2 207a_100000210049_100000738523 [0,2,0,0,0,0|2,0,0]=4 17472 B16R2.1973 CSc1cccc(c1)NCc2ccco2 207a_100000210049_100000186105 [0,2,0,0,0,0|2,0,0]=4 17473 B16R2.1973 CSc1cccc(c1)NCc2ccco2 270302a_100000210049_100000186105 [0,2,0,0,0,0|2,0,0]=4 17474 B16R2.1973 CSc1cccc(c1)NCc2cccs2 207a_100000210049_100000209959 [0,2,0,0,0,0|2,0,0]=4 17475 B16R2.1973 CSc1cccc(c1)NCc2cccs2 270302a_100000210049_100000209959 [0,2,0,0,0,0|2,0,0]=4 17476 B16R2.1973 CSc1cccc(c1)NCc2ccoc2 207a_100000210049_100011215517 [0,2,0,0,0,0|2,0,0]=4 17477 B16R2.1973 CSc1cccc(c1)NCc2ccon2 2230a_100000210049_100000234950 [0,2,0,0,0,0|2,0,0]=4 17478 B16R2.1973 CSc1cccc(c1)NCc2ccon2 34a_100000210049_100000234950 [0,2,0,0,0,0|2,0,0]=4 17479 B16R2.1973 CSc1cccc(c1)NCc2ccsc2 207a_100000210049_100000188534 [0,2,0,0,0,0|2,0,0]=4 17480 B16R2.1973 CSc1cccc(c1)NCc2ccsc2 2230a_100000210049_100011261437 [0,2,0,0,0,0|2,0,0]=4 17481 B16R2.1973 CSc1cccc(c1)NCc2ccsc2 270302a_100000210049_100000188534 [0,2,0,0,0,0|2,0,0]=4 17482 B16R2.1973 CSc1cccc(c1)NCc2ccsc2 34a_100000210049_100011261437 [0,2,0,0,0,0|2,0,0]=4 17483 B16R2.1973 CSc1cccc(c1)NCc2cn[nH]c2 207a_100000210049_100016992096 [0,2,0,0,0,0|2,0,0]=4 17484 B16R2.1973 CSc1cccc(c1)NCc2cn[nH]c2 270302a_100000210049_100016992096 [0,2,0,0,0,0|2,0,0]=4 17485 B16R2.1973 CSc1cccc(c1)NCc2cnc[nH]2 207a_100000210049_100000742939 [0,2,0,0,0,0|0,0,2]=4 17486 B16R2.1973 CSc1cccc(c1)NCc2cncs2 207a_100000210049_100000749870 [0,2,0,0,0,0|1,0,1]=4 17487 B16R2.1973 CSc1cccc(c1)NCc2cncs2 2230a_100000210049_100015185245 [0,2,0,0,0,0|1,0,1]=4 17488 B16R2.1973 CSc1cccc(c1)NCc2cncs2 270302a_100000210049_100000749870 [0,2,0,0,0,0|1,0,1]=4 17489 B16R2.1973 CSc1cccc(c1)NCc2cncs2 34a_100000210049_100015185245 [0,2,0,0,0,0|1,0,1]=4 17490 B16R2.1973 CSc1cccc(c1)NCc2cscn2 207a_100000210049_100000743575 [0,2,0,0,0,0|1,0,0]=3 17491 B16R2.1973 CSc1cccc(c1)NCc2cscn2 2230a_100000210049_100000205941 [0,2,0,0,0,0|1,0,0]=3 17492 B16R2.1973 CSc1cccc(c1)NCc2cscn2 270302a_100000210049_100000743575 [0,2,0,0,0,0|1,0,0]=3 17493 B16R2.1973 CSc1cccc(c1)NCc2cscn2 34a_100000210049_100000205941 [0,2,0,0,0,0|1,0,0]=3 17494 B16R2.1973 CSc1cccc(c1)NCc2ncc[nH]2 207a_100000210049_100000743867 [0,2,0,0,0,0|2,0,0]=4 17495 B16R2.1973 CSc1cccc(c1)NCc2ncc[nH]2 2230a_100000210049_100016991755 [0,2,0,0,0,0|2,0,0]=4 17496 B16R2.1973 CSc1cccc(c1)NCc2ncc[nH]2 34a_100000210049_100016991755 [0,2,0,0,0,0|2,0,0]=4 17497 B16R2.1973 CSc1cccc(c1)NCc2ncco2 2230a_100000210049_103436540062 [0,2,0,0,0,0|2,0,0]=4 17498 B16R2.1973 CSc1cccc(c1)NCc2ncco2 34a_100000210049_103436540062 [0,2,0,0,0,0|2,0,0]=4 17499 B16R2.1973 CSc1cccc(c1)NCc2nccs2 207a_100000210049_100000750902 [0,2,0,0,0,0|2,0,0]=4 17500 B16R2.1973 CSc1cccc(c1)NCc2nccs2 2230a_100000210049_100015184050 [0,2,0,0,0,0|2,0,0]=4 17501 B16R2.1973 CSc1cccc(c1)NCc2nccs2 270302a_100000210049_100000750902 [0,2,0,0,0,0|2,0,0]=4 17502 B16R2.1973 CSc1cccc(c1)NCc2nccs2 34a_100000210049_100015184050 [0,2,0,0,0,0|2,0,0]=4 17503 B16R2.1973 CSc1cccc(c1)NCc2ncon2 34a_100000210049_100000233494 [0,2,0,0,0,0|2,0,0]=4 17504 B16R2.1973 CSc1cccc(c1)NCn2cncn2 2230a_100000210049_200020645497 [0,2,0,0,0,0|1,0,1]=4 17505 B16R2.1973 CSc1cccc(c1)NCn2cncn2 34a_100000210049_200020645497 [0,2,0,0,0,0|1,0,1]=4 17506 B16R2.1973 CSc1cccc(c1)OCc2c[nH]cn2 34a_100011265683_100000707719 [0,2,0,0,0,0|1,0,0]=3 17507 B16R2.1973 CSc1cccc(c1)OCc2cscn2 34a_100011265683_100000205941 [0,2,0,0,0,0|2,0,0]=4 17508 B16R2.1973 CSc1cccc(c1)OCc2cscn2 7a_100011265683_100000205941 [0,2,0,0,0,0|2,0,0]=4 17509 B16R2.1973 CSc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100011215954 [0,2,0,0,0,0|1,0,0]=3 17510 B16R2.1973 CSc1cccc(c1)SCc2c[nH]cn2 62a_100011215954_100000707719 [0,2,0,0,0,0|1,0,0]=3 17511 B16R2.1973 CSc1cccc(c1)SCc2cscn2 62a_100000205941_100011215954 [0,2,0,0,0,0|2,0,0]=4 17512 B16R2.1973 CSc1cccc(c1)SCc2cscn2 62a_100011215954_100000205941 [0,2,0,0,0,0|2,0,0]=4 17513 B16R2.1973 CSc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100011960944 [0,2,0,0,0,0|2,0,0]=4 17514 B16R2.1973 CSc1cccc(n1)SCc2c[nH]cn2 62a_100011960944_100000707719 [0,2,0,0,0,0|2,0,0]=4 17515 B16R2.1973 CSc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100010883326 [0,2,0,0,0,0|2,0,0]=4 17516 B16R2.1973 CSc1ccnc(c1)SCc2c[nH]cn2 62a_100010883326_100000707719 [0,2,0,0,0,0|2,0,0]=4 17517 B16R2.1973 CSc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100011650323 [0,2,0,0,0,0|2,0,0]=4 17518 B16R2.1973 CSc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100009816972 [0,2,0,0,0,0|2,0,0]=4 17519 B16R2.1973 CSc1cncc(c1)SCc2c[nH]cn2 62a_100009816972_100000707719 [0,2,0,0,0,0|2,0,0]=4 17520 B16R2.1973 CSc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100000032126 [0,2,0,0,0,0|2,0,0]=4 17521 B16R2.1973 ClCc1cccc(c1)OCc2c[nH]cn2 34a_100000084143_100000707719 [0,2,0,0,0,0|1,0,0]=3 17522 B16R2.1973 ClCc1cccc(c1)OCc2cscn2 34a_100000084143_100000205941 [0,2,0,0,0,0|2,0,0]=4 17523 B16R2.1973 ClCc1cccc(c1)OCc2cscn2 7a_100000084143_100000205941 [0,2,0,0,0,0|2,0,0]=4 17524 B16R2.1973 FCc1cccc(c1)NCc2c[nH]cn2 2230a_100000126320_100000707719 [0,2,0,0,0,0|0,0,0]=2 17525 B16R2.1973 FCc1cccc(c1)NCc2c[nH]cn2 34a_100000126320_100000707719 [0,2,0,0,0,0|0,0,0]=2 17526 B16R2.1973 FCc1cccc(c1)NCc2cc[nH]n2 207a_100000126320_100000738523 [0,2,0,0,0,0|2,0,0]=4 17527 B16R2.1973 FCc1cccc(c1)NCc2ccco2 207a_100000126320_100000186105 [0,2,0,0,0,0|2,0,0]=4 17528 B16R2.1973 FCc1cccc(c1)NCc2ccco2 270302a_100000126320_100000186105 [0,2,0,0,0,0|2,0,0]=4 17529 B16R2.1973 FCc1cccc(c1)NCc2cccs2 207a_100000126320_100000209959 [0,2,0,0,0,0|2,0,0]=4 17530 B16R2.1973 FCc1cccc(c1)NCc2cccs2 270302a_100000126320_100000209959 [0,2,0,0,0,0|2,0,0]=4 17531 B16R2.1973 FCc1cccc(c1)NCc2ccoc2 207a_100000126320_100011215517 [0,2,0,0,0,0|2,0,0]=4 17532 B16R2.1973 FCc1cccc(c1)NCc2ccon2 2230a_100000126320_100000234950 [0,2,0,0,0,0|2,0,0]=4 17533 B16R2.1973 FCc1cccc(c1)NCc2ccon2 34a_100000126320_100000234950 [0,2,0,0,0,0|2,0,0]=4 17534 B16R2.1973 FCc1cccc(c1)NCc2ccon2 7a_100000126320_100000234950 [0,2,0,0,0,0|2,0,0]=4 17535 B16R2.1973 FCc1cccc(c1)NCc2ccsc2 207a_100000126320_100000188534 [0,2,0,0,0,0|2,0,0]=4 17536 B16R2.1973 FCc1cccc(c1)NCc2ccsc2 2230a_100000126320_100011261437 [0,2,0,0,0,0|2,0,0]=4 17537 B16R2.1973 FCc1cccc(c1)NCc2ccsc2 270302a_100000126320_100000188534 [0,2,0,0,0,0|2,0,0]=4 17538 B16R2.1973 FCc1cccc(c1)NCc2ccsc2 34a_100000126320_100011261437 [0,2,0,0,0,0|2,0,0]=4 17539 B16R2.1973 FCc1cccc(c1)NCc2ccsc2 7a_100000126320_100011261437 [0,2,0,0,0,0|2,0,0]=4 17540 B16R2.1973 FCc1cccc(c1)NCc2cn[nH]c2 207a_100000126320_100016992096 [0,2,0,0,0,0|2,0,0]=4 17541 B16R2.1973 FCc1cccc(c1)NCc2cn[nH]c2 270302a_100000126320_100016992096 [0,2,0,0,0,0|2,0,0]=4 17542 B16R2.1973 FCc1cccc(c1)NCc2cnc[nH]2 207a_100000126320_100000742939 [0,2,0,0,0,0|0,0,2]=4 17543 B16R2.1973 FCc1cccc(c1)NCc2cncs2 207a_100000126320_100000749870 [0,2,0,0,0,0|1,0,1]=4 17544 B16R2.1973 FCc1cccc(c1)NCc2cncs2 2230a_100000126320_100015185245 [0,2,0,0,0,0|1,0,1]=4 17545 B16R2.1973 FCc1cccc(c1)NCc2cncs2 270302a_100000126320_100000749870 [0,2,0,0,0,0|1,0,1]=4 17546 B16R2.1973 FCc1cccc(c1)NCc2cncs2 34a_100000126320_100015185245 [0,2,0,0,0,0|1,0,1]=4 17547 B16R2.1973 FCc1cccc(c1)NCc2cncs2 7a_100000126320_100015185245 [0,2,0,0,0,0|1,0,1]=4 17548 B16R2.1973 FCc1cccc(c1)NCc2cscn2 207a_100000126320_100000743575 [0,2,0,0,0,0|1,0,0]=3 17549 B16R2.1973 FCc1cccc(c1)NCc2cscn2 2230a_100000126320_100000205941 [0,2,0,0,0,0|1,0,0]=3 17550 B16R2.1973 FCc1cccc(c1)NCc2cscn2 270302a_100000126320_100000743575 [0,2,0,0,0,0|1,0,0]=3 17551 B16R2.1973 FCc1cccc(c1)NCc2cscn2 34a_100000126320_100000205941 [0,2,0,0,0,0|1,0,0]=3 17552 B16R2.1973 FCc1cccc(c1)NCc2cscn2 7a_100000126320_100000205941 [0,2,0,0,0,0|1,0,0]=3 17553 B16R2.1973 FCc1cccc(c1)NCc2ncc[nH]2 207a_100000126320_100000743867 [0,2,0,0,0,0|2,0,0]=4 17554 B16R2.1973 FCc1cccc(c1)NCc2ncc[nH]2 2230a_100000126320_100016991755 [0,2,0,0,0,0|2,0,0]=4 17555 B16R2.1973 FCc1cccc(c1)NCc2ncc[nH]2 34a_100000126320_100016991755 [0,2,0,0,0,0|2,0,0]=4 17556 B16R2.1973 FCc1cccc(c1)NCc2ncc[nH]2 7a_100000126320_100000753453 [0,2,0,0,0,0|2,0,0]=4 17557 B16R2.1973 FCc1cccc(c1)NCc2ncco2 2230a_100000126320_103436540062 [0,2,0,0,0,0|2,0,0]=4 17558 B16R2.1973 FCc1cccc(c1)NCc2ncco2 34a_100000126320_103436540062 [0,2,0,0,0,0|2,0,0]=4 17559 B16R2.1973 FCc1cccc(c1)NCc2ncco2 7a_100000126320_103436540062 [0,2,0,0,0,0|2,0,0]=4 17560 B16R2.1973 FCc1cccc(c1)NCc2nccs2 207a_100000126320_100000750902 [0,2,0,0,0,0|2,0,0]=4 17561 B16R2.1973 FCc1cccc(c1)NCc2nccs2 2230a_100000126320_100015184050 [0,2,0,0,0,0|2,0,0]=4 17562 B16R2.1973 FCc1cccc(c1)NCc2nccs2 270302a_100000126320_100000750902 [0,2,0,0,0,0|2,0,0]=4 17563 B16R2.1973 FCc1cccc(c1)NCc2nccs2 34a_100000126320_100015184050 [0,2,0,0,0,0|2,0,0]=4 17564 B16R2.1973 FCc1cccc(c1)NCc2nccs2 7a_100000126320_100015184050 [0,2,0,0,0,0|2,0,0]=4 17565 B16R2.1973 FCc1cccc(c1)NCc2ncon2 34a_100000126320_100000233494 [0,2,0,0,0,0|2,0,0]=4 17566 B16R2.1973 FCc1cccc(c1)NCn2cncn2 2230a_100000126320_200020645497 [0,2,0,0,0,0|1,0,1]=4 17567 B16R2.1973 FCc1cccc(c1)NCn2cncn2 34a_100000126320_200020645497 [0,2,0,0,0,0|1,0,1]=4 17568 B16R2.1973 FCc1cccc(c1)NCn2cncn2 7a_100000126320_200020645497 [0,2,0,0,0,0|1,0,1]=4 17569 B16R2.1973 FCc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100010878472 [0,2,0,0,0,0|1,0,0]=3 17570 B16R2.1973 FCc1cccc(c1)SCc2c[nH]cn2 62a_100010878472_100000707719 [0,2,0,0,0,0|1,0,0]=3 17571 B16R2.1973 FCc1cccc(c1)SCc2cscn2 62a_100000205941_100010878472 [0,2,0,0,0,0|2,0,0]=4 17572 B16R2.1973 FCc1cccc(c1)SCc2cscn2 62a_100010878472_100000205941 [0,2,0,0,0,0|2,0,0]=4 17573 B16R2.1973 N#Cc1cc(ccn1)NCc2c[nH]cn2 27a_100000758547_100000685610 [0,2,0,0,0,0|1,0,0]=3 17574 B16R2.1973 N#Cc1cc(ccn1)NCc2c[nH]nn2 27a_100020620823_100000685610 [0,2,0,0,0,0|2,0,0]=4 17575 B16R2.1973 N#Cc1cc(ccn1)NCc2cocn2 27a_100015188801_100000685610 [0,2,0,0,0,0|2,0,0]=4 17576 B16R2.1973 N#Cc1cc(ccn1)NCc2cscn2 27a_100015185402_100000685610 [0,2,0,0,0,0|2,0,0]=4 17577 B16R2.1973 N#Cc1cc(ccn1)OCc2c[nH]cn2 34a_100011777083_100000707719 [0,2,0,0,0,0|2,0,0]=4 17578 B16R2.1973 N#Cc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000685610 [0,2,0,0,0,0|2,0,0]=4 17579 B16R2.1973 N#Cc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000092509 [0,2,0,0,0,0|2,0,0]=4 17580 B16R2.1973 N#Cc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100000233786 [0,2,0,0,0,0|2,0,0]=4 17581 B16R2.1973 N#Cc1cccc(c1)NCc2c[nH]cn2 34a_100000210922_100000707719 [0,2,0,0,0,0|0,0,0]=2 17582 B16R2.1973 N#Cc1cccc(c1)NCc2cc[nH]n2 207a_100000210922_100000738523 [0,2,0,0,0,0|2,0,0]=4 17583 B16R2.1973 N#Cc1cccc(c1)NCc2ccco2 207a_100000210922_100000186105 [0,2,0,0,0,0|2,0,0]=4 17584 B16R2.1973 N#Cc1cccc(c1)NCc2ccco2 270302a_100000210922_100000186105 [0,2,0,0,0,0|2,0,0]=4 17585 B16R2.1973 N#Cc1cccc(c1)NCc2cccs2 207a_100000210922_100000209959 [0,2,0,0,0,0|2,0,0]=4 17586 B16R2.1973 N#Cc1cccc(c1)NCc2cccs2 270302a_100000210922_100000209959 [0,2,0,0,0,0|2,0,0]=4 17587 B16R2.1973 N#Cc1cccc(c1)NCc2ccoc2 207a_100000210922_100011215517 [0,2,0,0,0,0|2,0,0]=4 17588 B16R2.1973 N#Cc1cccc(c1)NCc2ccon2 34a_100000210922_100000234950 [0,2,0,0,0,0|2,0,0]=4 17589 B16R2.1973 N#Cc1cccc(c1)NCc2ccon2 7a_100000210922_100000234950 [0,2,0,0,0,0|2,0,0]=4 17590 B16R2.1973 N#Cc1cccc(c1)NCc2ccsc2 207a_100000210922_100000188534 [0,2,0,0,0,0|2,0,0]=4 17591 B16R2.1973 N#Cc1cccc(c1)NCc2ccsc2 270302a_100000210922_100000188534 [0,2,0,0,0,0|2,0,0]=4 17592 B16R2.1973 N#Cc1cccc(c1)NCc2ccsc2 34a_100000210922_100011261437 [0,2,0,0,0,0|2,0,0]=4 17593 B16R2.1973 N#Cc1cccc(c1)NCc2ccsc2 7a_100000210922_100011261437 [0,2,0,0,0,0|2,0,0]=4 17594 B16R2.1973 N#Cc1cccc(c1)NCc2cn[nH]c2 207a_100000210922_100016992096 [0,2,0,0,0,0|2,0,0]=4 17595 B16R2.1973 N#Cc1cccc(c1)NCc2cn[nH]c2 270302a_100000210922_100016992096 [0,2,0,0,0,0|2,0,0]=4 17596 B16R2.1973 N#Cc1cccc(c1)NCc2cnc[nH]2 207a_100000210922_100000742939 [0,2,0,0,0,0|0,0,2]=4 17597 B16R2.1973 N#Cc1cccc(c1)NCc2cncs2 207a_100000210922_100000749870 [0,2,0,0,0,0|1,0,1]=4 17598 B16R2.1973 N#Cc1cccc(c1)NCc2cncs2 270302a_100000210922_100000749870 [0,2,0,0,0,0|1,0,1]=4 17599 B16R2.1973 N#Cc1cccc(c1)NCc2cncs2 34a_100000210922_100015185245 [0,2,0,0,0,0|1,0,1]=4 17600 B16R2.1973 N#Cc1cccc(c1)NCc2cncs2 7a_100000210922_100015185245 [0,2,0,0,0,0|1,0,1]=4 17601 B16R2.1973 N#Cc1cccc(c1)NCc2cscn2 207a_100000210922_100000743575 [0,2,0,0,0,0|1,0,0]=3 17602 B16R2.1973 N#Cc1cccc(c1)NCc2cscn2 270302a_100000210922_100000743575 [0,2,0,0,0,0|1,0,0]=3 17603 B16R2.1973 N#Cc1cccc(c1)NCc2cscn2 34a_100000210922_100000205941 [0,2,0,0,0,0|1,0,0]=3 17604 B16R2.1973 N#Cc1cccc(c1)NCc2cscn2 7a_100000210922_100000205941 [0,2,0,0,0,0|1,0,0]=3 17605 B16R2.1973 N#Cc1cccc(c1)NCc2ncc[nH]2 207a_100000210922_100000743867 [0,2,0,0,0,0|2,0,0]=4 17606 B16R2.1973 N#Cc1cccc(c1)NCc2ncc[nH]2 34a_100000210922_100016991755 [0,2,0,0,0,0|2,0,0]=4 17607 B16R2.1973 N#Cc1cccc(c1)NCc2ncc[nH]2 7a_100000210922_100000753453 [0,2,0,0,0,0|2,0,0]=4 17608 B16R2.1973 N#Cc1cccc(c1)NCc2ncco2 34a_100000210922_103436540062 [0,2,0,0,0,0|2,0,0]=4 17609 B16R2.1973 N#Cc1cccc(c1)NCc2ncco2 7a_100000210922_103436540062 [0,2,0,0,0,0|2,0,0]=4 17610 B16R2.1973 N#Cc1cccc(c1)NCc2nccs2 207a_100000210922_100000750902 [0,2,0,0,0,0|2,0,0]=4 17611 B16R2.1973 N#Cc1cccc(c1)NCc2nccs2 270302a_100000210922_100000750902 [0,2,0,0,0,0|2,0,0]=4 17612 B16R2.1973 N#Cc1cccc(c1)NCc2nccs2 34a_100000210922_100015184050 [0,2,0,0,0,0|2,0,0]=4 17613 B16R2.1973 N#Cc1cccc(c1)NCc2nccs2 7a_100000210922_100015184050 [0,2,0,0,0,0|2,0,0]=4 17614 B16R2.1973 N#Cc1cccc(c1)NCc2ncon2 34a_100000210922_100000233494 [0,2,0,0,0,0|2,0,0]=4 17615 B16R2.1973 N#Cc1cccc(c1)NCn2cncn2 34a_100000210922_200020645497 [0,2,0,0,0,0|1,0,1]=4 17616 B16R2.1973 N#Cc1cccc(c1)NCn2cncn2 7a_100000210922_200020645497 [0,2,0,0,0,0|1,0,1]=4 17617 B16R2.1973 N#Cc1cccc(c1)OCc2c[nH]cn2 34a_100000184713_100000707719 [0,2,0,0,0,0|1,0,0]=3 17618 B16R2.1973 N#Cc1cccc(c1)OCc2cscn2 34a_100000184713_100000205941 [0,2,0,0,0,0|2,0,0]=4 17619 B16R2.1973 N#Cc1cccc(c1)OCc2cscn2 7a_100000184713_100000205941 [0,2,0,0,0,0|2,0,0]=4 17620 B16R2.1973 N#Cc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000189340 [0,2,0,0,0,0|1,0,0]=3 17621 B16R2.1973 N#Cc1cccc(c1)SCc2cscn2 62a_100000205941_100000189340 [0,2,0,0,0,0|2,0,0]=4 17622 B16R2.1973 N#Cc1cccc(n1)NCc2c[nH]cn2 27a_100000758547_100011934037 [0,2,0,0,0,0|1,0,0]=3 17623 B16R2.1973 N#Cc1cccc(n1)NCc2c[nH]nn2 27a_100020620823_100011934037 [0,2,0,0,0,0|2,0,0]=4 17624 B16R2.1973 N#Cc1cccc(n1)NCc2cocn2 27a_100015188801_100011934037 [0,2,0,0,0,0|2,0,0]=4 17625 B16R2.1973 N#Cc1cccc(n1)NCc2cscn2 27a_100015185402_100011934037 [0,2,0,0,0,0|2,0,0]=4 17626 B16R2.1973 N#Cc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100011934037 [0,2,0,0,0,0|2,0,0]=4 17627 B16R2.1973 N#Cc1ccnc(c1)NCc2c[nH]cn2 27a_100000758547_100011291639 [0,2,0,0,0,0|1,0,0]=3 17628 B16R2.1973 N#Cc1ccnc(c1)NCc2c[nH]nn2 27a_100020620823_100011291639 [0,2,0,0,0,0|2,0,0]=4 17629 B16R2.1973 N#Cc1ccnc(c1)NCc2cocn2 27a_100015188801_100011291639 [0,2,0,0,0,0|2,0,0]=4 17630 B16R2.1973 N#Cc1ccnc(c1)NCc2cscn2 27a_100015185402_100011291639 [0,2,0,0,0,0|2,0,0]=4 17631 B16R2.1973 N#Cc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100011291639 [0,2,0,0,0,0|2,0,0]=4 17632 B16R2.1973 N#Cc1ccnc(n1)NCc2c[nH]cn2 27a_100000758547_100000066186 [0,2,0,0,0,0|2,0,0]=4 17633 B16R2.1973 N#Cc1cncc(c1)OCc2c[nH]cn2 34a_100012002025_100000707719 [0,2,0,0,0,0|2,0,0]=4 17634 B16R2.1973 N#Cc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000686085 [0,2,0,0,0,0|2,0,0]=4 17635 B16R2.1973 N#Cc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_100009817212 [0,2,0,0,0,0|2,0,0]=4 17636 B16R2.1973 N#Cc1nccc(n1)NCc2c[nH]cn2 27a_100000758547_100000092507 [0,2,0,0,0,0|2,0,0]=4 17637 B16R2.1973 NCc1cc(ccn1)SCc2c[nH]cn2 62a_100000085674_100000707719 [0,2,0,0,0,0|2,0,0]=4 17638 B16R2.1973 NCc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000085674 [0,2,0,0,0,0|2,0,0]=4 17639 B16R2.1973 NCc1cccc(c1)OCc2c[nH]cn2 34a_100000743036_100000707719 [0,2,0,0,0,0|1,0,0]=3 17640 B16R2.1973 NCc1cccc(c1)OCc2cscn2 34a_100000743036_100000205941 [0,2,0,0,0,0|2,0,0]=4 17641 B16R2.1973 NCc1cccc(c1)SCc2c[nH]cn2 62a_100000106179_100000707719 [0,2,0,0,0,0|1,0,0]=3 17642 B16R2.1973 NCc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000106179 [0,2,0,0,0,0|1,0,0]=3 17643 B16R2.1973 NCc1cccc(c1)SCc2cscn2 62a_100000106179_100000205941 [0,2,0,0,0,0|2,0,0]=4 17644 B16R2.1973 NCc1cccc(c1)SCc2cscn2 62a_100000205941_100000106179 [0,2,0,0,0,0|2,0,0]=4 17645 B16R2.1973 NCc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100016990191 [0,2,0,0,0,0|2,0,0]=4 17646 B16R2.1973 NCc1cccc(n1)SCc2c[nH]cn2 62a_100016990191_100000707719 [0,2,0,0,0,0|2,0,0]=4 17647 B16R2.1973 NCc1ccnc(c1)OCc2c[nH]cn2 34a_100000748557_100000707719 [0,2,0,0,0,0|2,0,0]=4 17648 B16R2.1973 NCc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100025757509 [0,2,0,0,0,0|2,0,0]=4 17649 B16R2.1973 NCc1ccnc(c1)SCc2c[nH]cn2 62a_100025757509_100000707719 [0,2,0,0,0,0|2,0,0]=4 17650 B16R2.1973 NCc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100011249555 [0,2,0,0,0,0|2,0,0]=4 17651 B16R2.1973 NCc1cncc(c1)SCc2c[nH]cn2 62a_100011249555_100000707719 [0,2,0,0,0,0|2,0,0]=4 17652 B16R2.1973 NNc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000764631 [0,2,0,0,0,0|2,0,0]=4 17653 B16R2.1973 NNc1cc(ccn1)SCc2c[nH]cn2 62a_100000764631_100000707719 [0,2,0,0,0,0|2,0,0]=4 17654 B16R2.1973 NNc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000242035 [0,2,0,0,0,0|2,0,0]=4 17655 B16R2.1973 NNc1cccc(c1)SCc2c[nH]cn2 62a_100000217339_100000707719 [0,2,0,0,0,0|1,0,0]=3 17656 B16R2.1973 NNc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000217339 [0,2,0,0,0,0|1,0,0]=3 17657 B16R2.1973 NNc1cccc(c1)SCc2cscn2 62a_100000205941_100000217339 [0,2,0,0,0,0|2,0,0]=4 17658 B16R2.1973 NNc1cccc(c1)SCc2cscn2 62a_100000217339_100000205941 [0,2,0,0,0,0|2,0,0]=4 17659 B16R2.1973 NNc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100009817029 [0,2,0,0,0,0|2,0,0]=4 17660 B16R2.1973 NNc1cccc(n1)SCc2c[nH]cn2 62a_100009817029_100000707719 [0,2,0,0,0,0|2,0,0]=4 17661 B16R2.1973 NNc1ccnc(c1)SCc2c[nH]cn2 62a_100000089018_100000707719 [0,2,0,0,0,0|2,0,0]=4 17662 B16R2.1973 NNc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100000089018 [0,2,0,0,0,0|2,0,0]=4 17663 B16R2.1973 NNc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000727789 [0,2,0,0,0,0|2,0,0]=4 17664 B16R2.1973 NNc1cncc(c1)SCc2c[nH]cn2 62a_100000727789_100000707719 [0,2,0,0,0,0|2,0,0]=4 17665 B16R2.1973 O=Cc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100011998288 [0,2,0,0,0,0|2,0,0]=4 17666 B16R2.1973 O=Cc1cc(ccn1)SCc2c[nH]cn2 62a_100011998288_100000707719 [0,2,0,0,0,0|2,0,0]=4 17667 B16R2.1973 O=Cc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100009816774 [0,2,0,0,0,0|2,0,0]=4 17668 B16R2.1973 O=Cc1cccc(c1)CSc2c[nH]cn2 62a_100009816774_100000756875 [0,2,0,0,0,0|2,0,0]=4 17669 B16R2.1973 O=Cc1cccc(c1)SCc2c[nH]cn2 62a_100000014684_100000707719 [0,2,0,0,0,0|1,0,0]=3 17670 B16R2.1973 O=Cc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000014684 [0,2,0,0,0,0|1,0,0]=3 17671 B16R2.1973 O=Cc1cccc(c1)SCc2cscn2 62a_100000014684_100000205941 [0,2,0,0,0,0|2,0,0]=4 17672 B16R2.1973 O=Cc1cccc(c1)SCc2cscn2 62a_100000205941_100000014684 [0,2,0,0,0,0|2,0,0]=4 17673 B16R2.1973 O=Cc1cccc(n1)SCc2c[nH]cn2 62a_100000688028_100000707719 [0,2,0,0,0,0|2,0,0]=4 17674 B16R2.1973 O=Cc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000688028 [0,2,0,0,0,0|2,0,0]=4 17675 B16R2.1973 O=Cc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100011290808 [0,2,0,0,0,0|2,0,0]=4 17676 B16R2.1973 O=Cc1ccnc(c1)SCc2c[nH]cn2 62a_100011290808_100000707719 [0,2,0,0,0,0|2,0,0]=4 17677 B16R2.1973 O=Cc1cncc(c1)SCc2c[nH]cn2 62a_100000687066_100000707719 [0,2,0,0,0,0|2,0,0]=4 17678 B16R2.1973 O=Cc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100000687066 [0,2,0,0,0,0|2,0,0]=4 17679 B16R2.1973 OCc1cc(ccn1)NCc2c[nH]cn2 27a_100000758547_100000748867 [0,2,0,0,0,0|1,0,0]=3 17680 B16R2.1973 OCc1cc(ccn1)NCc2c[nH]nn2 27a_100020620823_100000748867 [0,2,0,0,0,0|2,0,0]=4 17681 B16R2.1973 OCc1cc(ccn1)NCc2cocn2 27a_100015188801_100000748867 [0,2,0,0,0,0|2,0,0]=4 17682 B16R2.1973 OCc1cc(ccn1)NCc2cscn2 27a_100015185402_100000748867 [0,2,0,0,0,0|2,0,0]=4 17683 B16R2.1973 OCc1cc(ccn1)SCc2c[nH]cn2 62a_100000707719_100000748867 [0,2,0,0,0,0|2,0,0]=4 17684 B16R2.1973 OCc1cc(ccn1)SCc2c[nH]cn2 62a_100000748867_100000707719 [0,2,0,0,0,0|2,0,0]=4 17685 B16R2.1973 OCc1cc(ncn1)NCc2c[nH]cn2 27a_100000758547_100000731546 [0,2,0,0,0,0|2,0,0]=4 17686 B16R2.1973 OCc1cccc(c1)CSc2c[nH]cn2 62a_100000756875_100010188025 [0,2,0,0,0,0|2,0,0]=4 17687 B16R2.1973 OCc1cccc(c1)CSc2c[nH]cn2 62a_100010188025_100000756875 [0,2,0,0,0,0|2,0,0]=4 17688 B16R2.1973 OCc1cccc(c1)NCc2c[nH]cn2 2230a_100000211919_100000707719 [0,2,0,0,0,0|0,0,0]=2 17689 B16R2.1973 OCc1cccc(c1)NCc2c[nH]cn2 34a_100000211919_100000707719 [0,2,0,0,0,0|0,0,0]=2 17690 B16R2.1973 OCc1cccc(c1)NCc2cc[nH]n2 207a_100000211919_100000738523 [0,2,0,0,0,0|2,0,0]=4 17691 B16R2.1973 OCc1cccc(c1)NCc2ccco2 207a_100000211919_100000186105 [0,2,0,0,0,0|2,0,0]=4 17692 B16R2.1973 OCc1cccc(c1)NCc2ccco2 270302a_100000211919_100000186105 [0,2,0,0,0,0|2,0,0]=4 17693 B16R2.1973 OCc1cccc(c1)NCc2cccs2 207a_100000211919_100000209959 [0,2,0,0,0,0|2,0,0]=4 17694 B16R2.1973 OCc1cccc(c1)NCc2cccs2 270302a_100000211919_100000209959 [0,2,0,0,0,0|2,0,0]=4 17695 B16R2.1973 OCc1cccc(c1)NCc2ccoc2 207a_100000211919_100011215517 [0,2,0,0,0,0|2,0,0]=4 17696 B16R2.1973 OCc1cccc(c1)NCc2ccon2 2230a_100000211919_100000234950 [0,2,0,0,0,0|2,0,0]=4 17697 B16R2.1973 OCc1cccc(c1)NCc2ccon2 34a_100000211919_100000234950 [0,2,0,0,0,0|2,0,0]=4 17698 B16R2.1973 OCc1cccc(c1)NCc2ccsc2 207a_100000211919_100000188534 [0,2,0,0,0,0|2,0,0]=4 17699 B16R2.1973 OCc1cccc(c1)NCc2ccsc2 2230a_100000211919_100011261437 [0,2,0,0,0,0|2,0,0]=4 17700 B16R2.1973 OCc1cccc(c1)NCc2ccsc2 270302a_100000211919_100000188534 [0,2,0,0,0,0|2,0,0]=4 17701 B16R2.1973 OCc1cccc(c1)NCc2ccsc2 34a_100000211919_100011261437 [0,2,0,0,0,0|2,0,0]=4 17702 B16R2.1973 OCc1cccc(c1)NCc2cn[nH]c2 207a_100000211919_100016992096 [0,2,0,0,0,0|2,0,0]=4 17703 B16R2.1973 OCc1cccc(c1)NCc2cn[nH]c2 270302a_100000211919_100016992096 [0,2,0,0,0,0|2,0,0]=4 17704 B16R2.1973 OCc1cccc(c1)NCc2cnc[nH]2 207a_100000211919_100000742939 [0,2,0,0,0,0|0,0,2]=4 17705 B16R2.1973 OCc1cccc(c1)NCc2cncs2 207a_100000211919_100000749870 [0,2,0,0,0,0|1,0,1]=4 17706 B16R2.1973 OCc1cccc(c1)NCc2cncs2 2230a_100000211919_100015185245 [0,2,0,0,0,0|1,0,1]=4 17707 B16R2.1973 OCc1cccc(c1)NCc2cncs2 270302a_100000211919_100000749870 [0,2,0,0,0,0|1,0,1]=4 17708 B16R2.1973 OCc1cccc(c1)NCc2cncs2 34a_100000211919_100015185245 [0,2,0,0,0,0|1,0,1]=4 17709 B16R2.1973 OCc1cccc(c1)NCc2cscn2 207a_100000211919_100000743575 [0,2,0,0,0,0|1,0,0]=3 17710 B16R2.1973 OCc1cccc(c1)NCc2cscn2 2230a_100000211919_100000205941 [0,2,0,0,0,0|1,0,0]=3 17711 B16R2.1973 OCc1cccc(c1)NCc2cscn2 270302a_100000211919_100000743575 [0,2,0,0,0,0|1,0,0]=3 17712 B16R2.1973 OCc1cccc(c1)NCc2cscn2 34a_100000211919_100000205941 [0,2,0,0,0,0|1,0,0]=3 17713 B16R2.1973 OCc1cccc(c1)NCc2ncc[nH]2 207a_100000211919_100000743867 [0,2,0,0,0,0|2,0,0]=4 17714 B16R2.1973 OCc1cccc(c1)NCc2ncc[nH]2 2230a_100000211919_100016991755 [0,2,0,0,0,0|2,0,0]=4 17715 B16R2.1973 OCc1cccc(c1)NCc2ncc[nH]2 34a_100000211919_100016991755 [0,2,0,0,0,0|2,0,0]=4 17716 B16R2.1973 OCc1cccc(c1)NCc2ncco2 2230a_100000211919_103436540062 [0,2,0,0,0,0|2,0,0]=4 17717 B16R2.1973 OCc1cccc(c1)NCc2ncco2 34a_100000211919_103436540062 [0,2,0,0,0,0|2,0,0]=4 17718 B16R2.1973 OCc1cccc(c1)NCc2nccs2 207a_100000211919_100000750902 [0,2,0,0,0,0|2,0,0]=4 17719 B16R2.1973 OCc1cccc(c1)NCc2nccs2 2230a_100000211919_100015184050 [0,2,0,0,0,0|2,0,0]=4 17720 B16R2.1973 OCc1cccc(c1)NCc2nccs2 270302a_100000211919_100000750902 [0,2,0,0,0,0|2,0,0]=4 17721 B16R2.1973 OCc1cccc(c1)NCc2nccs2 34a_100000211919_100015184050 [0,2,0,0,0,0|2,0,0]=4 17722 B16R2.1973 OCc1cccc(c1)NCc2ncon2 34a_100000211919_100000233494 [0,2,0,0,0,0|2,0,0]=4 17723 B16R2.1973 OCc1cccc(c1)NCn2cncn2 2230a_100000211919_200020645497 [0,2,0,0,0,0|1,0,1]=4 17724 B16R2.1973 OCc1cccc(c1)NCn2cncn2 34a_100000211919_200020645497 [0,2,0,0,0,0|1,0,1]=4 17725 B16R2.1973 OCc1cccc(c1)OCc2c[nH]cn2 34a_100011214949_100000707719 [0,2,0,0,0,0|1,0,0]=3 17726 B16R2.1973 OCc1cccc(c1)OCc2cscn2 34a_100011214949_100000205941 [0,2,0,0,0,0|2,0,0]=4 17727 B16R2.1973 OCc1cccc(c1)OCc2cscn2 7a_100011214949_100000205941 [0,2,0,0,0,0|2,0,0]=4 17728 B16R2.1973 OCc1cccc(c1)SCc2c[nH]cn2 62a_100000687537_100000707719 [0,2,0,0,0,0|1,0,0]=3 17729 B16R2.1973 OCc1cccc(c1)SCc2c[nH]cn2 62a_100000707719_100000687537 [0,2,0,0,0,0|1,0,0]=3 17730 B16R2.1973 OCc1cccc(c1)SCc2cscn2 62a_100000205941_100000687537 [0,2,0,0,0,0|2,0,0]=4 17731 B16R2.1973 OCc1cccc(c1)SCc2cscn2 62a_100000687537_100000205941 [0,2,0,0,0,0|2,0,0]=4 17732 B16R2.1973 OCc1cccc(n1)SCc2c[nH]cn2 62a_100000694195_100000707719 [0,2,0,0,0,0|2,0,0]=4 17733 B16R2.1973 OCc1cccc(n1)SCc2c[nH]cn2 62a_100000707719_100000694195 [0,2,0,0,0,0|2,0,0]=4 17734 B16R2.1973 OCc1ccnc(c1)SCc2c[nH]cn2 62a_100000707719_100009814636 [0,2,0,0,0,0|2,0,0]=4 17735 B16R2.1973 OCc1ccnc(c1)SCc2c[nH]cn2 62a_100009814636_100000707719 [0,2,0,0,0,0|2,0,0]=4 17736 B16R2.1973 OCc1cncc(c1)SCc2c[nH]cn2 62a_100000707719_100011259137 [0,2,0,0,0,0|2,0,0]=4 17737 B16R2.1973 OCc1cncc(c1)SCc2c[nH]cn2 62a_100011259137_100000707719 [0,2,0,0,0,0|2,0,0]=4 17738 B16R2.1973 OCc1cncc(n1)NCc2c[nH]cn2 27a_100000758547_100009853123 [0,2,0,0,0,0|2,0,0]=4 17739 B16R2.11351 Brc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100000756875_100011216082 [0,2,0,0,0,0|2,0,0]=4 17740 B16R2.11351 Brc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100011216082_100000756875 [0,2,0,0,0,0|2,0,0]=4 17741 B16R2.11351 Brc1cc(cc(c1)CSc2c[nH]cn2)I 62a_100000756875_100010146614 [0,2,0,0,0,0|2,0,0]=4 17742 B16R2.11351 Brc1cc(cc(c1)CSc2c[nH]cn2)I 62a_100010146614_100000756875 [0,2,0,0,0,0|2,0,0]=4 17743 B16R2.11351 Brc1cc(cc(c1)NCc2c[nH]cn2)Br 27a_100000758547_100009814770 [0,2,0,0,0,0|0,0,0]=2 17744 B16R2.11351 Brc1cc(cc(c1)NCc2c[nH]cn2)Br 34a_100012047176_100000707719 [0,2,0,0,0,0|0,0,0]=2 17745 B16R2.11351 Brc1cc(cc(c1)NCc2c[nH]nn2)Br 27a_100020620823_100009814770 [0,2,0,0,0,0|1,0,0]=3 17746 B16R2.11351 Brc1cc(cc(c1)NCc2cc[nH]n2)Br 207a_100012047176_100000738523 [0,2,0,0,0,0|2,0,0]=4 17747 B16R2.11351 Brc1cc(cc(c1)NCc2cc[nH]n2)Br 27a_100000739516_100009814770 [0,2,0,0,0,0|2,0,0]=4 17748 B16R2.11351 Brc1cc(cc(c1)NCc2cc[nH]n2)I 207a_100009814763_100000738523 [0,2,0,0,0,0|2,0,0]=4 17749 B16R2.11351 Brc1cc(cc(c1)NCc2ccco2)Br 207a_100012047176_100000186105 [0,2,0,0,0,0|2,0,0]=4 17750 B16R2.11351 Brc1cc(cc(c1)NCc2ccco2)Br 270302a_100012047176_100000186105 [0,2,0,0,0,0|2,0,0]=4 17751 B16R2.11351 Brc1cc(cc(c1)NCc2ccco2)Br 27a_100000185738_100009814770 [0,2,0,0,0,0|2,0,0]=4 17752 B16R2.11351 Brc1cc(cc(c1)NCc2ccco2)I 207a_100009814763_100000186105 [0,2,0,0,0,0|2,0,0]=4 17753 B16R2.11351 Brc1cc(cc(c1)NCc2ccco2)I 270302a_100009814763_100000186105 [0,2,0,0,0,0|2,0,0]=4 17754 B16R2.11351 Brc1cc(cc(c1)NCc2cccs2)Br 207a_100012047176_100000209959 [0,2,0,0,0,0|2,0,0]=4 17755 B16R2.11351 Brc1cc(cc(c1)NCc2cccs2)Br 270302a_100012047176_100000209959 [0,2,0,0,0,0|2,0,0]=4 17756 B16R2.11351 Brc1cc(cc(c1)NCc2cccs2)Br 27a_100000211653_100009814770 [0,2,0,0,0,0|2,0,0]=4 17757 B16R2.11351 Brc1cc(cc(c1)NCc2cccs2)I 207a_100009814763_100000209959 [0,2,0,0,0,0|2,0,0]=4 17758 B16R2.11351 Brc1cc(cc(c1)NCc2cccs2)I 270302a_100009814763_100000209959 [0,2,0,0,0,0|2,0,0]=4 17759 B16R2.11351 Brc1cc(cc(c1)NCc2ccoc2)Br 207a_100012047176_100011215517 [0,2,0,0,0,0|2,0,0]=4 17760 B16R2.11351 Brc1cc(cc(c1)NCc2ccoc2)Br 27a_100015206860_100009814770 [0,2,0,0,0,0|2,0,0]=4 17761 B16R2.11351 Brc1cc(cc(c1)NCc2ccoc2)I 207a_100009814763_100011215517 [0,2,0,0,0,0|2,0,0]=4 17762 B16R2.11351 Brc1cc(cc(c1)NCc2ccon2)Br 27a_100000688301_100009814770 [0,2,0,0,0,0|2,0,0]=4 17763 B16R2.11351 Brc1cc(cc(c1)NCc2ccon2)Br 34a_100012047176_100000234950 [0,2,0,0,0,0|2,0,0]=4 17764 B16R2.11351 Brc1cc(cc(c1)NCc2ccon2)Br 7a_100012047176_100000234950 [0,2,0,0,0,0|2,0,0]=4 17765 B16R2.11351 Brc1cc(cc(c1)NCc2ccon2)I 7a_100009814763_100000234950 [0,2,0,0,0,0|2,0,0]=4 17766 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)Br 207a_100012047176_100000188534 [0,2,0,0,0,0|2,0,0]=4 17767 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)Br 270302a_100012047176_100000188534 [0,2,0,0,0,0|2,0,0]=4 17768 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)Br 27a_100000186416_100009814770 [0,2,0,0,0,0|2,0,0]=4 17769 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)Br 34a_100012047176_100011261437 [0,2,0,0,0,0|2,0,0]=4 17770 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)Br 7a_100012047176_100011261437 [0,2,0,0,0,0|2,0,0]=4 17771 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)I 207a_100009814763_100000188534 [0,2,0,0,0,0|2,0,0]=4 17772 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)I 270302a_100009814763_100000188534 [0,2,0,0,0,0|2,0,0]=4 17773 B16R2.11351 Brc1cc(cc(c1)NCc2ccsc2)I 7a_100009814763_100011261437 [0,2,0,0,0,0|2,0,0]=4 17774 B16R2.11351 Brc1cc(cc(c1)NCc2cn[nH]c2)Br 207a_100012047176_100016992096 [0,2,0,0,0,0|2,0,0]=4 17775 B16R2.11351 Brc1cc(cc(c1)NCc2cn[nH]c2)Br 270302a_100012047176_100016992096 [0,2,0,0,0,0|2,0,0]=4 17776 B16R2.11351 Brc1cc(cc(c1)NCc2cn[nH]c2)Br 27a_100000737208_100009814770 [0,2,0,0,0,0|2,0,0]=4 17777 B16R2.11351 Brc1cc(cc(c1)NCc2cn[nH]c2)I 207a_100009814763_100016992096 [0,2,0,0,0,0|2,0,0]=4 17778 B16R2.11351 Brc1cc(cc(c1)NCc2cn[nH]c2)I 270302a_100009814763_100016992096 [0,2,0,0,0,0|2,0,0]=4 17779 B16R2.11351 Brc1cc(cc(c1)NCc2cnc[nH]2)Br 207a_100012047176_100000742939 [0,2,0,0,0,0|0,0,2]=4 17780 B16R2.11351 Brc1cc(cc(c1)NCc2cnc[nH]2)I 207a_100009814763_100000742939 [0,2,0,0,0,0|0,0,2]=4 17781 B16R2.11351 Brc1cc(cc(c1)NCc2cnco2)Br 27a_100020634212_100009814770 [0,2,0,0,0,0|1,0,1]=4 17782 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)Br 207a_100012047176_100000749870 [0,2,0,0,0,0|1,0,1]=4 17783 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)Br 270302a_100012047176_100000749870 [0,2,0,0,0,0|1,0,1]=4 17784 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)Br 27a_100016987365_100009814770 [0,2,0,0,0,0|1,0,1]=4 17785 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)Br 34a_100012047176_100015185245 [0,2,0,0,0,0|1,0,1]=4 17786 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)Br 7a_100012047176_100015185245 [0,2,0,0,0,0|1,0,1]=4 17787 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)I 207a_100009814763_100000749870 [0,2,0,0,0,0|1,0,1]=4 17788 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)I 270302a_100009814763_100000749870 [0,2,0,0,0,0|1,0,1]=4 17789 B16R2.11351 Brc1cc(cc(c1)NCc2cncs2)I 7a_100009814763_100015185245 [0,2,0,0,0,0|1,0,1]=4 17790 B16R2.11351 Brc1cc(cc(c1)NCc2cocn2)Br 27a_100015188801_100009814770 [0,2,0,0,0,0|1,0,0]=3 17791 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)Br 207a_100012047176_100000743575 [0,2,0,0,0,0|1,0,0]=3 17792 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)Br 270302a_100012047176_100000743575 [0,2,0,0,0,0|1,0,0]=3 17793 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)Br 27a_100015185402_100009814770 [0,2,0,0,0,0|1,0,0]=3 17794 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)Br 34a_100012047176_100000205941 [0,2,0,0,0,0|1,0,0]=3 17795 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)Br 7a_100012047176_100000205941 [0,2,0,0,0,0|1,0,0]=3 17796 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)I 207a_100009814763_100000743575 [0,2,0,0,0,0|1,0,0]=3 17797 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)I 270302a_100009814763_100000743575 [0,2,0,0,0,0|1,0,0]=3 17798 B16R2.11351 Brc1cc(cc(c1)NCc2cscn2)I 7a_100009814763_100000205941 [0,2,0,0,0,0|1,0,0]=3 17799 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)Br 207a_100012047176_100000743867 [0,2,0,0,0,0|2,0,0]=4 17800 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)Br 27a_100000754540_100009814770 [0,2,0,0,0,0|2,0,0]=4 17801 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)Br 34a_100012047176_100016991755 [0,2,0,0,0,0|2,0,0]=4 17802 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)Br 7a_100012047176_100000753453 [0,2,0,0,0,0|2,0,0]=4 17803 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)I 207a_100009814763_100000743867 [0,2,0,0,0,0|2,0,0]=4 17804 B16R2.11351 Brc1cc(cc(c1)NCc2ncc[nH]2)I 7a_100009814763_100000753453 [0,2,0,0,0,0|2,0,0]=4 17805 B16R2.11351 Brc1cc(cc(c1)NCc2ncco2)Br 27a_100016994969_100009814770 [0,2,0,0,0,0|2,0,0]=4 17806 B16R2.11351 Brc1cc(cc(c1)NCc2ncco2)Br 34a_100012047176_103436540062 [0,2,0,0,0,0|2,0,0]=4 17807 B16R2.11351 Brc1cc(cc(c1)NCc2ncco2)Br 7a_100012047176_103436540062 [0,2,0,0,0,0|2,0,0]=4 17808 B16R2.11351 Brc1cc(cc(c1)NCc2ncco2)I 7a_100009814763_103436540062 [0,2,0,0,0,0|2,0,0]=4 17809 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)Br 207a_100012047176_100000750902 [0,2,0,0,0,0|2,0,0]=4 17810 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)Br 270302a_100012047176_100000750902 [0,2,0,0,0,0|2,0,0]=4 17811 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)Br 27a_100000740555_100009814770 [0,2,0,0,0,0|2,0,0]=4 17812 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)Br 34a_100012047176_100015184050 [0,2,0,0,0,0|2,0,0]=4 17813 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)Br 7a_100012047176_100015184050 [0,2,0,0,0,0|2,0,0]=4 17814 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)I 207a_100009814763_100000750902 [0,2,0,0,0,0|2,0,0]=4 17815 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)I 270302a_100009814763_100000750902 [0,2,0,0,0,0|2,0,0]=4 17816 B16R2.11351 Brc1cc(cc(c1)NCc2nccs2)I 7a_100009814763_100015184050 [0,2,0,0,0,0|2,0,0]=4 17817 B16R2.11351 Brc1cc(cc(c1)NCc2ncon2)Br 34a_100012047176_100000233494 [0,2,0,0,0,0|2,0,0]=4 17818 B16R2.11351 Brc1cc(cc(c1)NCn2cncn2)Br 34a_100012047176_200020645497 [0,2,0,0,0,0|1,0,1]=4 17819 B16R2.11351 Brc1cc(cc(c1)NCn2cncn2)Br 7a_100012047176_200020645497 [0,2,0,0,0,0|1,0,1]=4 17820 B16R2.11351 Brc1cc(cc(c1)NCn2cncn2)I 7a_100009814763_200020645497 [0,2,0,0,0,0|1,0,1]=4 17821 B16R2.11351 Brc1cc(cc(c1)OCc2c[nH]cn2)Br 34a_100010167048_100000707719 [0,2,0,0,0,0|1,0,0]=3 17822 B16R2.11351 Brc1cc(cc(c1)OCc2c[nH]cn2)I 34a_100010068917_100000707719 [0,2,0,0,0,0|1,0,0]=3 17823 B16R2.11351 Brc1cc(cc(c1)OCc2cscn2)Br 34a_100010167048_100000205941 [0,2,0,0,0,0|2,0,0]=4 17824 B16R2.11351 Brc1cc(cc(c1)OCc2cscn2)Br 7a_100010167048_100000205941 [0,2,0,0,0,0|2,0,0]=4 17825 B16R2.11351 Brc1cc(cc(c1)OCc2cscn2)I 34a_100010068917_100000205941 [0,2,0,0,0,0|2,0,0]=4 17826 B16R2.11351 Brc1cc(cc(c1)OCc2cscn2)I 7a_100010068917_100000205941 [0,2,0,0,0,0|2,0,0]=4 17827 B16R2.11351 Brc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100000707719_100009814770 [0,2,0,0,0,0|1,0,0]=3 17828 B16R2.11351 Brc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100009814770_100000707719 [0,2,0,0,0,0|1,0,0]=3 17829 B16R2.11351 Brc1cc(cc(c1)SCc2cscn2)Br 62a_100000205941_100009814770 [0,2,0,0,0,0|2,0,0]=4 17830 B16R2.11351 Brc1cc(cc(c1)SCc2cscn2)Br 62a_100009814770_100000205941 [0,2,0,0,0,0|2,0,0]=4 17831 B16R2.11351 Brc1cc(cc(n1)Br)OCc2c[nH]cn2 34a_100010172823_100000707719 [0,2,0,0,0,0|2,0,0]=4 17832 B16R2.11351 Cc1cc(=O)cc(o1)OCc2c[nH]cn2 34a_100016989201_100000707719 [0,2,0,0,0,0|2,0,0]=4 17833 B16R2.11351 Cc1cc(cc(=O)[nH]1)NCc2c[nH]cn2 27a_100000758547_100009861981 [0,2,0,0,0,0|1,0,0]=3 17834 B16R2.11351 Cc1cc(cc(=O)[nH]1)NCc2c[nH]nn2 27a_100020620823_100009861981 [0,2,0,0,0,0|2,0,0]=4 17835 B16R2.11351 Cc1cc(cc(=O)[nH]1)NCc2cocn2 27a_100015188801_100009861981 [0,2,0,0,0,0|2,0,0]=4 17836 B16R2.11351 Cc1cc(cc(=O)[nH]1)NCc2cscn2 27a_100015185402_100009861981 [0,2,0,0,0,0|2,0,0]=4 17837 B16R2.11351 Cc1cc(cc(=O)[nH]1)OCc2c[nH]cn2 34a_100000039070_100000707719 [0,2,0,0,0,0|2,0,0]=4 17838 B16R2.11351 Cc1cc(cc(=O)[nH]1)SCc2c[nH]cn2 62a_100000707719_100009861981 [0,2,0,0,0,0|2,0,0]=4 17839 B16R2.11351 Cc1cc(cc(=O)[nH]1)SCc2c[nH]cn2 62a_100009861981_100000707719 [0,2,0,0,0,0|2,0,0]=4 17840 B16R2.11351 Cc1cc(cc(=O)o1)OCc2c[nH]cn2 34a_100000210952_100000707719 [0,2,0,0,0,0|2,0,0]=4 17841 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100000756875_100012348363 [0,2,0,0,0,0|2,0,0]=4 17842 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100012348363_100000756875 [0,2,0,0,0,0|2,0,0]=4 17843 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)C 62a_100000181317_100000756875 [0,2,0,0,0,0|2,0,0]=4 17844 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)C 62a_100000756875_100000181317 [0,2,0,0,0,0|2,0,0]=4 17845 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)F 62a_100000756875_100011219130 [0,2,0,0,0,0|2,0,0]=4 17846 B16R2.11351 Cc1cc(cc(c1)CSc2c[nH]cn2)F 62a_100011219130_100000756875 [0,2,0,0,0,0|2,0,0]=4 17847 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)Br 34a_100000695972_100000707719 [0,2,0,0,0,0|0,0,0]=2 17848 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)C 2230a_100000210930_100000707719 [0,2,0,0,0,0|0,0,0]=2 17849 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)C 34a_100000210930_100000707719 [0,2,0,0,0,0|0,0,0]=2 17850 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)Cl 2230a_100012022512_100000707719 [0,2,0,0,0,0|0,0,0]=2 17851 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)Cl 34a_100012022512_100000707719 [0,2,0,0,0,0|0,0,0]=2 17852 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)F 2230a_100000742734_100000707719 [0,2,0,0,0,0|0,0,0]=2 17853 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)F 34a_100000742734_100000707719 [0,2,0,0,0,0|0,0,0]=2 17854 B16R2.11351 Cc1cc(cc(c1)NCc2c[nH]cn2)O 34a_100011995906_100000707719 [0,2,0,0,0,0|0,0,0]=2 17855 B16R2.11351 Cc1cc(cc(c1)NCc2cc[nH]n2)Br 207a_100000695972_100000738523 [0,2,0,0,0,0|2,0,0]=4 17856 B16R2.11351 Cc1cc(cc(c1)NCc2cc[nH]n2)C 207a_100000210930_100000738523 [0,2,0,0,0,0|2,0,0]=4 17857 B16R2.11351 Cc1cc(cc(c1)NCc2cc[nH]n2)Cl 207a_100012022512_100000738523 [0,2,0,0,0,0|2,0,0]=4 17858 B16R2.11351 Cc1cc(cc(c1)NCc2cc[nH]n2)F 207a_100000742734_100000738523 [0,2,0,0,0,0|2,0,0]=4 17859 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)Br 207a_100000695972_100000186105 [0,2,0,0,0,0|2,0,0]=4 17860 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)Br 270302a_100000695972_100000186105 [0,2,0,0,0,0|2,0,0]=4 17861 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)C 207a_100000210930_100000186105 [0,2,0,0,0,0|2,0,0]=4 17862 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)C 270302a_100000210930_100000186105 [0,2,0,0,0,0|2,0,0]=4 17863 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)Cl 207a_100012022512_100000186105 [0,2,0,0,0,0|2,0,0]=4 17864 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)Cl 270302a_100012022512_100000186105 [0,2,0,0,0,0|2,0,0]=4 17865 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)F 207a_100000742734_100000186105 [0,2,0,0,0,0|2,0,0]=4 17866 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)F 270302a_100000742734_100000186105 [0,2,0,0,0,0|2,0,0]=4 17867 B16R2.11351 Cc1cc(cc(c1)NCc2ccco2)O 270302a_100011995906_100000186105 [0,2,0,0,0,0|2,0,0]=4 17868 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)Br 207a_100000695972_100000209959 [0,2,0,0,0,0|2,0,0]=4 17869 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)Br 270302a_100000695972_100000209959 [0,2,0,0,0,0|2,0,0]=4 17870 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)C 207a_100000210930_100000209959 [0,2,0,0,0,0|2,0,0]=4 17871 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)C 270302a_100000210930_100000209959 [0,2,0,0,0,0|2,0,0]=4 17872 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)Cl 207a_100012022512_100000209959 [0,2,0,0,0,0|2,0,0]=4 17873 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)Cl 270302a_100012022512_100000209959 [0,2,0,0,0,0|2,0,0]=4 17874 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)F 207a_100000742734_100000209959 [0,2,0,0,0,0|2,0,0]=4 17875 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)F 270302a_100000742734_100000209959 [0,2,0,0,0,0|2,0,0]=4 17876 B16R2.11351 Cc1cc(cc(c1)NCc2cccs2)O 270302a_100011995906_100000209959 [0,2,0,0,0,0|2,0,0]=4 17877 B16R2.11351 Cc1cc(cc(c1)NCc2ccoc2)Br 207a_100000695972_100011215517 [0,2,0,0,0,0|2,0,0]=4 17878 B16R2.11351 Cc1cc(cc(c1)NCc2ccoc2)C 207a_100000210930_100011215517 [0,2,0,0,0,0|2,0,0]=4 17879 B16R2.11351 Cc1cc(cc(c1)NCc2ccoc2)Cl 207a_100012022512_100011215517 [0,2,0,0,0,0|2,0,0]=4 17880 B16R2.11351 Cc1cc(cc(c1)NCc2ccoc2)F 207a_100000742734_100011215517 [0,2,0,0,0,0|2,0,0]=4 17881 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)Br 34a_100000695972_100000234950 [0,2,0,0,0,0|2,0,0]=4 17882 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)Br 7a_100000695972_100000234950 [0,2,0,0,0,0|2,0,0]=4 17883 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)C 2230a_100000210930_100000234950 [0,2,0,0,0,0|2,0,0]=4 17884 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)C 34a_100000210930_100000234950 [0,2,0,0,0,0|2,0,0]=4 17885 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)C 7a_100000210930_100000234950 [0,2,0,0,0,0|2,0,0]=4 17886 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)Cl 2230a_100012022512_100000234950 [0,2,0,0,0,0|2,0,0]=4 17887 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)Cl 34a_100012022512_100000234950 [0,2,0,0,0,0|2,0,0]=4 17888 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)Cl 7a_100012022512_100000234950 [0,2,0,0,0,0|2,0,0]=4 17889 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)F 2230a_100000742734_100000234950 [0,2,0,0,0,0|2,0,0]=4 17890 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)F 34a_100000742734_100000234950 [0,2,0,0,0,0|2,0,0]=4 17891 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)F 7a_100000742734_100000234950 [0,2,0,0,0,0|2,0,0]=4 17892 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)O 34a_100011995906_100000234950 [0,2,0,0,0,0|2,0,0]=4 17893 B16R2.11351 Cc1cc(cc(c1)NCc2ccon2)O 7a_100011995906_100000234950 [0,2,0,0,0,0|2,0,0]=4 17894 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Br 207a_100000695972_100000188534 [0,2,0,0,0,0|2,0,0]=4 17895 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Br 270302a_100000695972_100000188534 [0,2,0,0,0,0|2,0,0]=4 17896 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Br 34a_100000695972_100011261437 [0,2,0,0,0,0|2,0,0]=4 17897 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Br 7a_100000695972_100011261437 [0,2,0,0,0,0|2,0,0]=4 17898 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)C 207a_100000210930_100000188534 [0,2,0,0,0,0|2,0,0]=4 17899 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)C 2230a_100000210930_100011261437 [0,2,0,0,0,0|2,0,0]=4 17900 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)C 270302a_100000210930_100000188534 [0,2,0,0,0,0|2,0,0]=4 17901 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)C 34a_100000210930_100011261437 [0,2,0,0,0,0|2,0,0]=4 17902 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)C 7a_100000210930_100011261437 [0,2,0,0,0,0|2,0,0]=4 17903 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Cl 207a_100012022512_100000188534 [0,2,0,0,0,0|2,0,0]=4 17904 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Cl 2230a_100012022512_100011261437 [0,2,0,0,0,0|2,0,0]=4 17905 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Cl 270302a_100012022512_100000188534 [0,2,0,0,0,0|2,0,0]=4 17906 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Cl 34a_100012022512_100011261437 [0,2,0,0,0,0|2,0,0]=4 17907 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)Cl 7a_100012022512_100011261437 [0,2,0,0,0,0|2,0,0]=4 17908 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)F 207a_100000742734_100000188534 [0,2,0,0,0,0|2,0,0]=4 17909 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)F 2230a_100000742734_100011261437 [0,2,0,0,0,0|2,0,0]=4 17910 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)F 270302a_100000742734_100000188534 [0,2,0,0,0,0|2,0,0]=4 17911 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)F 34a_100000742734_100011261437 [0,2,0,0,0,0|2,0,0]=4 17912 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)F 7a_100000742734_100011261437 [0,2,0,0,0,0|2,0,0]=4 17913 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)O 270302a_100011995906_100000188534 [0,2,0,0,0,0|2,0,0]=4 17914 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)O 34a_100011995906_100011261437 [0,2,0,0,0,0|2,0,0]=4 17915 B16R2.11351 Cc1cc(cc(c1)NCc2ccsc2)O 7a_100011995906_100011261437 [0,2,0,0,0,0|2,0,0]=4 17916 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)Br 207a_100000695972_100016992096 [0,2,0,0,0,0|2,0,0]=4 17917 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)Br 270302a_100000695972_100016992096 [0,2,0,0,0,0|2,0,0]=4 17918 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)C 207a_100000210930_100016992096 [0,2,0,0,0,0|2,0,0]=4 17919 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)C 270302a_100000210930_100016992096 [0,2,0,0,0,0|2,0,0]=4 17920 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)Cl 207a_100012022512_100016992096 [0,2,0,0,0,0|2,0,0]=4 17921 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)Cl 270302a_100012022512_100016992096 [0,2,0,0,0,0|2,0,0]=4 17922 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)F 207a_100000742734_100016992096 [0,2,0,0,0,0|2,0,0]=4 17923 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)F 270302a_100000742734_100016992096 [0,2,0,0,0,0|2,0,0]=4 17924 B16R2.11351 Cc1cc(cc(c1)NCc2cn[nH]c2)O 270302a_100011995906_100016992096 [0,2,0,0,0,0|2,0,0]=4 17925 B16R2.11351 Cc1cc(cc(c1)NCc2cnc[nH]2)Br 207a_100000695972_100000742939 [0,2,0,0,0,0|0,0,2]=4 17926 B16R2.11351 Cc1cc(cc(c1)NCc2cnc[nH]2)C 207a_100000210930_100000742939 [0,2,0,0,0,0|0,0,2]=4 17927 B16R2.11351 Cc1cc(cc(c1)NCc2cnc[nH]2)Cl 207a_100012022512_100000742939 [0,2,0,0,0,0|0,0,2]=4 17928 B16R2.11351 Cc1cc(cc(c1)NCc2cnc[nH]2)F 207a_100000742734_100000742939 [0,2,0,0,0,0|0,0,2]=4 17929 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Br 207a_100000695972_100000749870 [0,2,0,0,0,0|1,0,1]=4 17930 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Br 270302a_100000695972_100000749870 [0,2,0,0,0,0|1,0,1]=4 17931 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Br 34a_100000695972_100015185245 [0,2,0,0,0,0|1,0,1]=4 17932 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Br 7a_100000695972_100015185245 [0,2,0,0,0,0|1,0,1]=4 17933 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)C 207a_100000210930_100000749870 [0,2,0,0,0,0|1,0,1]=4 17934 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)C 2230a_100000210930_100015185245 [0,2,0,0,0,0|1,0,1]=4 17935 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)C 270302a_100000210930_100000749870 [0,2,0,0,0,0|1,0,1]=4 17936 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)C 34a_100000210930_100015185245 [0,2,0,0,0,0|1,0,1]=4 17937 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)C 7a_100000210930_100015185245 [0,2,0,0,0,0|1,0,1]=4 17938 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Cl 207a_100012022512_100000749870 [0,2,0,0,0,0|1,0,1]=4 17939 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Cl 2230a_100012022512_100015185245 [0,2,0,0,0,0|1,0,1]=4 17940 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Cl 270302a_100012022512_100000749870 [0,2,0,0,0,0|1,0,1]=4 17941 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Cl 34a_100012022512_100015185245 [0,2,0,0,0,0|1,0,1]=4 17942 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)Cl 7a_100012022512_100015185245 [0,2,0,0,0,0|1,0,1]=4 17943 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)F 207a_100000742734_100000749870 [0,2,0,0,0,0|1,0,1]=4 17944 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)F 2230a_100000742734_100015185245 [0,2,0,0,0,0|1,0,1]=4 17945 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)F 270302a_100000742734_100000749870 [0,2,0,0,0,0|1,0,1]=4 17946 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)F 34a_100000742734_100015185245 [0,2,0,0,0,0|1,0,1]=4 17947 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)F 7a_100000742734_100015185245 [0,2,0,0,0,0|1,0,1]=4 17948 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)O 270302a_100011995906_100000749870 [0,2,0,0,0,0|1,0,1]=4 17949 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)O 34a_100011995906_100015185245 [0,2,0,0,0,0|1,0,1]=4 17950 B16R2.11351 Cc1cc(cc(c1)NCc2cncs2)O 7a_100011995906_100015185245 [0,2,0,0,0,0|1,0,1]=4 17951 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Br 207a_100000695972_100000743575 [0,2,0,0,0,0|1,0,0]=3 17952 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Br 270302a_100000695972_100000743575 [0,2,0,0,0,0|1,0,0]=3 17953 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Br 34a_100000695972_100000205941 [0,2,0,0,0,0|1,0,0]=3 17954 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Br 7a_100000695972_100000205941 [0,2,0,0,0,0|1,0,0]=3 17955 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)C 207a_100000210930_100000743575 [0,2,0,0,0,0|1,0,0]=3 17956 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)C 2230a_100000210930_100000205941 [0,2,0,0,0,0|1,0,0]=3 17957 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)C 270302a_100000210930_100000743575 [0,2,0,0,0,0|1,0,0]=3 17958 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)C 34a_100000210930_100000205941 [0,2,0,0,0,0|1,0,0]=3 17959 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)C 7a_100000210930_100000205941 [0,2,0,0,0,0|1,0,0]=3 17960 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Cl 207a_100012022512_100000743575 [0,2,0,0,0,0|1,0,0]=3 17961 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Cl 2230a_100012022512_100000205941 [0,2,0,0,0,0|1,0,0]=3 17962 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Cl 270302a_100012022512_100000743575 [0,2,0,0,0,0|1,0,0]=3 17963 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Cl 34a_100012022512_100000205941 [0,2,0,0,0,0|1,0,0]=3 17964 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)Cl 7a_100012022512_100000205941 [0,2,0,0,0,0|1,0,0]=3 17965 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)F 207a_100000742734_100000743575 [0,2,0,0,0,0|1,0,0]=3 17966 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)F 2230a_100000742734_100000205941 [0,2,0,0,0,0|1,0,0]=3 17967 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)F 270302a_100000742734_100000743575 [0,2,0,0,0,0|1,0,0]=3 17968 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)F 34a_100000742734_100000205941 [0,2,0,0,0,0|1,0,0]=3 17969 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)F 7a_100000742734_100000205941 [0,2,0,0,0,0|1,0,0]=3 17970 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)O 270302a_100011995906_100000743575 [0,2,0,0,0,0|1,0,0]=3 17971 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)O 34a_100011995906_100000205941 [0,2,0,0,0,0|1,0,0]=3 17972 B16R2.11351 Cc1cc(cc(c1)NCc2cscn2)O 7a_100011995906_100000205941 [0,2,0,0,0,0|1,0,0]=3 17973 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Br 207a_100000695972_100000743867 [0,2,0,0,0,0|2,0,0]=4 17974 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Br 34a_100000695972_100016991755 [0,2,0,0,0,0|2,0,0]=4 17975 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Br 7a_100000695972_100000753453 [0,2,0,0,0,0|2,0,0]=4 17976 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)C 207a_100000210930_100000743867 [0,2,0,0,0,0|2,0,0]=4 17977 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)C 2230a_100000210930_100016991755 [0,2,0,0,0,0|2,0,0]=4 17978 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)C 34a_100000210930_100016991755 [0,2,0,0,0,0|2,0,0]=4 17979 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)C 7a_100000210930_100000753453 [0,2,0,0,0,0|2,0,0]=4 17980 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Cl 207a_100012022512_100000743867 [0,2,0,0,0,0|2,0,0]=4 17981 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Cl 2230a_100012022512_100016991755 [0,2,0,0,0,0|2,0,0]=4 17982 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Cl 34a_100012022512_100016991755 [0,2,0,0,0,0|2,0,0]=4 17983 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)Cl 7a_100012022512_100000753453 [0,2,0,0,0,0|2,0,0]=4 17984 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)F 207a_100000742734_100000743867 [0,2,0,0,0,0|2,0,0]=4 17985 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)F 2230a_100000742734_100016991755 [0,2,0,0,0,0|2,0,0]=4 17986 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)F 34a_100000742734_100016991755 [0,2,0,0,0,0|2,0,0]=4 17987 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)F 7a_100000742734_100000753453 [0,2,0,0,0,0|2,0,0]=4 17988 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)O 34a_100011995906_100016991755 [0,2,0,0,0,0|2,0,0]=4 17989 B16R2.11351 Cc1cc(cc(c1)NCc2ncc[nH]2)O 7a_100011995906_100000753453 [0,2,0,0,0,0|2,0,0]=4 17990 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)Br 34a_100000695972_103436540062 [0,2,0,0,0,0|2,0,0]=4 17991 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)Br 7a_100000695972_103436540062 [0,2,0,0,0,0|2,0,0]=4 17992 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)C 2230a_100000210930_103436540062 [0,2,0,0,0,0|2,0,0]=4 17993 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)C 34a_100000210930_103436540062 [0,2,0,0,0,0|2,0,0]=4 17994 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)C 7a_100000210930_103436540062 [0,2,0,0,0,0|2,0,0]=4 17995 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)Cl 2230a_100012022512_103436540062 [0,2,0,0,0,0|2,0,0]=4 17996 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)Cl 34a_100012022512_103436540062 [0,2,0,0,0,0|2,0,0]=4 17997 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)Cl 7a_100012022512_103436540062 [0,2,0,0,0,0|2,0,0]=4 17998 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)F 2230a_100000742734_103436540062 [0,2,0,0,0,0|2,0,0]=4 17999 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)F 34a_100000742734_103436540062 [0,2,0,0,0,0|2,0,0]=4 18000 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)F 7a_100000742734_103436540062 [0,2,0,0,0,0|2,0,0]=4 18001 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)O 34a_100011995906_103436540062 [0,2,0,0,0,0|2,0,0]=4 18002 B16R2.11351 Cc1cc(cc(c1)NCc2ncco2)O 7a_100011995906_103436540062 [0,2,0,0,0,0|2,0,0]=4 18003 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Br 207a_100000695972_100000750902 [0,2,0,0,0,0|2,0,0]=4 18004 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Br 270302a_100000695972_100000750902 [0,2,0,0,0,0|2,0,0]=4 18005 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Br 34a_100000695972_100015184050 [0,2,0,0,0,0|2,0,0]=4 18006 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Br 7a_100000695972_100015184050 [0,2,0,0,0,0|2,0,0]=4 18007 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)C 207a_100000210930_100000750902 [0,2,0,0,0,0|2,0,0]=4 18008 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)C 2230a_100000210930_100015184050 [0,2,0,0,0,0|2,0,0]=4 18009 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)C 270302a_100000210930_100000750902 [0,2,0,0,0,0|2,0,0]=4 18010 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)C 34a_100000210930_100015184050 [0,2,0,0,0,0|2,0,0]=4 18011 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)C 7a_100000210930_100015184050 [0,2,0,0,0,0|2,0,0]=4 18012 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Cl 207a_100012022512_100000750902 [0,2,0,0,0,0|2,0,0]=4 18013 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Cl 2230a_100012022512_100015184050 [0,2,0,0,0,0|2,0,0]=4 18014 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Cl 270302a_100012022512_100000750902 [0,2,0,0,0,0|2,0,0]=4 18015 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Cl 34a_100012022512_100015184050 [0,2,0,0,0,0|2,0,0]=4 18016 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)Cl 7a_100012022512_100015184050 [0,2,0,0,0,0|2,0,0]=4 18017 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)F 207a_100000742734_100000750902 [0,2,0,0,0,0|2,0,0]=4 18018 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)F 2230a_100000742734_100015184050 [0,2,0,0,0,0|2,0,0]=4 18019 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)F 270302a_100000742734_100000750902 [0,2,0,0,0,0|2,0,0]=4 18020 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)F 34a_100000742734_100015184050 [0,2,0,0,0,0|2,0,0]=4 18021 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)F 7a_100000742734_100015184050 [0,2,0,0,0,0|2,0,0]=4 18022 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)O 270302a_100011995906_100000750902 [0,2,0,0,0,0|2,0,0]=4 18023 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)O 34a_100011995906_100015184050 [0,2,0,0,0,0|2,0,0]=4 18024 B16R2.11351 Cc1cc(cc(c1)NCc2nccs2)O 7a_100011995906_100015184050 [0,2,0,0,0,0|2,0,0]=4 18025 B16R2.11351 Cc1cc(cc(c1)NCc2ncon2)Br 34a_100000695972_100000233494 [0,2,0,0,0,0|2,0,0]=4 18026 B16R2.11351 Cc1cc(cc(c1)NCc2ncon2)C 34a_100000210930_100000233494 [0,2,0,0,0,0|2,0,0]=4 18027 B16R2.11351 Cc1cc(cc(c1)NCc2ncon2)Cl 34a_100012022512_100000233494 [0,2,0,0,0,0|2,0,0]=4 18028 B16R2.11351 Cc1cc(cc(c1)NCc2ncon2)F 34a_100000742734_100000233494 [0,2,0,0,0,0|2,0,0]=4 18029 B16R2.11351 Cc1cc(cc(c1)NCc2ncon2)O 34a_100011995906_100000233494 [0,2,0,0,0,0|2,0,0]=4 18030 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)Br 34a_100000695972_200020645497 [0,2,0,0,0,0|1,0,1]=4 18031 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)Br 7a_100000695972_200020645497 [0,2,0,0,0,0|1,0,1]=4 18032 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)C 2230a_100000210930_200020645497 [0,2,0,0,0,0|1,0,1]=4 18033 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)C 34a_100000210930_200020645497 [0,2,0,0,0,0|1,0,1]=4 18034 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)C 7a_100000210930_200020645497 [0,2,0,0,0,0|1,0,1]=4 18035 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)Cl 2230a_100012022512_200020645497 [0,2,0,0,0,0|1,0,1]=4 18036 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)Cl 34a_100012022512_200020645497 [0,2,0,0,0,0|1,0,1]=4 18037 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)Cl 7a_100012022512_200020645497 [0,2,0,0,0,0|1,0,1]=4 18038 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)F 2230a_100000742734_200020645497 [0,2,0,0,0,0|1,0,1]=4 18039 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)F 34a_100000742734_200020645497 [0,2,0,0,0,0|1,0,1]=4 18040 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)F 7a_100000742734_200020645497 [0,2,0,0,0,0|1,0,1]=4 18041 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)O 34a_100011995906_200020645497 [0,2,0,0,0,0|1,0,1]=4 18042 B16R2.11351 Cc1cc(cc(c1)NCn2cncn2)O 7a_100011995906_200020645497 [0,2,0,0,0,0|1,0,1]=4 18043 B16R2.11351 Cc1cc(cc(c1)OCc2c[nH]cn2)Br 34a_100011999630_100000707719 [0,2,0,0,0,0|1,0,0]=3 18044 B16R2.11351 Cc1cc(cc(c1)OCc2c[nH]cn2)C 34a_100000210933_100000707719 [0,2,0,0,0,0|1,0,0]=3 18045 B16R2.11351 Cc1cc(cc(c1)OCc2c[nH]cn2)Cl 34a_100000087485_100000707719 [0,2,0,0,0,0|1,0,0]=3 18046 B16R2.11351 Cc1cc(cc(c1)OCc2c[nH]cn2)F 34a_100011830401_100000707719 [0,2,0,0,0,0|1,0,0]=3 18047 B16R2.11351 Cc1cc(cc(c1)OCc2c[nH]cn2)N 34a_100011995906_100000707719 [0,2,0,0,0,0|1,0,0]=3 18048 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)Br 34a_100011999630_100000205941 [0,2,0,0,0,0|2,0,0]=4 18049 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)Br 7a_100011999630_100000205941 [0,2,0,0,0,0|2,0,0]=4 18050 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)C 34a_100000210933_100000205941 [0,2,0,0,0,0|2,0,0]=4 18051 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)C 7a_100000210933_100000205941 [0,2,0,0,0,0|2,0,0]=4 18052 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)Cl 34a_100000087485_100000205941 [0,2,0,0,0,0|2,0,0]=4 18053 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)Cl 7a_100000087485_100000205941 [0,2,0,0,0,0|2,0,0]=4 18054 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)F 34a_100011830401_100000205941 [0,2,0,0,0,0|2,0,0]=4 18055 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)F 7a_100011830401_100000205941 [0,2,0,0,0,0|2,0,0]=4 18056 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)N 34a_100011995906_100000205941 [0,2,0,0,0,0|2,0,0]=4 18057 B16R2.11351 Cc1cc(cc(c1)OCc2cscn2)N 7a_100011995906_100000205941 [0,2,0,0,0,0|2,0,0]=4 18058 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)C 62a_100000707719_100011215608 [0,2,0,0,0,0|1,0,0]=3 18059 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)C 62a_100011215608_100000707719 [0,2,0,0,0,0|1,0,0]=3 18060 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100010172791 [0,2,0,0,0,0|1,0,0]=3 18061 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100010172791_100000707719 [0,2,0,0,0,0|1,0,0]=3 18062 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000707719_100011356977 [0,2,0,0,0,0|1,0,0]=3 18063 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100011356977_100000707719 [0,2,0,0,0,0|1,0,0]=3 18064 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)N 62a_100000695972_100000707719 [0,2,0,0,0,0|1,0,0]=3 18065 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)N 62a_100000707719_100000695972 [0,2,0,0,0,0|1,0,0]=3 18066 B16R2.11351 Cc1cc(cc(c1)SCc2c[nH]cn2)O 62a_100000707719_100011999630 [0,2,0,0,0,0|1,0,0]=3 18067 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)C 62a_100000205941_100011215608 [0,2,0,0,0,0|2,0,0]=4 18068 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)C 62a_100011215608_100000205941 [0,2,0,0,0,0|2,0,0]=4 18069 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)Cl 62a_100000205941_100010172791 [0,2,0,0,0,0|2,0,0]=4 18070 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)Cl 62a_100010172791_100000205941 [0,2,0,0,0,0|2,0,0]=4 18071 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)F 62a_100000205941_100011356977 [0,2,0,0,0,0|2,0,0]=4 18072 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)F 62a_100011356977_100000205941 [0,2,0,0,0,0|2,0,0]=4 18073 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)N 62a_100000205941_100000695972 [0,2,0,0,0,0|2,0,0]=4 18074 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)N 62a_100000695972_100000205941 [0,2,0,0,0,0|2,0,0]=4 18075 B16R2.11351 Cc1cc(cc(c1)SCc2cscn2)O 62a_100000205941_100011999630 [0,2,0,0,0,0|2,0,0]=4 18076 B16R2.11351 Cc1cc(cc(n1)C)NCc2c[nH]cn2 27a_100000758547_100000066820 [0,2,0,0,0,0|1,0,0]=3 18077 B16R2.11351 Cc1cc(cc(n1)C)NCc2c[nH]nn2 27a_100020620823_100000066820 [0,2,0,0,0,0|2,0,0]=4 18078 B16R2.11351 Cc1cc(cc(n1)C)NCc2cocn2 27a_100015188801_100000066820 [0,2,0,0,0,0|2,0,0]=4 18079 B16R2.11351 Cc1cc(cc(n1)C)NCc2cscn2 27a_100015185402_100000066820 [0,2,0,0,0,0|2,0,0]=4 18080 B16R2.11351 Cc1cc(cc(n1)C)SCc2c[nH]cn2 62a_100000066820_100000707719 [0,2,0,0,0,0|2,0,0]=4 18081 B16R2.11351 Cc1cc(cc(n1)C)SCc2c[nH]cn2 62a_100000707719_100000066820 [0,2,0,0,0,0|2,0,0]=4 18082 B16R2.11351 Cc1cc(cc(n1)Cl)NCc2c[nH]cn2 27a_100000758547_100010068023 [0,2,0,0,0,0|1,0,0]=3 18083 B16R2.11351 Cc1cc(cc(n1)Cl)NCc2c[nH]nn2 27a_100020620823_100010068023 [0,2,0,0,0,0|2,0,0]=4 18084 B16R2.11351 Cc1cc(cc(n1)Cl)NCc2cocn2 27a_100015188801_100010068023 [0,2,0,0,0,0|2,0,0]=4 18085 B16R2.11351 Cc1cc(cc(n1)Cl)NCc2cscn2 27a_100015185402_100010068023 [0,2,0,0,0,0|2,0,0]=4 18086 B16R2.11351 Cc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100000707719_100010068023 [0,2,0,0,0,0|2,0,0]=4 18087 B16R2.11351 Cc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100010068023_100000707719 [0,2,0,0,0,0|2,0,0]=4 18088 B16R2.11351 Cc1cc(cc(n1)F)NCc2c[nH]cn2 27a_100000758547_100010006595 [0,2,0,0,0,0|1,0,0]=3 18089 B16R2.11351 Cc1cc(cc(n1)F)NCc2c[nH]nn2 27a_100020620823_100010006595 [0,2,0,0,0,0|2,0,0]=4 18090 B16R2.11351 Cc1cc(cc(n1)F)NCc2cocn2 27a_100015188801_100010006595 [0,2,0,0,0,0|2,0,0]=4 18091 B16R2.11351 Cc1cc(cc(n1)F)NCc2cscn2 27a_100015185402_100010006595 [0,2,0,0,0,0|2,0,0]=4 18092 B16R2.11351 Cc1cc(cc(n1)F)SCc2c[nH]cn2 62a_100000707719_100010006595 [0,2,0,0,0,0|2,0,0]=4 18093 B16R2.11351 Cc1cc(cc(n1)F)SCc2c[nH]cn2 62a_100010006595_100000707719 [0,2,0,0,0,0|2,0,0]=4 18094 B16R2.11351 Cc1cc(cc(n1)N)SCc2c[nH]cn2 62a_100000076705_100000707719 [0,2,0,0,0,0|2,0,0]=4 18095 B16R2.11351 Cc1cc(cc(n1)N)SCc2c[nH]cn2 62a_100000707719_100000076705 [0,2,0,0,0,0|2,0,0]=4 18096 B16R2.11351 Cc1cc(cc(n1)SCc2c[nH]cn2)N 62a_100000071261_100000707719 [0,2,0,0,0,0|2,0,0]=4 18097 B16R2.11351 Cc1cc(cc(n1)SCc2c[nH]cn2)N 62a_100000707719_100000071261 [0,2,0,0,0,0|2,0,0]=4 18098 B16R2.11351 Cc1cc(nc(c1)NCc2c[nH]cn2)C 27a_100000758547_100000069240 [0,2,0,0,0,0|1,0,0]=3 18099 B16R2.11351 Cc1cc(nc(c1)NCc2c[nH]cn2)F 27a_100000758547_100009819601 [0,2,0,0,0,0|1,0,0]=3 18100 B16R2.11351 Cc1cc(nc(c1)NCc2c[nH]nn2)C 27a_100020620823_100000069240 [0,2,0,0,0,0|2,0,0]=4 18101 B16R2.11351 Cc1cc(nc(c1)NCc2c[nH]nn2)F 27a_100020620823_100009819601 [0,2,0,0,0,0|2,0,0]=4 18102 B16R2.11351 Cc1cc(nc(c1)NCc2cocn2)C 27a_100015188801_100000069240 [0,2,0,0,0,0|2,0,0]=4 18103 B16R2.11351 Cc1cc(nc(c1)NCc2cocn2)F 27a_100015188801_100009819601 [0,2,0,0,0,0|2,0,0]=4 18104 B16R2.11351 Cc1cc(nc(c1)NCc2cscn2)C 27a_100015185402_100000069240 [0,2,0,0,0,0|2,0,0]=4 18105 B16R2.11351 Cc1cc(nc(c1)NCc2cscn2)F 27a_100015185402_100009819601 [0,2,0,0,0,0|2,0,0]=4 18106 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)C 62a_100000069240_100000707719 [0,2,0,0,0,0|2,0,0]=4 18107 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)C 62a_100000707719_100000069240 [0,2,0,0,0,0|2,0,0]=4 18108 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)F 62a_100000707719_100009819601 [0,2,0,0,0,0|2,0,0]=4 18109 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)F 62a_100009819601_100000707719 [0,2,0,0,0,0|2,0,0]=4 18110 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)N 62a_100000707719_100009819863 [0,2,0,0,0,0|2,0,0]=4 18111 B16R2.11351 Cc1cc(nc(c1)SCc2c[nH]cn2)N 62a_100009819863_100000707719 [0,2,0,0,0,0|2,0,0]=4 18112 B16R2.11351 Cc1cc(nc(n1)C)NCc2c[nH]cn2 27a_100000758547_100000736142 [0,2,0,0,0,0|2,0,0]=4 18113 B16R2.11351 Cc1cc(nc(n1)N)NCc2c[nH]cn2 27a_100000758547_100000183061 [0,2,0,0,0,0|2,0,0]=4 18114 B16R2.11351 Cc1cc(nc(n1)NCc2c[nH]cn2)C 27a_100000758547_100000736147 [0,2,0,0,0,0|2,0,0]=4 18115 B16R2.11351 Cc1cc(nc(n1)NCc2c[nH]cn2)N 27a_100000758547_100000687285 [0,2,0,0,0,0|2,0,0]=4 18116 B16R2.11351 Cc1nc(cc(n1)NCc2c[nH]cn2)N 27a_100000758547_100000761517 [0,2,0,0,0,0|2,0,0]=4 18117 B16R2.11351 Cc1nc(cc(n1)NCc2c[nH]cn2)O 27a_100000758547_106741647437 [0,2,0,0,0,0|2,0,0]=4 18118 B16R2.11351 Clc1cc(cc(c1)CSc2c[nH]cn2)Cl 62a_100000756875_100011219208 [0,2,0,0,0,0|2,0,0]=4 18119 B16R2.11351 Clc1cc(cc(c1)CSc2c[nH]cn2)Cl 62a_100011219208_100000756875 [0,2,0,0,0,0|2,0,0]=4 18120 B16R2.11351 Clc1cc(cc(c1)NCc2c[nH]cn2)Br 34a_100011934539_100000707719 [0,2,0,0,0,0|0,0,0]=2 18121 B16R2.11351 Clc1cc(cc(c1)NCc2c[nH]cn2)Cl 34a_100000210456_100000707719 [0,2,0,0,0,0|0,0,0]=2 18122 B16R2.11351 Clc1cc(cc(c1)NCc2cc[nH]n2)Br 207a_100011934539_100000738523 [0,2,0,0,0,0|2,0,0]=4 18123 B16R2.11351 Clc1cc(cc(c1)NCc2cc[nH]n2)Cl 207a_100000210456_100000738523 [0,2,0,0,0,0|2,0,0]=4 18124 B16R2.11351 Clc1cc(cc(c1)NCc2cc[nH]n2)I 207a_100010147676_100000738523 [0,2,0,0,0,0|2,0,0]=4 18125 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)Br 207a_100011934539_100000186105 [0,2,0,0,0,0|2,0,0]=4 18126 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)Br 270302a_100011934539_100000186105 [0,2,0,0,0,0|2,0,0]=4 18127 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)Cl 207a_100000210456_100000186105 [0,2,0,0,0,0|2,0,0]=4 18128 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)Cl 270302a_100000210456_100000186105 [0,2,0,0,0,0|2,0,0]=4 18129 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)I 207a_100010147676_100000186105 [0,2,0,0,0,0|2,0,0]=4 18130 B16R2.11351 Clc1cc(cc(c1)NCc2ccco2)I 270302a_100010147676_100000186105 [0,2,0,0,0,0|2,0,0]=4 18131 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)Br 207a_100011934539_100000209959 [0,2,0,0,0,0|2,0,0]=4 18132 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)Br 270302a_100011934539_100000209959 [0,2,0,0,0,0|2,0,0]=4 18133 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)Cl 207a_100000210456_100000209959 [0,2,0,0,0,0|2,0,0]=4 18134 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)Cl 270302a_100000210456_100000209959 [0,2,0,0,0,0|2,0,0]=4 18135 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)I 207a_100010147676_100000209959 [0,2,0,0,0,0|2,0,0]=4 18136 B16R2.11351 Clc1cc(cc(c1)NCc2cccs2)I 270302a_100010147676_100000209959 [0,2,0,0,0,0|2,0,0]=4 18137 B16R2.11351 Clc1cc(cc(c1)NCc2ccoc2)Br 207a_100011934539_100011215517 [0,2,0,0,0,0|2,0,0]=4 18138 B16R2.11351 Clc1cc(cc(c1)NCc2ccoc2)Cl 207a_100000210456_100011215517 [0,2,0,0,0,0|2,0,0]=4 18139 B16R2.11351 Clc1cc(cc(c1)NCc2ccoc2)I 207a_100010147676_100011215517 [0,2,0,0,0,0|2,0,0]=4 18140 B16R2.11351 Clc1cc(cc(c1)NCc2ccon2)Br 34a_100011934539_100000234950 [0,2,0,0,0,0|2,0,0]=4 18141 B16R2.11351 Clc1cc(cc(c1)NCc2ccon2)Br 7a_100011934539_100000234950 [0,2,0,0,0,0|2,0,0]=4 18142 B16R2.11351 Clc1cc(cc(c1)NCc2ccon2)Cl 34a_100000210456_100000234950 [0,2,0,0,0,0|2,0,0]=4 18143 B16R2.11351 Clc1cc(cc(c1)NCc2ccon2)Cl 7a_100000210456_100000234950 [0,2,0,0,0,0|2,0,0]=4 18144 B16R2.11351 Clc1cc(cc(c1)NCc2ccon2)I 7a_100010147676_100000234950 [0,2,0,0,0,0|2,0,0]=4 18145 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Br 207a_100011934539_100000188534 [0,2,0,0,0,0|2,0,0]=4 18146 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Br 270302a_100011934539_100000188534 [0,2,0,0,0,0|2,0,0]=4 18147 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Br 34a_100011934539_100011261437 [0,2,0,0,0,0|2,0,0]=4 18148 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Br 7a_100011934539_100011261437 [0,2,0,0,0,0|2,0,0]=4 18149 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Cl 207a_100000210456_100000188534 [0,2,0,0,0,0|2,0,0]=4 18150 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Cl 270302a_100000210456_100000188534 [0,2,0,0,0,0|2,0,0]=4 18151 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Cl 34a_100000210456_100011261437 [0,2,0,0,0,0|2,0,0]=4 18152 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)Cl 7a_100000210456_100011261437 [0,2,0,0,0,0|2,0,0]=4 18153 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)I 207a_100010147676_100000188534 [0,2,0,0,0,0|2,0,0]=4 18154 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)I 270302a_100010147676_100000188534 [0,2,0,0,0,0|2,0,0]=4 18155 B16R2.11351 Clc1cc(cc(c1)NCc2ccsc2)I 7a_100010147676_100011261437 [0,2,0,0,0,0|2,0,0]=4 18156 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)Br 207a_100011934539_100016992096 [0,2,0,0,0,0|2,0,0]=4 18157 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)Br 270302a_100011934539_100016992096 [0,2,0,0,0,0|2,0,0]=4 18158 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)Cl 207a_100000210456_100016992096 [0,2,0,0,0,0|2,0,0]=4 18159 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)Cl 270302a_100000210456_100016992096 [0,2,0,0,0,0|2,0,0]=4 18160 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)I 207a_100010147676_100016992096 [0,2,0,0,0,0|2,0,0]=4 18161 B16R2.11351 Clc1cc(cc(c1)NCc2cn[nH]c2)I 270302a_100010147676_100016992096 [0,2,0,0,0,0|2,0,0]=4 18162 B16R2.11351 Clc1cc(cc(c1)NCc2cnc[nH]2)Br 207a_100011934539_100000742939 [0,2,0,0,0,0|0,0,2]=4 18163 B16R2.11351 Clc1cc(cc(c1)NCc2cnc[nH]2)Cl 207a_100000210456_100000742939 [0,2,0,0,0,0|0,0,2]=4 18164 B16R2.11351 Clc1cc(cc(c1)NCc2cnc[nH]2)I 207a_100010147676_100000742939 [0,2,0,0,0,0|0,0,2]=4 18165 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Br 207a_100011934539_100000749870 [0,2,0,0,0,0|1,0,1]=4 18166 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Br 270302a_100011934539_100000749870 [0,2,0,0,0,0|1,0,1]=4 18167 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Br 34a_100011934539_100015185245 [0,2,0,0,0,0|1,0,1]=4 18168 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Br 7a_100011934539_100015185245 [0,2,0,0,0,0|1,0,1]=4 18169 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Cl 207a_100000210456_100000749870 [0,2,0,0,0,0|1,0,1]=4 18170 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Cl 270302a_100000210456_100000749870 [0,2,0,0,0,0|1,0,1]=4 18171 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Cl 34a_100000210456_100015185245 [0,2,0,0,0,0|1,0,1]=4 18172 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)Cl 7a_100000210456_100015185245 [0,2,0,0,0,0|1,0,1]=4 18173 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)I 207a_100010147676_100000749870 [0,2,0,0,0,0|1,0,1]=4 18174 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)I 270302a_100010147676_100000749870 [0,2,0,0,0,0|1,0,1]=4 18175 B16R2.11351 Clc1cc(cc(c1)NCc2cncs2)I 7a_100010147676_100015185245 [0,2,0,0,0,0|1,0,1]=4 18176 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Br 207a_100011934539_100000743575 [0,2,0,0,0,0|1,0,0]=3 18177 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Br 270302a_100011934539_100000743575 [0,2,0,0,0,0|1,0,0]=3 18178 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Br 34a_100011934539_100000205941 [0,2,0,0,0,0|1,0,0]=3 18179 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Br 7a_100011934539_100000205941 [0,2,0,0,0,0|1,0,0]=3 18180 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Cl 207a_100000210456_100000743575 [0,2,0,0,0,0|1,0,0]=3 18181 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Cl 270302a_100000210456_100000743575 [0,2,0,0,0,0|1,0,0]=3 18182 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Cl 34a_100000210456_100000205941 [0,2,0,0,0,0|1,0,0]=3 18183 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)Cl 7a_100000210456_100000205941 [0,2,0,0,0,0|1,0,0]=3 18184 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)I 207a_100010147676_100000743575 [0,2,0,0,0,0|1,0,0]=3 18185 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)I 270302a_100010147676_100000743575 [0,2,0,0,0,0|1,0,0]=3 18186 B16R2.11351 Clc1cc(cc(c1)NCc2cscn2)I 7a_100010147676_100000205941 [0,2,0,0,0,0|1,0,0]=3 18187 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Br 207a_100011934539_100000743867 [0,2,0,0,0,0|2,0,0]=4 18188 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Br 34a_100011934539_100016991755 [0,2,0,0,0,0|2,0,0]=4 18189 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Br 7a_100011934539_100000753453 [0,2,0,0,0,0|2,0,0]=4 18190 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Cl 207a_100000210456_100000743867 [0,2,0,0,0,0|2,0,0]=4 18191 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Cl 34a_100000210456_100016991755 [0,2,0,0,0,0|2,0,0]=4 18192 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)Cl 7a_100000210456_100000753453 [0,2,0,0,0,0|2,0,0]=4 18193 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)I 207a_100010147676_100000743867 [0,2,0,0,0,0|2,0,0]=4 18194 B16R2.11351 Clc1cc(cc(c1)NCc2ncc[nH]2)I 7a_100010147676_100000753453 [0,2,0,0,0,0|2,0,0]=4 18195 B16R2.11351 Clc1cc(cc(c1)NCc2ncco2)Br 34a_100011934539_103436540062 [0,2,0,0,0,0|2,0,0]=4 18196 B16R2.11351 Clc1cc(cc(c1)NCc2ncco2)Br 7a_100011934539_103436540062 [0,2,0,0,0,0|2,0,0]=4 18197 B16R2.11351 Clc1cc(cc(c1)NCc2ncco2)Cl 34a_100000210456_103436540062 [0,2,0,0,0,0|2,0,0]=4 18198 B16R2.11351 Clc1cc(cc(c1)NCc2ncco2)Cl 7a_100000210456_103436540062 [0,2,0,0,0,0|2,0,0]=4 18199 B16R2.11351 Clc1cc(cc(c1)NCc2ncco2)I 7a_100010147676_103436540062 [0,2,0,0,0,0|2,0,0]=4 18200 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Br 207a_100011934539_100000750902 [0,2,0,0,0,0|2,0,0]=4 18201 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Br 270302a_100011934539_100000750902 [0,2,0,0,0,0|2,0,0]=4 18202 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Br 34a_100011934539_100015184050 [0,2,0,0,0,0|2,0,0]=4 18203 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Br 7a_100011934539_100015184050 [0,2,0,0,0,0|2,0,0]=4 18204 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Cl 207a_100000210456_100000750902 [0,2,0,0,0,0|2,0,0]=4 18205 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Cl 270302a_100000210456_100000750902 [0,2,0,0,0,0|2,0,0]=4 18206 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Cl 34a_100000210456_100015184050 [0,2,0,0,0,0|2,0,0]=4 18207 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)Cl 7a_100000210456_100015184050 [0,2,0,0,0,0|2,0,0]=4 18208 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)I 207a_100010147676_100000750902 [0,2,0,0,0,0|2,0,0]=4 18209 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)I 270302a_100010147676_100000750902 [0,2,0,0,0,0|2,0,0]=4 18210 B16R2.11351 Clc1cc(cc(c1)NCc2nccs2)I 7a_100010147676_100015184050 [0,2,0,0,0,0|2,0,0]=4 18211 B16R2.11351 Clc1cc(cc(c1)NCc2ncon2)Br 34a_100011934539_100000233494 [0,2,0,0,0,0|2,0,0]=4 18212 B16R2.11351 Clc1cc(cc(c1)NCc2ncon2)Cl 34a_100000210456_100000233494 [0,2,0,0,0,0|2,0,0]=4 18213 B16R2.11351 Clc1cc(cc(c1)NCn2cncn2)Br 34a_100011934539_200020645497 [0,2,0,0,0,0|1,0,1]=4 18214 B16R2.11351 Clc1cc(cc(c1)NCn2cncn2)Br 7a_100011934539_200020645497 [0,2,0,0,0,0|1,0,1]=4 18215 B16R2.11351 Clc1cc(cc(c1)NCn2cncn2)Cl 34a_100000210456_200020645497 [0,2,0,0,0,0|1,0,1]=4 18216 B16R2.11351 Clc1cc(cc(c1)NCn2cncn2)Cl 7a_100000210456_200020645497 [0,2,0,0,0,0|1,0,1]=4 18217 B16R2.11351 Clc1cc(cc(c1)NCn2cncn2)I 7a_100010147676_200020645497 [0,2,0,0,0,0|1,0,1]=4 18218 B16R2.11351 Clc1cc(cc(c1)OCc2c[nH]cn2)Br 34a_100010185897_100000707719 [0,2,0,0,0,0|1,0,0]=3 18219 B16R2.11351 Clc1cc(cc(c1)OCc2c[nH]cn2)Cl 34a_100000181315_100000707719 [0,2,0,0,0,0|1,0,0]=3 18220 B16R2.11351 Clc1cc(cc(c1)OCc2c[nH]cn2)I 34a_100010068924_100000707719 [0,2,0,0,0,0|1,0,0]=3 18221 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)Br 34a_100010185897_100000205941 [0,2,0,0,0,0|2,0,0]=4 18222 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)Br 7a_100010185897_100000205941 [0,2,0,0,0,0|2,0,0]=4 18223 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)Cl 34a_100000181315_100000205941 [0,2,0,0,0,0|2,0,0]=4 18224 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)Cl 7a_100000181315_100000205941 [0,2,0,0,0,0|2,0,0]=4 18225 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)I 34a_100010068924_100000205941 [0,2,0,0,0,0|2,0,0]=4 18226 B16R2.11351 Clc1cc(cc(c1)OCc2cscn2)I 7a_100010068924_100000205941 [0,2,0,0,0,0|2,0,0]=4 18227 B16R2.11351 Clc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100000707719_100009814755 [0,2,0,0,0,0|1,0,0]=3 18228 B16R2.11351 Clc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100009814755_100000707719 [0,2,0,0,0,0|1,0,0]=3 18229 B16R2.11351 Clc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100000747138 [0,2,0,0,0,0|1,0,0]=3 18230 B16R2.11351 Clc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000747138_100000707719 [0,2,0,0,0,0|1,0,0]=3 18231 B16R2.11351 Clc1cc(cc(c1)SCc2cscn2)Br 62a_100000205941_100009814755 [0,2,0,0,0,0|2,0,0]=4 18232 B16R2.11351 Clc1cc(cc(c1)SCc2cscn2)Br 62a_100009814755_100000205941 [0,2,0,0,0,0|2,0,0]=4 18233 B16R2.11351 Clc1cc(cc(c1)SCc2cscn2)Cl 62a_100000205941_100000747138 [0,2,0,0,0,0|2,0,0]=4 18234 B16R2.11351 Clc1cc(cc(c1)SCc2cscn2)Cl 62a_100000747138_100000205941 [0,2,0,0,0,0|2,0,0]=4 18235 B16R2.11351 Clc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100000062418_100000707719 [0,2,0,0,0,0|2,0,0]=4 18236 B16R2.11351 Clc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100000707719_100000062418 [0,2,0,0,0,0|2,0,0]=4 18237 B16R2.11351 Fc1cc(cc(c1)C=Cc2c[nH]cn2)F 271570a_100102527693_100000756875 [0,2,0,0,0,0|1,0,1]=4 18238 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100000756875_100000766940 [0,2,0,0,0,0|2,0,0]=4 18239 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)Br 62a_100000766940_100000756875 [0,2,0,0,0,0|2,0,0]=4 18240 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)Cl 62a_100000756875_100011219885 [0,2,0,0,0,0|2,0,0]=4 18241 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)Cl 62a_100011219885_100000756875 [0,2,0,0,0,0|2,0,0]=4 18242 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)F 62a_100000697002_100000756875 [0,2,0,0,0,0|2,0,0]=4 18243 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)F 62a_100000756875_100000697002 [0,2,0,0,0,0|2,0,0]=4 18244 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)I 62a_100000756875_100010149605 [0,2,0,0,0,0|2,0,0]=4 18245 B16R2.11351 Fc1cc(cc(c1)CSc2c[nH]cn2)I 62a_100010149605_100000756875 [0,2,0,0,0,0|2,0,0]=4 18246 B16R2.11351 Fc1cc(cc(c1)NCc2c[nH]cn2)Br 34a_100000705686_100000707719 [0,2,0,0,0,0|0,0,0]=2 18247 B16R2.11351 Fc1cc(cc(c1)NCc2c[nH]cn2)Cl 34a_100000686136_100000707719 [0,2,0,0,0,0|0,0,0]=2 18248 B16R2.11351 Fc1cc(cc(c1)NCc2c[nH]cn2)F 34a_100000233717_100000707719 [0,2,0,0,0,0|0,0,0]=2 18249 B16R2.11351 Fc1cc(cc(c1)NCc2c[nH]cn2)I 34a_100011356972_100000707719 [0,2,0,0,0,0|0,0,0]=2 18250 B16R2.11351 Fc1cc(cc(c1)NCc2cc[nH]n2)Br 207a_100000705686_100000738523 [0,2,0,0,0,0|2,0,0]=4 18251 B16R2.11351 Fc1cc(cc(c1)NCc2cc[nH]n2)Cl 207a_100000686136_100000738523 [0,2,0,0,0,0|2,0,0]=4 18252 B16R2.11351 Fc1cc(cc(c1)NCc2cc[nH]n2)F 207a_100000233717_100000738523 [0,2,0,0,0,0|2,0,0]=4 18253 B16R2.11351 Fc1cc(cc(c1)NCc2cc[nH]n2)I 207a_100011356972_100000738523 [0,2,0,0,0,0|2,0,0]=4 18254 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)Br 207a_100000705686_100000186105 [0,2,0,0,0,0|2,0,0]=4 18255 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)Br 270302a_100000705686_100000186105 [0,2,0,0,0,0|2,0,0]=4 18256 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)Cl 207a_100000686136_100000186105 [0,2,0,0,0,0|2,0,0]=4 18257 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)Cl 270302a_100000686136_100000186105 [0,2,0,0,0,0|2,0,0]=4 18258 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)F 207a_100000233717_100000186105 [0,2,0,0,0,0|2,0,0]=4 18259 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)F 270302a_100000233717_100000186105 [0,2,0,0,0,0|2,0,0]=4 18260 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)I 207a_100011356972_100000186105 [0,2,0,0,0,0|2,0,0]=4 18261 B16R2.11351 Fc1cc(cc(c1)NCc2ccco2)I 270302a_100011356972_100000186105 [0,2,0,0,0,0|2,0,0]=4 18262 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)Br 207a_100000705686_100000209959 [0,2,0,0,0,0|2,0,0]=4 18263 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)Br 270302a_100000705686_100000209959 [0,2,0,0,0,0|2,0,0]=4 18264 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)Cl 207a_100000686136_100000209959 [0,2,0,0,0,0|2,0,0]=4 18265 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)Cl 270302a_100000686136_100000209959 [0,2,0,0,0,0|2,0,0]=4 18266 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)F 207a_100000233717_100000209959 [0,2,0,0,0,0|2,0,0]=4 18267 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)F 270302a_100000233717_100000209959 [0,2,0,0,0,0|2,0,0]=4 18268 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)I 207a_100011356972_100000209959 [0,2,0,0,0,0|2,0,0]=4 18269 B16R2.11351 Fc1cc(cc(c1)NCc2cccs2)I 270302a_100011356972_100000209959 [0,2,0,0,0,0|2,0,0]=4 18270 B16R2.11351 Fc1cc(cc(c1)NCc2ccoc2)Br 207a_100000705686_100011215517 [0,2,0,0,0,0|2,0,0]=4 18271 B16R2.11351 Fc1cc(cc(c1)NCc2ccoc2)Cl 207a_100000686136_100011215517 [0,2,0,0,0,0|2,0,0]=4 18272 B16R2.11351 Fc1cc(cc(c1)NCc2ccoc2)F 207a_100000233717_100011215517 [0,2,0,0,0,0|2,0,0]=4 18273 B16R2.11351 Fc1cc(cc(c1)NCc2ccoc2)I 207a_100011356972_100011215517 [0,2,0,0,0,0|2,0,0]=4 18274 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)Br 34a_100000705686_100000234950 [0,2,0,0,0,0|2,0,0]=4 18275 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)Br 7a_100000705686_100000234950 [0,2,0,0,0,0|2,0,0]=4 18276 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)Cl 34a_100000686136_100000234950 [0,2,0,0,0,0|2,0,0]=4 18277 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)Cl 7a_100000686136_100000234950 [0,2,0,0,0,0|2,0,0]=4 18278 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)F 34a_100000233717_100000234950 [0,2,0,0,0,0|2,0,0]=4 18279 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)F 7a_100000233717_100000234950 [0,2,0,0,0,0|2,0,0]=4 18280 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)I 34a_100011356972_100000234950 [0,2,0,0,0,0|2,0,0]=4 18281 B16R2.11351 Fc1cc(cc(c1)NCc2ccon2)I 7a_100011356972_100000234950 [0,2,0,0,0,0|2,0,0]=4 18282 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Br 207a_100000705686_100000188534 [0,2,0,0,0,0|2,0,0]=4 18283 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Br 270302a_100000705686_100000188534 [0,2,0,0,0,0|2,0,0]=4 18284 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Br 34a_100000705686_100011261437 [0,2,0,0,0,0|2,0,0]=4 18285 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Br 7a_100000705686_100011261437 [0,2,0,0,0,0|2,0,0]=4 18286 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Cl 207a_100000686136_100000188534 [0,2,0,0,0,0|2,0,0]=4 18287 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Cl 270302a_100000686136_100000188534 [0,2,0,0,0,0|2,0,0]=4 18288 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Cl 34a_100000686136_100011261437 [0,2,0,0,0,0|2,0,0]=4 18289 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)Cl 7a_100000686136_100011261437 [0,2,0,0,0,0|2,0,0]=4 18290 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)F 207a_100000233717_100000188534 [0,2,0,0,0,0|2,0,0]=4 18291 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)F 270302a_100000233717_100000188534 [0,2,0,0,0,0|2,0,0]=4 18292 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)F 34a_100000233717_100011261437 [0,2,0,0,0,0|2,0,0]=4 18293 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)F 7a_100000233717_100011261437 [0,2,0,0,0,0|2,0,0]=4 18294 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)I 207a_100011356972_100000188534 [0,2,0,0,0,0|2,0,0]=4 18295 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)I 270302a_100011356972_100000188534 [0,2,0,0,0,0|2,0,0]=4 18296 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)I 34a_100011356972_100011261437 [0,2,0,0,0,0|2,0,0]=4 18297 B16R2.11351 Fc1cc(cc(c1)NCc2ccsc2)I 7a_100011356972_100011261437 [0,2,0,0,0,0|2,0,0]=4 18298 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)Br 207a_100000705686_100016992096 [0,2,0,0,0,0|2,0,0]=4 18299 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)Br 270302a_100000705686_100016992096 [0,2,0,0,0,0|2,0,0]=4 18300 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)Cl 207a_100000686136_100016992096 [0,2,0,0,0,0|2,0,0]=4 18301 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)Cl 270302a_100000686136_100016992096 [0,2,0,0,0,0|2,0,0]=4 18302 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)F 207a_100000233717_100016992096 [0,2,0,0,0,0|2,0,0]=4 18303 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)F 270302a_100000233717_100016992096 [0,2,0,0,0,0|2,0,0]=4 18304 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)I 207a_100011356972_100016992096 [0,2,0,0,0,0|2,0,0]=4 18305 B16R2.11351 Fc1cc(cc(c1)NCc2cn[nH]c2)I 270302a_100011356972_100016992096 [0,2,0,0,0,0|2,0,0]=4 18306 B16R2.11351 Fc1cc(cc(c1)NCc2cnc[nH]2)Br 207a_100000705686_100000742939 [0,2,0,0,0,0|0,0,2]=4 18307 B16R2.11351 Fc1cc(cc(c1)NCc2cnc[nH]2)Cl 207a_100000686136_100000742939 [0,2,0,0,0,0|0,0,2]=4 18308 B16R2.11351 Fc1cc(cc(c1)NCc2cnc[nH]2)F 207a_100000233717_100000742939 [0,2,0,0,0,0|0,0,2]=4 18309 B16R2.11351 Fc1cc(cc(c1)NCc2cnc[nH]2)I 207a_100011356972_100000742939 [0,2,0,0,0,0|0,0,2]=4 18310 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Br 207a_100000705686_100000749870 [0,2,0,0,0,0|1,0,1]=4 18311 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Br 270302a_100000705686_100000749870 [0,2,0,0,0,0|1,0,1]=4 18312 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Br 34a_100000705686_100015185245 [0,2,0,0,0,0|1,0,1]=4 18313 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Br 7a_100000705686_100015185245 [0,2,0,0,0,0|1,0,1]=4 18314 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Cl 207a_100000686136_100000749870 [0,2,0,0,0,0|1,0,1]=4 18315 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Cl 270302a_100000686136_100000749870 [0,2,0,0,0,0|1,0,1]=4 18316 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Cl 34a_100000686136_100015185245 [0,2,0,0,0,0|1,0,1]=4 18317 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)Cl 7a_100000686136_100015185245 [0,2,0,0,0,0|1,0,1]=4 18318 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)F 207a_100000233717_100000749870 [0,2,0,0,0,0|1,0,1]=4 18319 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)F 270302a_100000233717_100000749870 [0,2,0,0,0,0|1,0,1]=4 18320 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)F 34a_100000233717_100015185245 [0,2,0,0,0,0|1,0,1]=4 18321 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)F 7a_100000233717_100015185245 [0,2,0,0,0,0|1,0,1]=4 18322 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)I 207a_100011356972_100000749870 [0,2,0,0,0,0|1,0,1]=4 18323 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)I 270302a_100011356972_100000749870 [0,2,0,0,0,0|1,0,1]=4 18324 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)I 34a_100011356972_100015185245 [0,2,0,0,0,0|1,0,1]=4 18325 B16R2.11351 Fc1cc(cc(c1)NCc2cncs2)I 7a_100011356972_100015185245 [0,2,0,0,0,0|1,0,1]=4 18326 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Br 207a_100000705686_100000743575 [0,2,0,0,0,0|1,0,0]=3 18327 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Br 270302a_100000705686_100000743575 [0,2,0,0,0,0|1,0,0]=3 18328 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Br 34a_100000705686_100000205941 [0,2,0,0,0,0|1,0,0]=3 18329 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Br 7a_100000705686_100000205941 [0,2,0,0,0,0|1,0,0]=3 18330 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Cl 207a_100000686136_100000743575 [0,2,0,0,0,0|1,0,0]=3 18331 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Cl 270302a_100000686136_100000743575 [0,2,0,0,0,0|1,0,0]=3 18332 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Cl 34a_100000686136_100000205941 [0,2,0,0,0,0|1,0,0]=3 18333 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)Cl 7a_100000686136_100000205941 [0,2,0,0,0,0|1,0,0]=3 18334 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)F 207a_100000233717_100000743575 [0,2,0,0,0,0|1,0,0]=3 18335 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)F 270302a_100000233717_100000743575 [0,2,0,0,0,0|1,0,0]=3 18336 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)F 34a_100000233717_100000205941 [0,2,0,0,0,0|1,0,0]=3 18337 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)F 7a_100000233717_100000205941 [0,2,0,0,0,0|1,0,0]=3 18338 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)I 207a_100011356972_100000743575 [0,2,0,0,0,0|1,0,0]=3 18339 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)I 270302a_100011356972_100000743575 [0,2,0,0,0,0|1,0,0]=3 18340 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)I 34a_100011356972_100000205941 [0,2,0,0,0,0|1,0,0]=3 18341 B16R2.11351 Fc1cc(cc(c1)NCc2cscn2)I 7a_100011356972_100000205941 [0,2,0,0,0,0|1,0,0]=3 18342 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Br 207a_100000705686_100000743867 [0,2,0,0,0,0|2,0,0]=4 18343 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Br 34a_100000705686_100016991755 [0,2,0,0,0,0|2,0,0]=4 18344 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Br 7a_100000705686_100000753453 [0,2,0,0,0,0|2,0,0]=4 18345 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Cl 207a_100000686136_100000743867 [0,2,0,0,0,0|2,0,0]=4 18346 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Cl 34a_100000686136_100016991755 [0,2,0,0,0,0|2,0,0]=4 18347 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)Cl 7a_100000686136_100000753453 [0,2,0,0,0,0|2,0,0]=4 18348 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)F 207a_100000233717_100000743867 [0,2,0,0,0,0|2,0,0]=4 18349 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)F 34a_100000233717_100016991755 [0,2,0,0,0,0|2,0,0]=4 18350 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)F 7a_100000233717_100000753453 [0,2,0,0,0,0|2,0,0]=4 18351 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)I 207a_100011356972_100000743867 [0,2,0,0,0,0|2,0,0]=4 18352 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)I 34a_100011356972_100016991755 [0,2,0,0,0,0|2,0,0]=4 18353 B16R2.11351 Fc1cc(cc(c1)NCc2ncc[nH]2)I 7a_100011356972_100000753453 [0,2,0,0,0,0|2,0,0]=4 18354 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)Br 34a_100000705686_103436540062 [0,2,0,0,0,0|2,0,0]=4 18355 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)Br 7a_100000705686_103436540062 [0,2,0,0,0,0|2,0,0]=4 18356 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)Cl 34a_100000686136_103436540062 [0,2,0,0,0,0|2,0,0]=4 18357 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)Cl 7a_100000686136_103436540062 [0,2,0,0,0,0|2,0,0]=4 18358 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)F 34a_100000233717_103436540062 [0,2,0,0,0,0|2,0,0]=4 18359 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)F 7a_100000233717_103436540062 [0,2,0,0,0,0|2,0,0]=4 18360 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)I 34a_100011356972_103436540062 [0,2,0,0,0,0|2,0,0]=4 18361 B16R2.11351 Fc1cc(cc(c1)NCc2ncco2)I 7a_100011356972_103436540062 [0,2,0,0,0,0|2,0,0]=4 18362 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Br 207a_100000705686_100000750902 [0,2,0,0,0,0|2,0,0]=4 18363 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Br 270302a_100000705686_100000750902 [0,2,0,0,0,0|2,0,0]=4 18364 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Br 34a_100000705686_100015184050 [0,2,0,0,0,0|2,0,0]=4 18365 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Br 7a_100000705686_100015184050 [0,2,0,0,0,0|2,0,0]=4 18366 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Cl 207a_100000686136_100000750902 [0,2,0,0,0,0|2,0,0]=4 18367 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Cl 270302a_100000686136_100000750902 [0,2,0,0,0,0|2,0,0]=4 18368 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Cl 34a_100000686136_100015184050 [0,2,0,0,0,0|2,0,0]=4 18369 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)Cl 7a_100000686136_100015184050 [0,2,0,0,0,0|2,0,0]=4 18370 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)F 207a_100000233717_100000750902 [0,2,0,0,0,0|2,0,0]=4 18371 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)F 270302a_100000233717_100000750902 [0,2,0,0,0,0|2,0,0]=4 18372 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)F 34a_100000233717_100015184050 [0,2,0,0,0,0|2,0,0]=4 18373 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)F 7a_100000233717_100015184050 [0,2,0,0,0,0|2,0,0]=4 18374 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)I 207a_100011356972_100000750902 [0,2,0,0,0,0|2,0,0]=4 18375 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)I 270302a_100011356972_100000750902 [0,2,0,0,0,0|2,0,0]=4 18376 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)I 34a_100011356972_100015184050 [0,2,0,0,0,0|2,0,0]=4 18377 B16R2.11351 Fc1cc(cc(c1)NCc2nccs2)I 7a_100011356972_100015184050 [0,2,0,0,0,0|2,0,0]=4 18378 B16R2.11351 Fc1cc(cc(c1)NCc2ncon2)Br 34a_100000705686_100000233494 [0,2,0,0,0,0|2,0,0]=4 18379 B16R2.11351 Fc1cc(cc(c1)NCc2ncon2)Cl 34a_100000686136_100000233494 [0,2,0,0,0,0|2,0,0]=4 18380 B16R2.11351 Fc1cc(cc(c1)NCc2ncon2)F 34a_100000233717_100000233494 [0,2,0,0,0,0|2,0,0]=4 18381 B16R2.11351 Fc1cc(cc(c1)NCc2ncon2)I 34a_100011356972_100000233494 [0,2,0,0,0,0|2,0,0]=4 18382 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)Br 34a_100000705686_200020645497 [0,2,0,0,0,0|1,0,1]=4 18383 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)Br 7a_100000705686_200020645497 [0,2,0,0,0,0|1,0,1]=4 18384 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)Cl 34a_100000686136_200020645497 [0,2,0,0,0,0|1,0,1]=4 18385 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)Cl 7a_100000686136_200020645497 [0,2,0,0,0,0|1,0,1]=4 18386 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)F 34a_100000233717_200020645497 [0,2,0,0,0,0|1,0,1]=4 18387 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)F 7a_100000233717_200020645497 [0,2,0,0,0,0|1,0,1]=4 18388 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)I 34a_100011356972_200020645497 [0,2,0,0,0,0|1,0,1]=4 18389 B16R2.11351 Fc1cc(cc(c1)NCn2cncn2)I 7a_100011356972_200020645497 [0,2,0,0,0,0|1,0,1]=4 18390 B16R2.11351 Fc1cc(cc(c1)OCc2c[nH]cn2)Br 34a_100000688818_100000707719 [0,2,0,0,0,0|1,0,0]=3 18391 B16R2.11351 Fc1cc(cc(c1)OCc2c[nH]cn2)Cl 34a_100011219751_100000707719 [0,2,0,0,0,0|1,0,0]=3 18392 B16R2.11351 Fc1cc(cc(c1)OCc2c[nH]cn2)F 34a_100000747503_100000707719 [0,2,0,0,0,0|1,0,0]=3 18393 B16R2.11351 Fc1cc(cc(c1)OCc2c[nH]cn2)I 34a_100000717995_100000707719 [0,2,0,0,0,0|1,0,0]=3 18394 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)Br 34a_100000688818_100000205941 [0,2,0,0,0,0|2,0,0]=4 18395 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)Br 7a_100000688818_100000205941 [0,2,0,0,0,0|2,0,0]=4 18396 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)Cl 34a_100011219751_100000205941 [0,2,0,0,0,0|2,0,0]=4 18397 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)Cl 7a_100011219751_100000205941 [0,2,0,0,0,0|2,0,0]=4 18398 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)F 34a_100000747503_100000205941 [0,2,0,0,0,0|2,0,0]=4 18399 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)F 7a_100000747503_100000205941 [0,2,0,0,0,0|2,0,0]=4 18400 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)I 34a_100000717995_100000205941 [0,2,0,0,0,0|2,0,0]=4 18401 B16R2.11351 Fc1cc(cc(c1)OCc2cscn2)I 7a_100000717995_100000205941 [0,2,0,0,0,0|2,0,0]=4 18402 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100000707719_100009814764 [0,2,0,0,0,0|1,0,0]=3 18403 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100009814764_100000707719 [0,2,0,0,0,0|1,0,0]=3 18404 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100013859453 [0,2,0,0,0,0|1,0,0]=3 18405 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100013859453_100000707719 [0,2,0,0,0,0|1,0,0]=3 18406 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000233788_100000707719 [0,2,0,0,0,0|1,0,0]=3 18407 B16R2.11351 Fc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000707719_100000233788 [0,2,0,0,0,0|1,0,0]=3 18408 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)Br 62a_100000205941_100009814764 [0,2,0,0,0,0|2,0,0]=4 18409 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)Br 62a_100009814764_100000205941 [0,2,0,0,0,0|2,0,0]=4 18410 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)Cl 62a_100000205941_100013859453 [0,2,0,0,0,0|2,0,0]=4 18411 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)Cl 62a_100013859453_100000205941 [0,2,0,0,0,0|2,0,0]=4 18412 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)F 62a_100000205941_100000233788 [0,2,0,0,0,0|2,0,0]=4 18413 B16R2.11351 Fc1cc(cc(c1)SCc2cscn2)F 62a_100000233788_100000205941 [0,2,0,0,0,0|2,0,0]=4 18414 B16R2.11351 Fc1cc(cc(n1)Cl)NCc2c[nH]cn2 27a_100000758547_100011069727 [0,2,0,0,0,0|1,0,0]=3 18415 B16R2.11351 Fc1cc(cc(n1)Cl)NCc2c[nH]nn2 27a_100020620823_100011069727 [0,2,0,0,0,0|2,0,0]=4 18416 B16R2.11351 Fc1cc(cc(n1)Cl)NCc2cocn2 27a_100015188801_100011069727 [0,2,0,0,0,0|2,0,0]=4 18417 B16R2.11351 Fc1cc(cc(n1)Cl)NCc2cscn2 27a_100015185402_100011069727 [0,2,0,0,0,0|2,0,0]=4 18418 B16R2.11351 Fc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100000707719_100011069727 [0,2,0,0,0,0|2,0,0]=4 18419 B16R2.11351 Fc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100011069727_100000707719 [0,2,0,0,0,0|2,0,0]=4 18420 B16R2.11351 Fc1cc(cc(n1)F)NCc2c[nH]cn2 27a_100000758547_100000049587 [0,2,0,0,0,0|1,0,0]=3 18421 B16R2.11351 Fc1cc(cc(n1)F)NCc2c[nH]nn2 27a_100020620823_100000049587 [0,2,0,0,0,0|2,0,0]=4 18422 B16R2.11351 Fc1cc(cc(n1)F)NCc2cocn2 27a_100015188801_100000049587 [0,2,0,0,0,0|2,0,0]=4 18423 B16R2.11351 Fc1cc(cc(n1)F)NCc2cscn2 27a_100015185402_100000049587 [0,2,0,0,0,0|2,0,0]=4 18424 B16R2.11351 Fc1cc(cc(n1)F)SCc2c[nH]cn2 62a_100000049587_100000707719 [0,2,0,0,0,0|2,0,0]=4 18425 B16R2.11351 Fc1cc(cc(n1)F)SCc2c[nH]cn2 62a_100000707719_100000049587 [0,2,0,0,0,0|2,0,0]=4 18426 B16R2.11351 Ic1cc(cc(c1)NCc2cc[nH]n2)I 207a_200000696836_100000738523 [0,2,0,0,0,0|2,0,0]=4 18427 B16R2.11351 Ic1cc(cc(c1)NCc2ccco2)I 207a_200000696836_100000186105 [0,2,0,0,0,0|2,0,0]=4 18428 B16R2.11351 Ic1cc(cc(c1)NCc2ccco2)I 270302a_200000696836_100000186105 [0,2,0,0,0,0|2,0,0]=4 18429 B16R2.11351 Ic1cc(cc(c1)NCc2cccs2)I 207a_200000696836_100000209959 [0,2,0,0,0,0|2,0,0]=4 18430 B16R2.11351 Ic1cc(cc(c1)NCc2cccs2)I 270302a_200000696836_100000209959 [0,2,0,0,0,0|2,0,0]=4 18431 B16R2.11351 Ic1cc(cc(c1)NCc2ccoc2)I 207a_200000696836_100011215517 [0,2,0,0,0,0|2,0,0]=4 18432 B16R2.11351 Ic1cc(cc(c1)NCc2ccon2)I 7a_200000696836_100000234950 [0,2,0,0,0,0|2,0,0]=4 18433 B16R2.11351 Ic1cc(cc(c1)NCc2ccsc2)I 207a_200000696836_100000188534 [0,2,0,0,0,0|2,0,0]=4 18434 B16R2.11351 Ic1cc(cc(c1)NCc2ccsc2)I 270302a_200000696836_100000188534 [0,2,0,0,0,0|2,0,0]=4 18435 B16R2.11351 Ic1cc(cc(c1)NCc2ccsc2)I 7a_200000696836_100011261437 [0,2,0,0,0,0|2,0,0]=4 18436 B16R2.11351 Ic1cc(cc(c1)NCc2cn[nH]c2)I 207a_200000696836_100016992096 [0,2,0,0,0,0|2,0,0]=4 18437 B16R2.11351 Ic1cc(cc(c1)NCc2cn[nH]c2)I 270302a_200000696836_100016992096 [0,2,0,0,0,0|2,0,0]=4 18438 B16R2.11351 Ic1cc(cc(c1)NCc2cnc[nH]2)I 207a_200000696836_100000742939 [0,2,0,0,0,0|0,0,2]=4 18439 B16R2.11351 Ic1cc(cc(c1)NCc2cncs2)I 207a_200000696836_100000749870 [0,2,0,0,0,0|1,0,1]=4 18440 B16R2.11351 Ic1cc(cc(c1)NCc2cncs2)I 270302a_200000696836_100000749870 [0,2,0,0,0,0|1,0,1]=4 18441 B16R2.11351 Ic1cc(cc(c1)NCc2cncs2)I 7a_200000696836_100015185245 [0,2,0,0,0,0|1,0,1]=4 18442 B16R2.11351 Ic1cc(cc(c1)NCc2cscn2)I 207a_200000696836_100000743575 [0,2,0,0,0,0|1,0,0]=3 18443 B16R2.11351 Ic1cc(cc(c1)NCc2cscn2)I 270302a_200000696836_100000743575 [0,2,0,0,0,0|1,0,0]=3 18444 B16R2.11351 Ic1cc(cc(c1)NCc2cscn2)I 7a_200000696836_100000205941 [0,2,0,0,0,0|1,0,0]=3 18445 B16R2.11351 Ic1cc(cc(c1)NCc2ncc[nH]2)I 207a_200000696836_100000743867 [0,2,0,0,0,0|2,0,0]=4 18446 B16R2.11351 Ic1cc(cc(c1)NCc2ncc[nH]2)I 7a_200000696836_100000753453 [0,2,0,0,0,0|2,0,0]=4 18447 B16R2.11351 Ic1cc(cc(c1)NCc2ncco2)I 7a_200000696836_103436540062 [0,2,0,0,0,0|2,0,0]=4 18448 B16R2.11351 Ic1cc(cc(c1)NCc2nccs2)I 207a_200000696836_100000750902 [0,2,0,0,0,0|2,0,0]=4 18449 B16R2.11351 Ic1cc(cc(c1)NCc2nccs2)I 270302a_200000696836_100000750902 [0,2,0,0,0,0|2,0,0]=4 18450 B16R2.11351 Ic1cc(cc(c1)NCc2nccs2)I 7a_200000696836_100015184050 [0,2,0,0,0,0|2,0,0]=4 18451 B16R2.11351 Ic1cc(cc(c1)NCn2cncn2)I 7a_200000696836_200020645497 [0,2,0,0,0,0|1,0,1]=4 18452 B16R2.11351 Nc1cc(=O)nc([nH]1)NCc2c[nH]cn2 27a_100000758547_100000101444 [0,2,0,0,0,0|2,0,0]=4 18453 B16R2.11351 Nc1cc(cc(c1)OCc2c[nH]cn2)Cl 34a_100000123917_100000707719 [0,2,0,0,0,0|1,0,0]=3 18454 B16R2.11351 Nc1cc(cc(c1)OCc2cscn2)Cl 34a_100000123917_100000205941 [0,2,0,0,0,0|2,0,0]=4 18455 B16R2.11351 Nc1cc(cc(c1)OCc2cscn2)Cl 7a_100000123917_100000205941 [0,2,0,0,0,0|2,0,0]=4 18456 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100000707719_100009814763 [0,2,0,0,0,0|1,0,0]=3 18457 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100009814763_100000707719 [0,2,0,0,0,0|1,0,0]=3 18458 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100010147676 [0,2,0,0,0,0|1,0,0]=3 18459 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100010147676_100000707719 [0,2,0,0,0,0|1,0,0]=3 18460 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000707719_100011356972 [0,2,0,0,0,0|1,0,0]=3 18461 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100011356972_100000707719 [0,2,0,0,0,0|1,0,0]=3 18462 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)N 62a_100000707719_100011999608 [0,2,0,0,0,0|1,0,0]=3 18463 B16R2.11351 Nc1cc(cc(c1)SCc2c[nH]cn2)N 62a_100011999608_100000707719 [0,2,0,0,0,0|1,0,0]=3 18464 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)Br 62a_100000205941_100009814763 [0,2,0,0,0,0|2,0,0]=4 18465 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)Br 62a_100009814763_100000205941 [0,2,0,0,0,0|2,0,0]=4 18466 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)Cl 62a_100000205941_100010147676 [0,2,0,0,0,0|2,0,0]=4 18467 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)Cl 62a_100010147676_100000205941 [0,2,0,0,0,0|2,0,0]=4 18468 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)F 62a_100000205941_100011356972 [0,2,0,0,0,0|2,0,0]=4 18469 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)F 62a_100011356972_100000205941 [0,2,0,0,0,0|2,0,0]=4 18470 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)N 62a_100000205941_100011999608 [0,2,0,0,0,0|2,0,0]=4 18471 B16R2.11351 Nc1cc(cc(c1)SCc2cscn2)N 62a_100011999608_100000205941 [0,2,0,0,0,0|2,0,0]=4 18472 B16R2.11351 Nc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_100000707719_200011084131 [0,2,0,0,0,0|2,0,0]=4 18473 B16R2.11351 Nc1cc(cc(n1)Cl)SCc2c[nH]cn2 62a_200011084131_100000707719 [0,2,0,0,0,0|2,0,0]=4 18474 B16R2.11351 Nc1cc(cc(n1)N)SCc2c[nH]cn2 62a_100009816676_100000707719 [0,2,0,0,0,0|2,0,0]=4 18475 B16R2.11351 Nc1cc(nc(c1)SCc2c[nH]cn2)O 62a_100000707719_200012179554 [0,2,0,0,0,0|2,0,0]=4 18476 B16R2.11351 Nc1nc(cc(n1)NCc2c[nH]cn2)O 27a_100000758547_100000694715 [0,2,0,0,0,0|2,0,0]=4 18477 B16R2.11351 O=c1cc([nH]c(=O)[nH]1)NCc2c[nH]cn2 27a_100000758547_100000015670 [0,2,0,0,0,0|2,0,0]=4 18478 B16R2.11351 Oc1cc(cc(c1)NCc2c[nH]cn2)Cl 34a_100000123917_100000707719 [0,2,0,0,0,0|0,0,0]=2 18479 B16R2.11351 Oc1cc(cc(c1)NCc2c[nH]cn2)O 34a_100000043371_100000707719 [0,2,0,0,0,0|0,0,0]=2 18480 B16R2.11351 Oc1cc(cc(c1)NCc2ccco2)Cl 270302a_100000123917_100000186105 [0,2,0,0,0,0|2,0,0]=4 18481 B16R2.11351 Oc1cc(cc(c1)NCc2ccco2)O 270302a_100000043371_100000186105 [0,2,0,0,0,0|2,0,0]=4 18482 B16R2.11351 Oc1cc(cc(c1)NCc2cccs2)Cl 270302a_100000123917_100000209959 [0,2,0,0,0,0|2,0,0]=4 18483 B16R2.11351 Oc1cc(cc(c1)NCc2cccs2)O 270302a_100000043371_100000209959 [0,2,0,0,0,0|2,0,0]=4 18484 B16R2.11351 Oc1cc(cc(c1)NCc2ccon2)Cl 34a_100000123917_100000234950 [0,2,0,0,0,0|2,0,0]=4 18485 B16R2.11351 Oc1cc(cc(c1)NCc2ccon2)Cl 7a_100000123917_100000234950 [0,2,0,0,0,0|2,0,0]=4 18486 B16R2.11351 Oc1cc(cc(c1)NCc2ccon2)O 34a_100000043371_100000234950 [0,2,0,0,0,0|2,0,0]=4 18487 B16R2.11351 Oc1cc(cc(c1)NCc2ccsc2)Cl 270302a_100000123917_100000188534 [0,2,0,0,0,0|2,0,0]=4 18488 B16R2.11351 Oc1cc(cc(c1)NCc2ccsc2)Cl 34a_100000123917_100011261437 [0,2,0,0,0,0|2,0,0]=4 18489 B16R2.11351 Oc1cc(cc(c1)NCc2ccsc2)Cl 7a_100000123917_100011261437 [0,2,0,0,0,0|2,0,0]=4 18490 B16R2.11351 Oc1cc(cc(c1)NCc2ccsc2)O 270302a_100000043371_100000188534 [0,2,0,0,0,0|2,0,0]=4 18491 B16R2.11351 Oc1cc(cc(c1)NCc2ccsc2)O 34a_100000043371_100011261437 [0,2,0,0,0,0|2,0,0]=4 18492 B16R2.11351 Oc1cc(cc(c1)NCc2cn[nH]c2)Cl 270302a_100000123917_100016992096 [0,2,0,0,0,0|2,0,0]=4 18493 B16R2.11351 Oc1cc(cc(c1)NCc2cn[nH]c2)O 270302a_100000043371_100016992096 [0,2,0,0,0,0|2,0,0]=4 18494 B16R2.11351 Oc1cc(cc(c1)NCc2cncs2)Cl 270302a_100000123917_100000749870 [0,2,0,0,0,0|1,0,1]=4 18495 B16R2.11351 Oc1cc(cc(c1)NCc2cncs2)Cl 34a_100000123917_100015185245 [0,2,0,0,0,0|1,0,1]=4 18496 B16R2.11351 Oc1cc(cc(c1)NCc2cncs2)Cl 7a_100000123917_100015185245 [0,2,0,0,0,0|1,0,1]=4 18497 B16R2.11351 Oc1cc(cc(c1)NCc2cncs2)O 270302a_100000043371_100000749870 [0,2,0,0,0,0|1,0,1]=4 18498 B16R2.11351 Oc1cc(cc(c1)NCc2cncs2)O 34a_100000043371_100015185245 [0,2,0,0,0,0|1,0,1]=4 18499 B16R2.11351 Oc1cc(cc(c1)NCc2cscn2)Cl 270302a_100000123917_100000743575 [0,2,0,0,0,0|1,0,0]=3 18500 B16R2.11351 Oc1cc(cc(c1)NCc2cscn2)Cl 34a_100000123917_100000205941 [0,2,0,0,0,0|1,0,0]=3 18501 B16R2.11351 Oc1cc(cc(c1)NCc2cscn2)Cl 7a_100000123917_100000205941 [0,2,0,0,0,0|1,0,0]=3 18502 B16R2.11351 Oc1cc(cc(c1)NCc2cscn2)O 270302a_100000043371_100000743575 [0,2,0,0,0,0|1,0,0]=3 18503 B16R2.11351 Oc1cc(cc(c1)NCc2cscn2)O 34a_100000043371_100000205941 [0,2,0,0,0,0|1,0,0]=3 18504 B16R2.11351 Oc1cc(cc(c1)NCc2ncc[nH]2)Cl 34a_100000123917_100016991755 [0,2,0,0,0,0|2,0,0]=4 18505 B16R2.11351 Oc1cc(cc(c1)NCc2ncc[nH]2)Cl 7a_100000123917_100000753453 [0,2,0,0,0,0|2,0,0]=4 18506 B16R2.11351 Oc1cc(cc(c1)NCc2ncc[nH]2)O 34a_100000043371_100016991755 [0,2,0,0,0,0|2,0,0]=4 18507 B16R2.11351 Oc1cc(cc(c1)NCc2ncco2)Cl 34a_100000123917_103436540062 [0,2,0,0,0,0|2,0,0]=4 18508 B16R2.11351 Oc1cc(cc(c1)NCc2ncco2)Cl 7a_100000123917_103436540062 [0,2,0,0,0,0|2,0,0]=4 18509 B16R2.11351 Oc1cc(cc(c1)NCc2ncco2)O 34a_100000043371_103436540062 [0,2,0,0,0,0|2,0,0]=4 18510 B16R2.11351 Oc1cc(cc(c1)NCc2nccs2)Cl 270302a_100000123917_100000750902 [0,2,0,0,0,0|2,0,0]=4 18511 B16R2.11351 Oc1cc(cc(c1)NCc2nccs2)Cl 34a_100000123917_100015184050 [0,2,0,0,0,0|2,0,0]=4 18512 B16R2.11351 Oc1cc(cc(c1)NCc2nccs2)Cl 7a_100000123917_100015184050 [0,2,0,0,0,0|2,0,0]=4 18513 B16R2.11351 Oc1cc(cc(c1)NCc2nccs2)O 270302a_100000043371_100000750902 [0,2,0,0,0,0|2,0,0]=4 18514 B16R2.11351 Oc1cc(cc(c1)NCc2nccs2)O 34a_100000043371_100015184050 [0,2,0,0,0,0|2,0,0]=4 18515 B16R2.11351 Oc1cc(cc(c1)NCc2ncon2)Cl 34a_100000123917_100000233494 [0,2,0,0,0,0|2,0,0]=4 18516 B16R2.11351 Oc1cc(cc(c1)NCc2ncon2)O 34a_100000043371_100000233494 [0,2,0,0,0,0|2,0,0]=4 18517 B16R2.11351 Oc1cc(cc(c1)NCn2cncn2)Cl 34a_100000123917_200020645497 [0,2,0,0,0,0|1,0,1]=4 18518 B16R2.11351 Oc1cc(cc(c1)NCn2cncn2)Cl 7a_100000123917_200020645497 [0,2,0,0,0,0|1,0,1]=4 18519 B16R2.11351 Oc1cc(cc(c1)NCn2cncn2)O 34a_100000043371_200020645497 [0,2,0,0,0,0|1,0,1]=4 18520 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100000707719_100010068917 [0,2,0,0,0,0|1,0,0]=3 18521 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)Br 62a_100010068917_100000707719 [0,2,0,0,0,0|1,0,0]=3 18522 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100000707719_100010068924 [0,2,0,0,0,0|1,0,0]=3 18523 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)Cl 62a_100010068924_100000707719 [0,2,0,0,0,0|1,0,0]=3 18524 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000688818_100000707719 [0,2,0,0,0,0|1,0,0]=3 18525 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)F 62a_100000707719_100000688818 [0,2,0,0,0,0|1,0,0]=3 18526 B16R2.11351 Oc1cc(cc(c1)SCc2c[nH]cn2)O 62a_100000707719_100009868816 [0,2,0,0,0,0|1,0,0]=3 18527 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)Br 62a_100000205941_100010068917 [0,2,0,0,0,0|2,0,0]=4 18528 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)Br 62a_100010068917_100000205941 [0,2,0,0,0,0|2,0,0]=4 18529 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)Cl 62a_100000205941_100010068924 [0,2,0,0,0,0|2,0,0]=4 18530 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)Cl 62a_100010068924_100000205941 [0,2,0,0,0,0|2,0,0]=4 18531 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)F 62a_100000205941_100000688818 [0,2,0,0,0,0|2,0,0]=4 18532 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)F 62a_100000688818_100000205941 [0,2,0,0,0,0|2,0,0]=4 18533 B16R2.11351 Oc1cc(cc(c1)SCc2cscn2)O 62a_100000205941_100009868816 [0,2,0,0,0,0|2,0,0]=4 18534 B16R2.685 C=CC(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_200000085779 [0,2,0,0,0,0|2,0,0]=4 18535 B16R2.685 C=CC(Sc1c[nH]cn1)c2ccccc2 62a_200000085779_100000756875 [0,2,0,0,0,0|2,0,0]=4 18536 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 2230a_100000210013_100000707719 [0,2,0,0,0,0|0,0,0]=2 18537 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 269982a_100000210013_100000707719 [0,2,0,0,0,0|0,0,0]=2 18538 B16R2.685 CCN(Cc1c[nH]cn1)c2ccccc2 34a_100000210013_100000707719 [0,2,0,0,0,0|0,0,0]=2 18539 B16R2.685 CCN(Cc1ccco1)c2ccccc2 2230a_100000230375_100000210202 [0,2,0,0,0,0|2,0,0]=4 18540 B16R2.685 CCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100000204670 [0,2,0,0,0,0|2,0,0]=4 18541 B16R2.685 CCN(Cc1ccco1)c2ccccc2 34a_100000230375_100000210202 [0,2,0,0,0,0|2,0,0]=4 18542 B16R2.685 CCN(Cc1ccon1)c2ccccc2 2230a_100000210013_100000234950 [0,2,0,0,0,0|2,0,0]=4 18543 B16R2.685 CCN(Cc1ccon1)c2ccccc2 269982a_100000210013_100000234950 [0,2,0,0,0,0|2,0,0]=4 18544 B16R2.685 CCN(Cc1ccon1)c2ccccc2 34a_100000210013_100000234950 [0,2,0,0,0,0|2,0,0]=4 18545 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 2230a_100000210013_100011261437 [0,2,0,0,0,0|2,0,0]=4 18546 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 269982a_100000210013_100011233845 [0,2,0,0,0,0|2,0,0]=4 18547 B16R2.685 CCN(Cc1ccsc1)c2ccccc2 34a_100000210013_100011261437 [0,2,0,0,0,0|2,0,0]=4 18548 B16R2.685 CCN(Cc1cncs1)c2ccccc2 2230a_100000210013_100015185245 [0,2,0,0,0,0|1,0,1]=4 18549 B16R2.685 CCN(Cc1cncs1)c2ccccc2 269982a_100000210013_100015185245 [0,2,0,0,0,0|1,0,1]=4 18550 B16R2.685 CCN(Cc1cncs1)c2ccccc2 34a_100000210013_100015185245 [0,2,0,0,0,0|1,0,1]=4 18551 B16R2.685 CCN(Cc1cscn1)c2ccccc2 2230a_100000210013_100000205941 [0,2,0,0,0,0|1,0,0]=3 18552 B16R2.685 CCN(Cc1cscn1)c2ccccc2 269982a_100000210013_100000205941 [0,2,0,0,0,0|1,0,0]=3 18553 B16R2.685 CCN(Cc1cscn1)c2ccccc2 34a_100000210013_100000205941 [0,2,0,0,0,0|1,0,0]=3 18554 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 2230a_100000210013_100016991755 [0,2,0,0,0,0|2,0,0]=4 18555 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 269982a_100000210013_100016991755 [0,2,0,0,0,0|2,0,0]=4 18556 B16R2.685 CCN(Cc1ncc[nH]1)c2ccccc2 34a_100000210013_100016991755 [0,2,0,0,0,0|2,0,0]=4 18557 B16R2.685 CCN(Cc1ncco1)c2ccccc2 2230a_100000210013_103436540062 [0,2,0,0,0,0|2,0,0]=4 18558 B16R2.685 CCN(Cc1ncco1)c2ccccc2 269982a_100000210013_103436540062 [0,2,0,0,0,0|2,0,0]=4 18559 B16R2.685 CCN(Cc1ncco1)c2ccccc2 34a_100000210013_103436540062 [0,2,0,0,0,0|2,0,0]=4 18560 B16R2.685 CCN(Cc1nccs1)c2ccccc2 2230a_100000210013_100015184050 [0,2,0,0,0,0|2,0,0]=4 18561 B16R2.685 CCN(Cc1nccs1)c2ccccc2 269982a_100000210013_100015184050 [0,2,0,0,0,0|2,0,0]=4 18562 B16R2.685 CCN(Cc1nccs1)c2ccccc2 34a_100000210013_100015184050 [0,2,0,0,0,0|2,0,0]=4 18563 B16R2.685 CCN(Cc1ncon1)c2ccccc2 269982a_100000210013_100000233494 [0,2,0,0,0,0|2,0,0]=4 18564 B16R2.685 CCN(Cc1ncon1)c2ccccc2 34a_100000210013_100000233494 [0,2,0,0,0,0|2,0,0]=4 18565 B16R2.685 CCN(Cn1cncn1)c2ccccc2 2230a_100000210013_200020645497 [0,2,0,0,0,0|1,0,1]=4 18566 B16R2.685 CCN(Cn1cncn1)c2ccccc2 269982a_100000210013_200020645497 [0,2,0,0,0,0|1,0,1]=4 18567 B16R2.685 CCN(Cn1cncn1)c2ccccc2 34a_100000210013_200020645497 [0,2,0,0,0,0|1,0,1]=4 18568 B16R2.685 FCN(Cc1ccco1)c2ccccc2 269982a_100000230375_100015361967 [0,2,0,0,0,0|2,0,0]=4 18569 B16R2.685 FCN(Cc1ccco1)c2ccccc2 34a_100000230375_100015361967 [0,2,0,0,0,0|2,0,0]=4 18570 B16R2.82795 CC(C)(Sc1c[nH]cn1)c2ccccc2 62a_100000034625_100000756875 [0,2,0,0,0,0|2,0,0]=4 18571 B16R2.82795 CC(C)(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_100000034625 [0,2,0,0,0,0|2,0,0]=4 18572 B16R2.82795 FC(F)(Sc1c[nH]cn1)c2ccccc2 62a_100000756875_100000036403 [0,2,0,0,0,0|2,0,0]=4 18573 B14R2.6 c1ccc(cc1)Nc2ccncn2 27a_100000106764_100000703185 [0,0,1,1,0,0|0,0,2]=4 18574 B14R2.98 C=Cc1ccccc1c2c[nH]cn2 271570a_100000037480_100000756875 [0,0,1,1,0,0|1,0,1]=4 18575 B14R2.322 c1coc(c1)CNCc2c[nH]cn2 207a_100000758547_100000186105 [0,0,1,1,0,0|1,0,1]=4 18576 B14R2.322 c1coc(c1)CNCc2c[nH]cn2 2230a_100000185738_100000707719 [0,0,1,1,0,0|1,0,1]=4 18577 B14R2.322 c1coc(c1)CNCc2c[nH]cn2 34a_100000185738_100000707719 [0,0,1,1,0,0|1,0,1]=4 18578 B14R2.322 c1csc(c1)CNCc2c[nH]cn2 207a_100000758547_100000209959 [0,0,1,1,0,0|1,0,1]=4 18579 B14R2.322 c1csc(c1)CNCc2c[nH]cn2 2230a_100000211653_100000707719 [0,0,1,1,0,0|1,0,1]=4 18580 B14R2.322 c1nc(c[nH]1)CNCc2ccoc2 207a_100000758547_100011215517 [0,0,1,1,0,0|1,0,1]=4 18581 B14R2.322 c1nc(c[nH]1)CNCc2ccoc2 2230a_100015206860_100000707719 [0,0,1,1,0,0|1,0,1]=4 18582 B14R2.322 c1nc(c[nH]1)CNCc2ccoc2 34a_100015206860_100000707719 [0,0,1,1,0,0|1,0,1]=4 18583 B14R2.322 c1nc(c[nH]1)CNCc2ccsc2 207a_100000758547_100000188534 [0,0,1,1,0,0|1,0,1]=4 18584 B14R2.322 c1nc(c[nH]1)CNCc2ccsc2 2230a_100000186416_100000707719 [0,0,1,1,0,0|1,0,1]=4 18585 B14R2.322 c1nc(c[nH]1)CNCc2ccsc2 34a_100000186416_100000707719 [0,0,1,1,0,0|1,0,1]=4 18586 B14R2.10 C=Cc1cccc(c1)c2c[nH]cn2 271570a_100010046461_100000756875 [0,0,1,1,0,0|1,0,1]=4 18587 B14R2.10 C=Cc1cccc(c1)c2c[nH]cn2 271570a_100011290941_100010196808 [0,0,1,1,0,0|1,0,1]=4 18588 B16R3.8 c1ccc2c(c[nH]c2c1)c3c[nH]cn3 271570a_100012356747_100000756875 [0,0,0,1,0,1|0,0,1]=3 18589 B16R3.8 c1ccc2c(c[nH]c2c1)c3cscn3 271570a_100012356747_100000751502 [0,0,0,1,0,1|1,0,1]=4 18590 B16R3.8 c1ccc2c(c[nH]c2c1)c3nc[nH]n3 271570a_100012356747_100000761765 [0,0,0,1,0,1|1,0,1]=4 18591 B16R3.8 c1ccc2c(coc2c1)c3c[nH]cn3 271570a_100000084643_100000756875 [0,0,0,1,0,1|1,0,1]=4 18592 B16R3.8 c1ccc2c(csc2c1)c3c[nH]cn3 271570a_100000038073_100000756875 [0,0,0,1,0,1|1,0,1]=4 18593 B16R3.8 c1ccc2c(n[nH]c2c1)c3cc[nH]c3 271570a_100000102155_100000050141 [0,0,0,1,0,1|1,0,1]=4 18594 B16R3.8 c1cnc2[nH]cc(c2c1)c3c[nH]cn3 271570a_100000695875_100000756875 [0,0,0,1,0,1|1,0,1]=4 18595 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]cn3 62a_100000756875_100009813401 [0,0,0,1,0,1|1,0,0]=3 18596 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]cn3 62a_100009813401_100000756875 [0,0,0,1,0,1|1,0,0]=3 18597 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]nn3 62a_100009813401_100009819707 [0,0,0,1,0,1|2,0,0]=4 18598 B16R3.1777 c1ccc2c(c1)CC2Sc3c[nH]nn3 62a_100009819707_100009813401 [0,0,0,1,0,1|2,0,0]=4 18599 B16R3.1777 c1ccc2c(c1)CC2Sc3cscn3 62a_100000751502_100009813401 [0,0,0,1,0,1|2,0,0]=4 18600 B16R3.1777 c1ccc2c(c1)CC2Sc3cscn3 62a_100009813401_100000751502 [0,0,0,1,0,1|2,0,0]=4 18601 B16R3.1777 c1ccc2c(c1)CC2Sc3nc[nH]n3 62a_100000761765_100009813401 [0,0,0,1,0,1|2,0,0]=4 18602 B16R3.1777 c1ccc2c(c1)CC2Sc3nc[nH]n3 62a_100009813401_100000761765 [0,0,0,1,0,1|2,0,0]=4 18603 B16R3.5925 C1=C(Cc2c1cccc2)c3c[nH]cn3 271570a_100010239756_100000756875 [0,1,0,1,0,0|1,0,1]=4 18604 B16R3.5925 c1ccc2[nH]c(cc2c1)c3c[nH]cn3 271570a_100010206980_100000756875 [0,1,0,1,0,0|0,0,1]=3 18605 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cc[nH]c3 271570a_100000102155_100010232065 [0,1,0,1,0,0|1,0,1]=4 18606 B16R3.5925 c1ccc2[nH]c(cc2c1)c3cscn3 271570a_100010206980_100000751502 [0,1,0,1,0,0|1,0,1]=4 18607 B16R3.5925 c1ccc2[nH]c(cc2c1)c3nc[nH]n3 271570a_100010206980_100000761765 [0,1,0,1,0,0|1,0,1]=4 18608 B16R3.5925 c1ccc2[nH]c(nc2c1)c3cc[nH]c3 271570a_100000102155_100009814255 [0,1,0,1,0,0|1,0,1]=4 18609 B16R3.5925 c1ccc2oc(cc2c1)c3c[nH]cn3 271570a_100011328764_100000756875 [0,1,0,1,0,0|1,0,1]=4 18610 B16R3.5925 c1ccc2sc(cc2c1)c3c[nH]cn3 271570a_100000034353_100000756875 [0,1,0,1,0,0|1,0,1]=4 18611 B16R3.5925 c1ccc2sc(nc2c1)c3c[nH]cn3 271570a_200000082171_100000756875 [0,1,0,1,0,0|0,0,2]=4 18612 B12R1.53 C=CC=CC(=O)Cc1c[nH]cn1 1458a_100016291481_100000707719 [0,0,1,0,1,0|1,0,0]=3 18613 B12R1.53 C=CC=CC(=O)Cc1cscn1 1458a_100016291481_100000205941 [0,0,1,0,1,0|2,0,0]=4 18614 B12R2.2 c1cc(ccn1)c2c[nH]cn2 271570a_100000752145_100000756875 [0,0,0,0,2,0|1,0,0]=3 18615 B12R2.2 c1cc(ccn1)c2cc[nH]c2 271570a_100000102155_100000035832 [0,0,0,0,2,0|2,0,0]=4 18616 B12R2.2 c1cc(ccn1)c2cscn2 271570a_100000752145_100000751502 [0,0,0,0,2,0|2,0,0]=4 18617 B12R2.2 c1cc(ccn1)c2nc[nH]n2 271570a_100000752145_100000761765 [0,0,0,0,2,0|2,0,0]=4 18618 B12R2.2 c1ccc(cc1)c2c[nH]cn2 271570a_100011218836_100000756875 [0,0,0,0,2,0|0,0,0]=2 18619 B12R2.2 c1ccc(cc1)c2cc[nH]c2 271570a_100000102155_100000210277 [0,0,0,0,2,0|1,0,0]=3 18620 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100000210277 [0,0,0,0,2,0|2,0,0]=4 18621 B12R2.2 c1ccc(cc1)c2cc[nH]n2 271570a_100011218836_100000062575 [0,0,0,0,2,0|2,0,0]=4 18622 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100000750936_100000210277 [0,0,0,0,2,0|2,0,0]=4 18623 B12R2.2 c1ccc(cc1)c2ccco2 271570a_100011218836_100009814098 [0,0,0,0,2,0|2,0,0]=4 18624 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100000742291_100000210277 [0,0,0,0,2,0|2,0,0]=4 18625 B12R2.2 c1ccc(cc1)c2cccs2 271570a_100011218836_100011215356 [0,0,0,0,2,0|2,0,0]=4 18626 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218836_100011215275 [0,0,0,0,2,0|2,0,0]=4 18627 B12R2.2 c1ccc(cc1)c2ccoc2 271570a_100011218838_100000210277 [0,0,0,0,2,0|2,0,0]=4 18628 B12R2.2 c1ccc(cc1)c2ccsc2 271570a_100011218836_100000738268 [0,0,0,0,2,0|2,0,0]=4 18629 B12R2.2 c1ccc(cc1)c2ccsc2 271570a_100011934443_100000210277 [0,0,0,0,2,0|2,0,0]=4 18630 B12R2.2 c1ccc(cc1)c2ccsn2 271570a_100011218836_100009818082 [0,0,0,0,2,0|2,0,0]=4 18631 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100000041997_100000210277 [0,0,0,0,2,0|2,0,0]=4 18632 B12R2.2 c1ccc(cc1)c2cn[nH]c2 271570a_100011218836_100000238712 [0,0,0,0,2,0|2,0,0]=4 18633 B12R2.2 c1ccc(cc1)c2cnco2 271570a_100011218836_100020591547 [0,0,0,0,2,0|1,0,1]=4 18634 B12R2.2 c1ccc(cc1)c2cncs2 271570a_100010231675_100000210277 [0,0,0,0,2,0|1,0,1]=4 18635 B12R2.2 c1ccc(cc1)c2cncs2 271570a_100011218836_100011934649 [0,0,0,0,2,0|1,0,1]=4 18636 B12R2.2 c1ccc(cc1)c2cscn2 271570a_100011218836_100000751502 [0,0,0,0,2,0|1,0,0]=3 18637 B12R2.2 c1ccc(cc1)c2nc[nH]n2 271570a_100011218836_100000761765 [0,0,0,0,2,0|1,0,0]=3 18638 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100011218836_100025796157 [0,0,0,0,2,0|2,0,0]=4 18639 B12R2.2 c1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100000210277 [0,0,0,0,2,0|2,0,0]=4 18640 B12R2.2 c1ccc(cc1)c2ncco2 271570a_100011218836_100011787736 [0,0,0,0,2,0|2,0,0]=4 18641 B12R2.2 c1ccc(cc1)c2nccs2 271570a_100011218836_100000211983 [0,0,0,0,2,0|2,0,0]=4 18642 B12R2.2 c1ccc(cc1)c2ncns2 271570a_100011218836_100000693119 [0,0,0,0,2,0|1,0,1]=4 18643 B12R2.2 c1ccc(nc1)c2c[nH]cn2 271570a_100011264011_100000756875 [0,0,0,0,2,0|1,0,0]=3 18644 B12R2.2 c1ccc(nc1)c2cc[nH]c2 271570a_100000102155_100011216584 [0,0,0,0,2,0|2,0,0]=4 18645 B12R2.2 c1ccc(nc1)c2cscn2 271570a_100011264011_100000751502 [0,0,0,0,2,0|2,0,0]=4 18646 B12R2.2 c1ccc(nc1)c2nc[nH]n2 271570a_100011264011_100000761765 [0,0,0,0,2,0|2,0,0]=4 18647 B12R2.2 c1cnc(cn1)c2c[nH]cn2 271570a_100011962566_100000756875 [0,0,0,0,2,0|2,0,0]=4 18648 B12R2.2 c1cncc(c1)c2c[nH]cn2 271570a_100000757648_100000756875 [0,0,0,0,2,0|1,0,0]=3 18649 B12R2.2 c1cncc(c1)c2cc[nH]c2 271570a_100000102155_100000752921 [0,0,0,0,2,0|2,0,0]=4 18650 B12R2.2 c1cncc(c1)c2cscn2 271570a_100000757648_100000751502 [0,0,0,0,2,0|2,0,0]=4 18651 B12R2.2 c1cncc(c1)c2nc[nH]n2 271570a_100000757648_100000761765 [0,0,0,0,2,0|2,0,0]=4 18652 B12R2.2 c1ncc(cn1)c2c[nH]cn2 271570a_100000707473_100000756875 [0,0,0,0,2,0|2,0,0]=4 18653 B12R2.98 c1coc(c1)Sc2c[nH]cn2 62a_100000756875_100009814098 [0,0,0,0,2,0|2,0,0]=4 18654 B12R2.98 c1coc(c1)Sc2c[nH]cn2 62a_100009814098_100000756875 [0,0,0,0,2,0|2,0,0]=4 18655 B12R2.98 c1csc(c1)Sc2c[nH]cn2 62a_100000756875_100011215356 [0,0,0,0,2,0|2,0,0]=4 18656 B12R2.98 c1csc(c1)Sc2c[nH]cn2 62a_100011215356_100000756875 [0,0,0,0,2,0|2,0,0]=4 18657 B12R2.98 c1nc(c[nH]1)Sc2ccoc2 62a_100000756875_100011215275 [0,0,0,0,2,0|2,0,0]=4 18658 B12R2.98 c1nc(c[nH]1)Sc2ccoc2 62a_100011215275_100000756875 [0,0,0,0,2,0|2,0,0]=4 18659 B12R2.98 c1nc(c[nH]1)Sc2ccsc2 62a_100000738268_100000756875 [0,0,0,0,2,0|2,0,0]=4 18660 B12R2.98 c1nc(c[nH]1)Sc2ccsc2 62a_100000756875_100000738268 [0,0,0,0,2,0|2,0,0]=4 18661 B16R2.2256 C(=NNc1ccccc1)c2ccccn2 4a_100015195140_100000209966 [0,0,0,0,0,2|1,0,1]=4 18662 B16R2.2256 C(=NNc1ccccc1)c2cccnc2 4a_100015195140_100000209961 [0,0,0,0,0,2|1,0,1]=4 18663 B16R2.2256 C(=NNc1ccccc1)c2ccncn2 4a_100015195140_100011744739 [0,0,0,0,0,2|0,0,2]=4 18664 B16R2.2256 C(=NNc1ccccc1)c2cnccn2 4a_100015195140_100000749867 [0,0,0,0,0,2|0,0,2]=4 18665 B16R2.2256 C(=NNc1ccccc1)c2cncnc2 4a_100015195140_100000749868 [0,0,0,0,0,2|0,0,2]=4 18666 B16R2.2256 C(=NNc1ccccc1)c2ncccn2 4a_100015195140_100011532527 [0,0,0,0,0,2|1,0,1]=4 18667 B16R2.2256 c1cc(ccn1)CNCc2cncnc2 207a_100011243677_100000186114 [0,0,0,0,0,2|1,0,1]=4 18668 B16R2.2256 c1cc(ccn1)CNCc2cncnc2 2230a_100011243677_100015193705 [0,0,0,0,0,2|1,0,1]=4 18669 B16R2.2256 c1ccc(cc1)CCNc2ccccc2 34a_100000106764_100000765856 [0,0,0,0,0,2|2,0,0]=4 18670 B16R2.2256 c1ccc(cc1)CCNc2cccnn2 27a_100000106460_100016991348 [0,0,0,0,0,2|2,0,0]=4 18671 B16R2.2256 c1ccc(cc1)CCNc2ccncn2 27a_100000106460_100000703185 [0,0,0,0,0,2|1,0,1]=4 18672 B16R2.2256 c1ccc(cc1)CCNc2cnccn2 27a_100000106460_100000211759 [0,0,0,0,0,2|1,0,1]=4 18673 B16R2.2256 c1ccc(cc1)CCNc2ncccn2 27a_100000106460_100000211032 [0,0,0,0,0,2|2,0,0]=4 18674 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 34a_100000210849_100000765856 [0,0,0,0,0,2|2,0,0]=4 18675 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 7a_100000210849_100000765856 [0,0,0,0,0,2|2,0,0]=4 18676 B16R2.2256 c1ccc(cc1)CCOc2cncnc2 7a_100000754086_100000765856 [0,0,0,0,0,2|1,0,1]=4 18677 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100000765856_100011216584 [0,0,0,0,0,2|2,0,0]=4 18678 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011218657 [0,0,0,0,0,2|2,0,0]=4 18679 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011218657 [0,0,0,0,0,2|2,0,0]=4 18680 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000765856_100000210063 [0,0,0,0,0,2|2,0,0]=4 18681 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100000765856_100016991348 [0,0,0,0,0,2|2,0,0]=4 18682 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100016991348_100011218657 [0,0,0,0,0,2|2,0,0]=4 18683 B16R2.2256 c1ccc(cc1)CCSc2ccncn2 62a_100000703185_100011218657 [0,0,0,0,0,2|1,0,1]=4 18684 B16R2.2256 c1ccc(cc1)CCSc2ccncn2 62a_100000765856_100000703185 [0,0,0,0,0,2|1,0,1]=4 18685 B16R2.2256 c1ccc(cc1)CCSc2cnccn2 62a_100000211759_100011218657 [0,0,0,0,0,2|1,0,1]=4 18686 B16R2.2256 c1ccc(cc1)CCSc2cnccn2 62a_100000765856_100000211759 [0,0,0,0,0,2|1,0,1]=4 18687 B16R2.2256 c1ccc(cc1)CCSc2cncnc2 62a_100000765856_100011206942 [0,0,0,0,0,2|1,0,1]=4 18688 B16R2.2256 c1ccc(cc1)CCSc2cncnc2 62a_100011206942_100011218657 [0,0,0,0,0,2|1,0,1]=4 18689 B16R2.2256 c1ccc(cc1)CCSc2ncccn2 62a_100000211032_100011218657 [0,0,0,0,0,2|2,0,0]=4 18690 B16R2.2256 c1ccc(cc1)CCSc2ncccn2 62a_100000765856_100000211032 [0,0,0,0,0,2|2,0,0]=4 18691 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 207a_100015324214_100015611070 [0,0,0,0,0,2|2,0,0]=4 18692 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100015291786 [0,0,0,0,0,2|2,0,0]=4 18693 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100015611070 [0,0,0,0,0,2|2,0,0]=4 18694 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 34a_100015324214_100015291786 [0,0,0,0,0,2|2,0,0]=4 18695 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 207a_100015324214_100000209966 [0,0,0,0,0,2|1,0,0]=3 18696 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 2230a_100015324214_100000721315 [0,0,0,0,0,2|1,0,0]=3 18697 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100015611070 [0,0,0,0,0,2|1,0,0]=3 18698 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100015324214_100000209966 [0,0,0,0,0,2|1,0,0]=3 18699 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 34a_100015324214_100000721315 [0,0,0,0,0,2|1,0,0]=3 18700 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100000210453_100015611070 [0,0,0,0,0,2|1,0,0]=3 18701 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100015324214_100000209961 [0,0,0,0,0,2|1,0,0]=3 18702 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 2230a_100015324214_100000741622 [0,0,0,0,0,2|1,0,0]=3 18703 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100015611070 [0,0,0,0,0,2|1,0,0]=3 18704 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100015324214_100000209961 [0,0,0,0,0,2|1,0,0]=3 18705 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 34a_100015324214_100000733263 [0,0,0,0,0,2|1,0,0]=3 18706 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100015324214_100016990269 [0,0,0,0,0,2|1,0,0]=3 18707 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100015291786 [0,0,0,0,0,2|1,0,0]=3 18708 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 34a_100015324214_100016990269 [0,0,0,0,0,2|1,0,0]=3 18709 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 207a_100015324214_100000186114 [0,0,0,0,0,2|1,0,1]=4 18710 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 2230a_100015324214_100015193705 [0,0,0,0,0,2|1,0,1]=4 18711 B16R2.2256 c1ccc(cc1)CNCc2ccnnc2 270004a_100015324214_100011934578 [0,0,0,0,0,2|1,0,1]=4 18712 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 2230a_100015324214_100016995436 [0,0,0,0,0,2|0,0,1]=3 18713 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 270004a_100015324214_100000749867 [0,0,0,0,0,2|0,0,1]=3 18714 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 34a_100015324214_100016995436 [0,0,0,0,0,2|0,0,1]=3 18715 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 207a_100011243677_100015611070 [0,0,0,0,0,2|0,0,1]=3 18716 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100015291786 [0,0,0,0,0,2|0,0,1]=3 18717 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 2230a_100015324214_100015196519 [0,0,0,0,0,2|0,0,1]=3 18718 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100015611070 [0,0,0,0,0,2|0,0,1]=3 18719 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 270004a_100015324214_100000749868 [0,0,0,0,0,2|0,0,1]=3 18720 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 34a_100015324214_100015196519 [0,0,0,0,0,2|0,0,1]=3 18721 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 2230a_100015324214_100000703007 [0,0,0,0,0,2|1,0,0]=3 18722 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 270004a_100015324214_100011532527 [0,0,0,0,0,2|1,0,0]=3 18723 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 34a_100015324214_100000703007 [0,0,0,0,0,2|1,0,0]=3 18724 B16R2.2256 c1ccc(cc1)COCc2ccccn2 34a_100000210790_100000721315 [0,0,0,0,0,2|2,0,0]=4 18725 B16R2.2256 c1ccc(cc1)COCc2ccccn2 7a_100000210790_100000721315 [0,0,0,0,0,2|2,0,0]=4 18726 B16R2.2256 c1ccc(cc1)COCc2cccnc2 34a_100000210790_100000733263 [0,0,0,0,0,2|2,0,0]=4 18727 B16R2.2256 c1ccc(cc1)COCc2cccnc2 7a_100000210790_100000741622 [0,0,0,0,0,2|2,0,0]=4 18728 B16R2.2256 c1ccc(cc1)COCc2cccnn2 34a_100000210790_100016990269 [0,0,0,0,0,2|2,0,0]=4 18729 B16R2.2256 c1ccc(cc1)COCc2cccnn2 7a_100000210790_100016990269 [0,0,0,0,0,2|2,0,0]=4 18730 B16R2.2256 c1ccc(cc1)COCc2cnccn2 34a_100000210790_100016995436 [0,0,0,0,0,2|1,0,1]=4 18731 B16R2.2256 c1ccc(cc1)COCc2cnccn2 7a_100000210790_100016995436 [0,0,0,0,0,2|1,0,1]=4 18732 B16R2.2256 c1ccc(cc1)COCc2cncnc2 34a_100000210790_100015196519 [0,0,0,0,0,2|1,0,1]=4 18733 B16R2.2256 c1ccc(cc1)COCc2cncnc2 7a_100000210790_100015196519 [0,0,0,0,0,2|1,0,1]=4 18734 B16R2.2256 c1ccc(cc1)COCc2ncccn2 34a_100000210790_100000703007 [0,0,0,0,0,2|2,0,0]=4 18735 B16R2.2256 c1ccc(cc1)COCc2ncccn2 7a_100000210790_100000703007 [0,0,0,0,0,2|2,0,0]=4 18736 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000211182_100000721315 [0,0,0,0,0,2|2,0,0]=4 18737 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000721315_100015291786 [0,0,0,0,0,2|2,0,0]=4 18738 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000211182_100000741622 [0,0,0,0,0,2|2,0,0]=4 18739 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000741622_100015291786 [0,0,0,0,0,2|2,0,0]=4 18740 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100000211182_100016990269 [0,0,0,0,0,2|2,0,0]=4 18741 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100016990269_100015291786 [0,0,0,0,0,2|2,0,0]=4 18742 B16R2.2256 c1ccc(cc1)CSCc2cnccn2 62a_100000211182_100016995436 [0,0,0,0,0,2|1,0,1]=4 18743 B16R2.2256 c1ccc(cc1)CSCc2cnccn2 62a_100016995436_100015291786 [0,0,0,0,0,2|1,0,1]=4 18744 B16R2.2256 c1ccc(cc1)CSCc2cncnc2 62a_100000211182_100015196519 [0,0,0,0,0,2|1,0,1]=4 18745 B16R2.2256 c1ccc(cc1)CSCc2cncnc2 62a_100015196519_100015291786 [0,0,0,0,0,2|1,0,1]=4 18746 B16R2.2256 c1ccc(cc1)CSCc2ncccn2 62a_100000211182_100000703007 [0,0,0,0,0,2|2,0,0]=4 18747 B16R2.2256 c1ccc(cc1)CSCc2ncccn2 62a_100000703007_100015291786 [0,0,0,0,0,2|2,0,0]=4 18748 B16R2.2256 c1ccc(cc1)OCCc2ccccn2 7a_100000210340_100015183660 [0,0,0,0,0,2|2,0,0]=4 18749 B16R2.2256 c1ccc(cc1)OCCc2cccnc2 7a_100000210340_200011713674 [0,0,0,0,0,2|2,0,0]=4 18750 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100000719477_100015183660 [0,0,0,0,0,2|2,0,0]=4 18751 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000041952 [0,0,0,0,0,2|2,0,0]=4 18752 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_100000719477_200011713674 [0,0,0,0,0,2|2,0,0]=4 18753 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000041952 [0,0,0,0,0,2|2,0,0]=4 18754 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011216584_100011218342 [0,0,0,0,0,2|2,0,0]=4 18755 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011218342_100011216584 [0,0,0,0,0,2|2,0,0]=4 18756 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100000210063_100011218342 [0,0,0,0,0,2|2,0,0]=4 18757 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100011218342_100000210063 [0,0,0,0,0,2|2,0,0]=4 18758 B16R2.2256 c1ccc(cc1)SCSc2cccnn2 62a_100011218342_100016991348 [0,0,0,0,0,2|2,0,0]=4 18759 B16R2.2256 c1ccc(cc1)SCSc2cccnn2 62a_100016991348_100011218342 [0,0,0,0,0,2|2,0,0]=4 18760 B16R2.2256 c1ccc(cc1)SCSc2ccncn2 62a_100000703185_100011218342 [0,0,0,0,0,2|1,0,1]=4 18761 B16R2.2256 c1ccc(cc1)SCSc2ccncn2 62a_100011218342_100000703185 [0,0,0,0,0,2|1,0,1]=4 18762 B16R2.2256 c1ccc(cc1)SCSc2cnccn2 62a_100000211759_100011218342 [0,0,0,0,0,2|1,0,1]=4 18763 B16R2.2256 c1ccc(cc1)SCSc2cnccn2 62a_100011218342_100000211759 [0,0,0,0,0,2|1,0,1]=4 18764 B16R2.2256 c1ccc(cc1)SCSc2cncnc2 62a_100011206942_100011218342 [0,0,0,0,0,2|1,0,1]=4 18765 B16R2.2256 c1ccc(cc1)SCSc2cncnc2 62a_100011218342_100011206942 [0,0,0,0,0,2|1,0,1]=4 18766 B16R2.2256 c1ccc(cc1)SCSc2ncccn2 62a_100000211032_100011218342 [0,0,0,0,0,2|2,0,0]=4 18767 B16R2.2256 c1ccc(cc1)SCSc2ncccn2 62a_100011218342_100000211032 [0,0,0,0,0,2|2,0,0]=4 18768 B16R2.2256 c1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100000209966 [0,0,0,0,0,2|2,0,0]=4 18769 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 207a_100000210453_100000209966 [0,0,0,0,0,2|2,0,0]=4 18770 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 270004a_100000210449_100000209961 [0,0,0,0,0,2|2,0,0]=4 18771 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100000209966 [0,0,0,0,0,2|2,0,0]=4 18772 B16R2.2256 c1ccc(nc1)CNCc2cccnn2 2230a_100159270163_100000721315 [0,0,0,0,0,2|2,0,0]=4 18773 B16R2.2256 c1ccc(nc1)CNCc2cnccn2 270004a_100000210449_100000749867 [0,0,0,0,0,2|1,0,1]=4 18774 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 207a_100011243677_100000209966 [0,0,0,0,0,2|1,0,1]=4 18775 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 2230a_100011243677_100000721315 [0,0,0,0,0,2|1,0,1]=4 18776 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 270004a_100000210449_100000749868 [0,0,0,0,0,2|1,0,1]=4 18777 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 270004a_100011243677_100000209966 [0,0,0,0,0,2|1,0,1]=4 18778 B16R2.2256 c1ccc(nc1)CNCc2ncccn2 270004a_100000210449_100011532527 [0,0,0,0,0,2|2,0,0]=4 18779 B16R2.2256 c1cnc(nc1)CNCc2cccnc2 270004a_100000210453_100011532527 [0,0,0,0,0,2|2,0,0]=4 18780 B16R2.2256 c1cncc(c1)CNCc2cccnc2 207a_100000210453_100000209961 [0,0,0,0,0,2|2,0,0]=4 18781 B16R2.2256 c1cncc(c1)CNCc2cccnc2 270004a_100000210453_100000209961 [0,0,0,0,0,2|2,0,0]=4 18782 B16R2.2256 c1cncc(c1)CNCc2cccnn2 2230a_100159270163_100000741622 [0,0,0,0,0,2|2,0,0]=4 18783 B16R2.2256 c1cncc(c1)CNCc2ccncc2 207a_100000210453_100000186114 [0,0,0,0,0,2|2,0,0]=4 18784 B16R2.2256 c1cncc(c1)CNCc2cnccn2 270004a_100000210453_100000749867 [0,0,0,0,0,2|1,0,1]=4 18785 B16R2.2256 c1cncc(c1)CNCc2cncnc2 207a_100011243677_100000209961 [0,0,0,0,0,2|1,0,1]=4 18786 B16R2.2256 c1cncc(c1)CNCc2cncnc2 2230a_100011243677_100000741622 [0,0,0,0,0,2|1,0,1]=4 18787 B16R2.2256 c1cncc(c1)CNCc2cncnc2 270004a_100000210453_100000749868 [0,0,0,0,0,2|1,0,1]=4 18788 B16R2.2256 c1cncc(c1)CNCc2cncnc2 270004a_100011243677_100000209961 [0,0,0,0,0,2|1,0,1]=4 18789 B16R2.2256 c1cnnc(c1)CNCc2ccncc2 2230a_100159270163_100015193705 [0,0,0,0,0,2|2,0,0]=4 18790 B16R2.2257 C(#Cc1ccccc1)CSc2c[nH]cn2 62a_100000756875_100011352542 [0,0,0,0,0,2|1,0,0]=3 18791 B16R2.2257 C(#Cc1ccccc1)CSc2c[nH]nn2 62a_100009819707_100011352542 [0,0,0,0,0,2|2,0,0]=4 18792 B16R2.2257 C(#Cc1ccccc1)CSc2cscn2 62a_100000751502_100011352542 [0,0,0,0,0,2|2,0,0]=4 18793 B16R2.2257 C(#Cc1ccccc1)CSc2nc[nH]n2 62a_100000761765_100011352542 [0,0,0,0,0,2|2,0,0]=4 18794 B16R2.2257 C(=C/c1ccccc1)\CSc2c[nH]cn2 62a_100000756875_100016265936 [0,0,0,0,0,2|1,0,0]=3 18795 B16R2.2257 C(=C/c1ccccc1)\CSc2c[nH]cn2 62a_100016265936_100000756875 [0,0,0,0,0,2|1,0,0]=3 18796 B16R2.2257 C(=C/c1ccccc1)\CSc2c[nH]nn2 62a_100009819707_100016265936 [0,0,0,0,0,2|2,0,0]=4 18797 B16R2.2257 C(=C/c1ccccc1)\CSc2c[nH]nn2 62a_100016265936_100009819707 [0,0,0,0,0,2|2,0,0]=4 18798 B16R2.2257 C(=C/c1ccccc1)\CSc2cscn2 62a_100000751502_100016265936 [0,0,0,0,0,2|2,0,0]=4 18799 B16R2.2257 C(=C/c1ccccc1)\CSc2cscn2 62a_100016265936_100000751502 [0,0,0,0,0,2|2,0,0]=4 18800 B16R2.2257 C(=C/c1ccccc1)\CSc2nc[nH]n2 62a_100000761765_100016265936 [0,0,0,0,0,2|2,0,0]=4 18801 B16R2.2257 C(=C/c1ccccc1)\CSc2nc[nH]n2 62a_100016265936_100000761765 [0,0,0,0,0,2|2,0,0]=4 18802 B16R2.2257 C(=NNCc1ccccc1)c2cc[nH]c2 4a_100000007032_100000760201 [0,0,0,0,0,2|1,0,1]=4 18803 B16R2.2257 C(=NNCc1ccccc1)c2cocn2 4a_100000007032_100000050382 [0,0,0,0,0,2|1,0,1]=4 18804 B16R2.2257 C(=NNCc1ccccc1)c2cscn2 4a_100000007032_100000743575 [0,0,0,0,0,2|1,0,1]=4 18805 B16R2.2257 c1cc(ccn1)CCNCc2cocn2 270004a_100000742849_100000050382 [0,0,0,0,0,2|2,0,0]=4 18806 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 207a_100000742849_100000743575 [0,0,0,0,0,2|2,0,0]=4 18807 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 2230a_100015185402_100000723409 [0,0,0,0,0,2|2,0,0]=4 18808 B16R2.2257 c1cc(ccn1)CCNCc2cscn2 270004a_100000742849_100000743575 [0,0,0,0,0,2|2,0,0]=4 18809 B16R2.2257 c1cc(ccn1)CCOCc2c[nH]cn2 34a_100011216225_100000707719 [0,0,0,0,0,2|2,0,0]=4 18810 B16R2.2257 c1cc(ccn1)CCSCc2c[nH]cn2 62a_100000707719_100000723409 [0,0,0,0,0,2|2,0,0]=4 18811 B16R2.2257 c1cc(ccn1)CCSCc2c[nH]cn2 62a_100000723409_100000707719 [0,0,0,0,0,2|2,0,0]=4 18812 B16R2.2257 c1cc(ccn1)CSCCc2c[nH]cn2 62a_100015193705_100020628418 [0,0,0,0,0,2|2,0,0]=4 18813 B16R2.2257 c1cc(ccn1)CSCCc2c[nH]cn2 62a_100020628418_100015193705 [0,0,0,0,0,2|2,0,0]=4 18814 B16R2.2257 c1cc(cnn1)CNCCc2c[nH]cn2 270004a_100000755092_100011934578 [0,0,0,0,0,2|2,0,0]=4 18815 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]cn2 62a_100000211621_100000756875 [0,0,0,0,0,2|1,0,0]=3 18816 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]cn2 62a_100000756875_100000211621 [0,0,0,0,0,2|1,0,0]=3 18817 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]nn2 62a_100000211621_100009819707 [0,0,0,0,0,2|2,0,0]=4 18818 B16R2.2257 c1ccc(cc1)CCCSc2c[nH]nn2 62a_100009819707_100000211621 [0,0,0,0,0,2|2,0,0]=4 18819 B16R2.2257 c1ccc(cc1)CCCSc2cscn2 62a_100000211621_100000751502 [0,0,0,0,0,2|2,0,0]=4 18820 B16R2.2257 c1ccc(cc1)CCCSc2cscn2 62a_100000751502_100000211621 [0,0,0,0,0,2|2,0,0]=4 18821 B16R2.2257 c1ccc(cc1)CCCSc2nc[nH]n2 62a_100000211621_100000761765 [0,0,0,0,0,2|2,0,0]=4 18822 B16R2.2257 c1ccc(cc1)CCCSc2nc[nH]n2 62a_100000761765_100000211621 [0,0,0,0,0,2|2,0,0]=4 18823 B16R2.2257 c1ccc(cc1)CCNCc2c[nH]cn2 2230a_100000106460_100000707719 [0,0,0,0,0,2|0,0,0]=2 18824 B16R2.2257 c1ccc(cc1)CCNCc2c[nH]cn2 34a_100000106460_100000707719 [0,0,0,0,0,2|0,0,0]=2 18825 B16R2.2257 c1ccc(cc1)CCNCc2cc[nH]n2 207a_100000106460_100000738523 [0,0,0,0,0,2|2,0,0]=4 18826 B16R2.2257 c1ccc(cc1)CCNCc2cc[nH]n2 270004a_100000106460_100000738523 [0,0,0,0,0,2|2,0,0]=4 18827 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 207a_100000106460_100000186105 [0,0,0,0,0,2|2,0,0]=4 18828 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 2230a_100000185738_100000765856 [0,0,0,0,0,2|2,0,0]=4 18829 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 270004a_100000106460_100000186105 [0,0,0,0,0,2|2,0,0]=4 18830 B16R2.2257 c1ccc(cc1)CCNCc2ccco2 34a_100000185738_100000765856 [0,0,0,0,0,2|2,0,0]=4 18831 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 207a_100000106460_100000209959 [0,0,0,0,0,2|2,0,0]=4 18832 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 2230a_100000211653_100000765856 [0,0,0,0,0,2|2,0,0]=4 18833 B16R2.2257 c1ccc(cc1)CCNCc2cccs2 270004a_100000106460_100000209959 [0,0,0,0,0,2|2,0,0]=4 18834 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 207a_100000106460_100011215517 [0,0,0,0,0,2|2,0,0]=4 18835 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 2230a_100015206860_100000765856 [0,0,0,0,0,2|2,0,0]=4 18836 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 270004a_100000106460_100011215517 [0,0,0,0,0,2|2,0,0]=4 18837 B16R2.2257 c1ccc(cc1)CCNCc2ccoc2 34a_100015206860_100000765856 [0,0,0,0,0,2|2,0,0]=4 18838 B16R2.2257 c1ccc(cc1)CCNCc2ccon2 2230a_100000106460_100000234950 [0,0,0,0,0,2|2,0,0]=4 18839 B16R2.2257 c1ccc(cc1)CCNCc2ccon2 34a_100000106460_100000234950 [0,0,0,0,0,2|2,0,0]=4 18840 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 207a_100000106460_100000188534 [0,0,0,0,0,2|2,0,0]=4 18841 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 2230a_100000106460_100011261437 [0,0,0,0,0,2|2,0,0]=4 18842 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 2230a_100000186416_100000765856 [0,0,0,0,0,2|2,0,0]=4 18843 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 270004a_100000106460_100000188534 [0,0,0,0,0,2|2,0,0]=4 18844 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 34a_100000106460_100011261437 [0,0,0,0,0,2|2,0,0]=4 18845 B16R2.2257 c1ccc(cc1)CCNCc2ccsc2 34a_100000186416_100000765856 [0,0,0,0,0,2|2,0,0]=4 18846 B16R2.2257 c1ccc(cc1)CCNCc2cn[nH]c2 207a_100000106460_100016992096 [0,0,0,0,0,2|2,0,0]=4 18847 B16R2.2257 c1ccc(cc1)CCNCc2cn[nH]c2 270004a_100000106460_100016992096 [0,0,0,0,0,2|2,0,0]=4 18848 B16R2.2257 c1ccc(cc1)CCNCc2cnc[nH]2 207a_100000106460_100000742939 [0,0,0,0,0,2|0,0,2]=4 18849 B16R2.2257 c1ccc(cc1)CCNCc2cnco2 270004a_100000106460_100000064291 [0,0,0,0,0,2|1,0,1]=4 18850 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 207a_100000106460_100000749870 [0,0,0,0,0,2|1,0,1]=4 18851 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 2230a_100000106460_100015185245 [0,0,0,0,0,2|1,0,1]=4 18852 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 2230a_100016987365_100000765856 [0,0,0,0,0,2|1,0,1]=4 18853 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 270004a_100000106460_100000749870 [0,0,0,0,0,2|1,0,1]=4 18854 B16R2.2257 c1ccc(cc1)CCNCc2cncs2 34a_100000106460_100015185245 [0,0,0,0,0,2|1,0,1]=4 18855 B16R2.2257 c1ccc(cc1)CCNCc2cocn2 270004a_100000106460_100000050382 [0,0,0,0,0,2|1,0,0]=3 18856 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 207a_100000106460_100000743575 [0,0,0,0,0,2|1,0,0]=3 18857 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 2230a_100000106460_100000205941 [0,0,0,0,0,2|1,0,0]=3 18858 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 2230a_100015185402_100000765856 [0,0,0,0,0,2|1,0,0]=3 18859 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 270004a_100000106460_100000743575 [0,0,0,0,0,2|1,0,0]=3 18860 B16R2.2257 c1ccc(cc1)CCNCc2cscn2 34a_100000106460_100000205941 [0,0,0,0,0,2|1,0,0]=3 18861 B16R2.2257 c1ccc(cc1)CCNCc2csnn2 270004a_100000106460_100000738508 [0,0,0,0,0,2|2,0,0]=4 18862 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 207a_100000106460_100000743867 [0,0,0,0,0,2|2,0,0]=4 18863 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 2230a_100000106460_100016991755 [0,0,0,0,0,2|2,0,0]=4 18864 B16R2.2257 c1ccc(cc1)CCNCc2ncc[nH]2 34a_100000106460_100016991755 [0,0,0,0,0,2|2,0,0]=4 18865 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 2230a_100000106460_103436540062 [0,0,0,0,0,2|2,0,0]=4 18866 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 2230a_100016994969_100000765856 [0,0,0,0,0,2|2,0,0]=4 18867 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 270004a_100000106460_100000064290 [0,0,0,0,0,2|2,0,0]=4 18868 B16R2.2257 c1ccc(cc1)CCNCc2ncco2 34a_100000106460_103436540062 [0,0,0,0,0,2|2,0,0]=4 18869 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 207a_100000106460_100000750902 [0,0,0,0,0,2|2,0,0]=4 18870 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 2230a_100000106460_100015184050 [0,0,0,0,0,2|2,0,0]=4 18871 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 2230a_100000740555_100000765856 [0,0,0,0,0,2|2,0,0]=4 18872 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 270004a_100000106460_100000750902 [0,0,0,0,0,2|2,0,0]=4 18873 B16R2.2257 c1ccc(cc1)CCNCc2nccs2 34a_100000106460_100015184050 [0,0,0,0,0,2|2,0,0]=4 18874 B16R2.2257 c1ccc(cc1)CCNCc2ncon2 34a_100000106460_100000233494 [0,0,0,0,0,2|2,0,0]=4 18875 B16R2.2257 c1ccc(cc1)CCNCn2cncn2 2230a_100000106460_200020645497 [0,0,0,0,0,2|1,0,1]=4 18876 B16R2.2257 c1ccc(cc1)CCNCn2cncn2 34a_100000106460_200020645497 [0,0,0,0,0,2|1,0,1]=4 18877 B16R2.2257 c1ccc(cc1)CCOCc2c[nH]cn2 34a_100000210268_100000707719 [0,0,0,0,0,2|1,0,0]=3 18878 B16R2.2257 c1ccc(cc1)CCOCc2cscn2 34a_100000210268_100000205941 [0,0,0,0,0,2|2,0,0]=4 18879 B16R2.2257 c1ccc(cc1)CCOCc2cscn2 7a_100000210268_100000205941 [0,0,0,0,0,2|2,0,0]=4 18880 B16R2.2257 c1ccc(cc1)CCSCc2c[nH]cn2 62a_100000707719_100011218657 [0,0,0,0,0,2|1,0,0]=3 18881 B16R2.2257 c1ccc(cc1)CCSCc2c[nH]cn2 62a_100000765856_100000707719 [0,0,0,0,0,2|1,0,0]=3 18882 B16R2.2257 c1ccc(cc1)CCSCc2cscn2 62a_100000205941_100011218657 [0,0,0,0,0,2|2,0,0]=4 18883 B16R2.2257 c1ccc(cc1)CCSCc2cscn2 62a_100000765856_100000205941 [0,0,0,0,0,2|2,0,0]=4 18884 B16R2.2257 c1ccc(cc1)CNCCc2c[nH]cn2 2230a_100015324214_100020628418 [0,0,0,0,0,2|0,0,0]=2 18885 B16R2.2257 c1ccc(cc1)CNCCc2c[nH]cn2 270004a_100000755092_100015611070 [0,0,0,0,0,2|0,0,0]=2 18886 B16R2.2257 c1ccc(cc1)CNCCc2ccco2 207a_100000694680_100015611070 [0,0,0,0,0,2|2,0,0]=4 18887 B16R2.2257 c1ccc(cc1)CNCCc2ccco2 2230a_100000694680_100015291786 [0,0,0,0,0,2|2,0,0]=4 18888 B16R2.2257 c1ccc(cc1)CNCCc2ccco2 270004a_100000694680_100015611070 [0,0,0,0,0,2|2,0,0]=4 18889 B16R2.2257 c1ccc(cc1)CNCCc2ccco2 34a_100000694680_100015291786 [0,0,0,0,0,2|2,0,0]=4 18890 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 207a_100000203755_100015611070 [0,0,0,0,0,2|2,0,0]=4 18891 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 2230a_100000203755_100015291786 [0,0,0,0,0,2|2,0,0]=4 18892 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 2230a_100015324214_100000748579 [0,0,0,0,0,2|2,0,0]=4 18893 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 270004a_100000203755_100015611070 [0,0,0,0,0,2|2,0,0]=4 18894 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 34a_100000203755_100015291786 [0,0,0,0,0,2|2,0,0]=4 18895 B16R2.2257 c1ccc(cc1)CNCCc2cccs2 34a_100015324214_100000748579 [0,0,0,0,0,2|2,0,0]=4 18896 B16R2.2257 c1ccc(cc1)CNCCc2ccsc2 207a_100000692642_100015611070 [0,0,0,0,0,2|2,0,0]=4 18897 B16R2.2257 c1ccc(cc1)CNCCc2ccsc2 2230a_100000692642_100015291786 [0,0,0,0,0,2|2,0,0]=4 18898 B16R2.2257 c1ccc(cc1)CNCCc2ccsc2 270004a_100000692642_100015611070 [0,0,0,0,0,2|2,0,0]=4 18899 B16R2.2257 c1ccc(cc1)CNCCc2ccsc2 34a_100000692642_100015291786 [0,0,0,0,0,2|2,0,0]=4 18900 B16R2.2257 c1ccc(cc1)CNCCc2cn[nH]c2 207a_100000732747_100015611070 [0,0,0,0,0,2|2,0,0]=4 18901 B16R2.2257 c1ccc(cc1)CNCCc2cn[nH]c2 2230a_100000732747_100015291786 [0,0,0,0,0,2|2,0,0]=4 18902 B16R2.2257 c1ccc(cc1)CNCCc2cn[nH]c2 2230a_100015324214_100000743252 [0,0,0,0,0,2|2,0,0]=4 18903 B16R2.2257 c1ccc(cc1)CNCCc2cn[nH]c2 270004a_100000732747_100015611070 [0,0,0,0,0,2|2,0,0]=4 18904 B16R2.2257 c1ccc(cc1)CNCCc2cncs2 207a_100016991637_100015611070 [0,0,0,0,0,2|1,0,1]=4 18905 B16R2.2257 c1ccc(cc1)CNCCc2cncs2 2230a_100016991637_100015291786 [0,0,0,0,0,2|1,0,1]=4 18906 B16R2.2257 c1ccc(cc1)CNCCc2cncs2 270004a_100016991637_100015611070 [0,0,0,0,0,2|1,0,1]=4 18907 B16R2.2257 c1ccc(cc1)CNCCc2ncc[nH]2 207a_100000754300_100015611070 [0,0,0,0,0,2|2,0,0]=4 18908 B16R2.2257 c1ccc(cc1)CNCCc2ncc[nH]2 270004a_100000754300_100015611070 [0,0,0,0,0,2|2,0,0]=4 18909 B16R2.2257 c1ccc(cc1)CNCCc2nccs2 207a_100015186391_100015611070 [0,0,0,0,0,2|2,0,0]=4 18910 B16R2.2257 c1ccc(cc1)CNCCc2nccs2 2230a_100015186391_100015291786 [0,0,0,0,0,2|2,0,0]=4 18911 B16R2.2257 c1ccc(cc1)CNCCc2nccs2 270004a_100015186391_100015611070 [0,0,0,0,0,2|2,0,0]=4 18912 B16R2.2257 c1ccc(cc1)CNCCn2cccn2 207a_100011200920_100015611070 [0,0,0,0,0,2|2,0,0]=4 18913 B16R2.2257 c1ccc(cc1)CNCCn2cccn2 2230a_100011200920_100015291786 [0,0,0,0,0,2|2,0,0]=4 18914 B16R2.2257 c1ccc(cc1)CNCCn2cccn2 2230a_100015324214_100000685285 [0,0,0,0,0,2|2,0,0]=4 18915 B16R2.2257 c1ccc(cc1)CNCCn2cccn2 270004a_100011200920_100015611070 [0,0,0,0,0,2|2,0,0]=4 18916 B16R2.2257 c1ccc(cc1)CNCCn2cccn2 34a_100015324214_100015204718 [0,0,0,0,0,2|2,0,0]=4 18917 B16R2.2257 c1ccc(cc1)CNCCn2cncn2 207a_200000738561_100015611070 [0,0,0,0,0,2|1,0,1]=4 18918 B16R2.2257 c1ccc(cc1)CNCCn2cncn2 2230a_100015324214_100000731791 [0,0,0,0,0,2|1,0,1]=4 18919 B16R2.2257 c1ccc(cc1)CNCCn2cncn2 2230a_200000738561_100015291786 [0,0,0,0,0,2|1,0,1]=4 18920 B16R2.2257 c1ccc(cc1)CNCCn2cncn2 270004a_200000738561_100015611070 [0,0,0,0,0,2|1,0,1]=4 18921 B16R2.2257 c1ccc(cc1)CNCCn2cncn2 34a_100015324214_200000749826 [0,0,0,0,0,2|1,0,1]=4 18922 B16R2.2257 c1ccc(cc1)COCCc2c[nH]cn2 7a_100000210790_100020628418 [0,0,0,0,0,2|1,0,0]=3 18923 B16R2.2257 c1ccc(cc1)COCSc2c[nH]cn2 62a_100000756875_100000763385 [0,0,0,0,0,2|1,0,0]=3 18924 B16R2.2257 c1ccc(cc1)COCSc2c[nH]cn2 62a_100000763385_100000756875 [0,0,0,0,0,2|1,0,0]=3 18925 B16R2.2257 c1ccc(cc1)COCSc2c[nH]nn2 62a_100000763385_100009819707 [0,0,0,0,0,2|2,0,0]=4 18926 B16R2.2257 c1ccc(cc1)COCSc2c[nH]nn2 62a_100009819707_100000763385 [0,0,0,0,0,2|2,0,0]=4 18927 B16R2.2257 c1ccc(cc1)COCSc2cscn2 62a_100000751502_100000763385 [0,0,0,0,0,2|2,0,0]=4 18928 B16R2.2257 c1ccc(cc1)COCSc2cscn2 62a_100000763385_100000751502 [0,0,0,0,0,2|2,0,0]=4 18929 B16R2.2257 c1ccc(cc1)COCSc2nc[nH]n2 62a_100000761765_100000763385 [0,0,0,0,0,2|2,0,0]=4 18930 B16R2.2257 c1ccc(cc1)COCSc2nc[nH]n2 62a_100000763385_100000761765 [0,0,0,0,0,2|2,0,0]=4 18931 B16R2.2257 c1ccc(cc1)CSCCc2c[nH]cn2 62a_100000211182_100020628418 [0,0,0,0,0,2|1,0,0]=3 18932 B16R2.2257 c1ccc(cc1)CSCCc2c[nH]cn2 62a_100020628418_100015291786 [0,0,0,0,0,2|1,0,0]=3 18933 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]cn2 62a_100000756875_200011217039 [0,0,0,0,0,2|1,0,0]=3 18934 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]cn2 62a_200011217039_100000756875 [0,0,0,0,0,2|1,0,0]=3 18935 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]nn2 62a_100009819707_200011217039 [0,0,0,0,0,2|2,0,0]=4 18936 B16R2.2257 c1ccc(cc1)CSCSc2c[nH]nn2 62a_200011217039_100009819707 [0,0,0,0,0,2|2,0,0]=4 18937 B16R2.2257 c1ccc(cc1)CSCSc2cscn2 62a_100000751502_200011217039 [0,0,0,0,0,2|2,0,0]=4 18938 B16R2.2257 c1ccc(cc1)CSCSc2cscn2 62a_200011217039_100000751502 [0,0,0,0,0,2|2,0,0]=4 18939 B16R2.2257 c1ccc(cc1)CSCSc2nc[nH]n2 62a_100000761765_200011217039 [0,0,0,0,0,2|2,0,0]=4 18940 B16R2.2257 c1ccc(cc1)CSCSc2nc[nH]n2 62a_200011217039_100000761765 [0,0,0,0,0,2|2,0,0]=4 18941 B16R2.2257 c1ccc(cc1)NCCCc2cccs2 34a_100000106764_100010992444 [0,0,0,0,0,2|2,0,0]=4 18942 B16R2.2257 c1ccc(cc1)NCCCn2cncn2 34a_100000106764_100102700105 [0,0,0,0,0,2|1,0,1]=4 18943 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]cn2 62a_100000184471_100000756875 [0,0,0,0,0,2|1,0,0]=3 18944 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]cn2 62a_100000756875_100000184471 [0,0,0,0,0,2|1,0,0]=3 18945 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]nn2 62a_100000184471_100009819707 [0,0,0,0,0,2|2,0,0]=4 18946 B16R2.2257 c1ccc(cc1)OCCSc2c[nH]nn2 62a_100009819707_100000184471 [0,0,0,0,0,2|2,0,0]=4 18947 B16R2.2257 c1ccc(cc1)OCCSc2cscn2 62a_100000184471_100000751502 [0,0,0,0,0,2|2,0,0]=4 18948 B16R2.2257 c1ccc(cc1)OCCSc2cscn2 62a_100000751502_100000184471 [0,0,0,0,0,2|2,0,0]=4 18949 B16R2.2257 c1ccc(cc1)OCCSc2nc[nH]n2 62a_100000184471_100000761765 [0,0,0,0,0,2|2,0,0]=4 18950 B16R2.2257 c1ccc(cc1)OCCSc2nc[nH]n2 62a_100000761765_100000184471 [0,0,0,0,0,2|2,0,0]=4 18951 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]cn2 62a_100000246102_100000756875 [0,0,0,0,0,2|1,0,0]=3 18952 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]cn2 62a_100000756875_100000246102 [0,0,0,0,0,2|1,0,0]=3 18953 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]nn2 62a_100000246102_100009819707 [0,0,0,0,0,2|2,0,0]=4 18954 B16R2.2257 c1ccc(cc1)SCCSc2c[nH]nn2 62a_100009819707_100000246102 [0,0,0,0,0,2|2,0,0]=4 18955 B16R2.2257 c1ccc(cc1)SCCSc2cscn2 62a_100000246102_100000751502 [0,0,0,0,0,2|2,0,0]=4 18956 B16R2.2257 c1ccc(cc1)SCCSc2cscn2 62a_100000751502_100000246102 [0,0,0,0,0,2|2,0,0]=4 18957 B16R2.2257 c1ccc(cc1)SCCSc2nc[nH]n2 62a_100000246102_100000761765 [0,0,0,0,0,2|2,0,0]=4 18958 B16R2.2257 c1ccc(cc1)SCCSc2nc[nH]n2 62a_100000761765_100000246102 [0,0,0,0,0,2|2,0,0]=4 18959 B16R2.2257 c1ccc(cc1)SCNCc2ccco2 2230a_100000185738_100011218342 [0,0,0,0,0,2|2,0,0]=4 18960 B16R2.2257 c1ccc(cc1)SCNCc2cccs2 2230a_100000211653_100011218342 [0,0,0,0,0,2|2,0,0]=4 18961 B16R2.2257 c1ccc(cc1)SCNCc2ccoc2 2230a_100015206860_100011218342 [0,0,0,0,0,2|2,0,0]=4 18962 B16R2.2257 c1ccc(cc1)SCNCc2ccsc2 2230a_100000186416_100011218342 [0,0,0,0,0,2|2,0,0]=4 18963 B16R2.2257 c1ccc(cc1)SCNCc2cncs2 2230a_100016987365_100011218342 [0,0,0,0,0,2|1,0,1]=4 18964 B16R2.2257 c1ccc(cc1)SCNCc2cscn2 2230a_100015185402_100011218342 [0,0,0,0,0,2|1,0,0]=3 18965 B16R2.2257 c1ccc(cc1)SCNCc2ncco2 2230a_100016994969_100011218342 [0,0,0,0,0,2|2,0,0]=4 18966 B16R2.2257 c1ccc(cc1)SCNCc2nccs2 2230a_100000740555_100011218342 [0,0,0,0,0,2|2,0,0]=4 18967 B16R2.2257 c1ccc(cc1)SCSCc2c[nH]cn2 62a_100000707719_100011218342 [0,0,0,0,0,2|1,0,0]=3 18968 B16R2.2257 c1ccc(cc1)SCSCc2c[nH]cn2 62a_100011218342_100000707719 [0,0,0,0,0,2|1,0,0]=3 18969 B16R2.2257 c1ccc(cc1)SCSCc2cscn2 62a_100000205941_100011218342 [0,0,0,0,0,2|2,0,0]=4 18970 B16R2.2257 c1ccc(cc1)SCSCc2cscn2 62a_100011218342_100000205941 [0,0,0,0,0,2|2,0,0]=4 18971 B16R2.2257 c1ccc(nc1)CCNCc2cocn2 270004a_100000211156_100000050382 [0,0,0,0,0,2|2,0,0]=4 18972 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 207a_100000211156_100000743575 [0,0,0,0,0,2|2,0,0]=4 18973 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 2230a_100015185402_100015183660 [0,0,0,0,0,2|2,0,0]=4 18974 B16R2.2257 c1ccc(nc1)CCNCc2cscn2 270004a_100000211156_100000743575 [0,0,0,0,0,2|2,0,0]=4 18975 B16R2.2257 c1ccc(nc1)CCOCc2c[nH]cn2 34a_100000210271_100000707719 [0,0,0,0,0,2|2,0,0]=4 18976 B16R2.2257 c1ccc(nc1)CCSCc2c[nH]cn2 62a_100000707719_100015183660 [0,0,0,0,0,2|2,0,0]=4 18977 B16R2.2257 c1ccc(nc1)CCSCc2c[nH]cn2 62a_100015183660_100000707719 [0,0,0,0,0,2|2,0,0]=4 18978 B16R2.2257 c1ccc(nc1)CNCCc2c[nH]cn2 270004a_100000755092_100000209966 [0,0,0,0,0,2|1,0,0]=3 18979 B16R2.2257 c1ccc(nc1)CSCCc2c[nH]cn2 62a_100000721315_100020628418 [0,0,0,0,0,2|2,0,0]=4 18980 B16R2.2257 c1ccc(nc1)CSCCc2c[nH]cn2 62a_100020628418_100000721315 [0,0,0,0,0,2|2,0,0]=4 18981 B16R2.2257 c1cnc(cn1)CNCCc2c[nH]cn2 270004a_100000755092_100000749867 [0,0,0,0,0,2|2,0,0]=4 18982 B16R2.2257 c1cnc(nc1)CNCCc2c[nH]cn2 270004a_100000755092_100011532527 [0,0,0,0,0,2|2,0,0]=4 18983 B16R2.2257 c1cncc(c1)CCNCc2c[nH]cn2 2230a_100000736294_100000707719 [0,0,0,0,0,2|1,0,0]=3 18984 B16R2.2257 c1cncc(c1)CCNCc2cocn2 270004a_100000736294_100000050382 [0,0,0,0,0,2|2,0,0]=4 18985 B16R2.2257 c1cncc(c1)CCNCc2cscn2 207a_100000736294_100000743575 [0,0,0,0,0,2|2,0,0]=4 18986 B16R2.2257 c1cncc(c1)CCNCc2cscn2 2230a_100000736294_100000205941 [0,0,0,0,0,2|2,0,0]=4 18987 B16R2.2257 c1cncc(c1)CCNCc2cscn2 2230a_100015185402_200011713674 [0,0,0,0,0,2|2,0,0]=4 18988 B16R2.2257 c1cncc(c1)CCNCc2cscn2 270004a_100000736294_100000743575 [0,0,0,0,0,2|2,0,0]=4 18989 B16R2.2257 c1cncc(c1)CCOCc2c[nH]cn2 34a_100011217484_100000707719 [0,0,0,0,0,2|2,0,0]=4 18990 B16R2.2257 c1cncc(c1)CCSCc2c[nH]cn2 62a_100000707719_200011713674 [0,0,0,0,0,2|2,0,0]=4 18991 B16R2.2257 c1cncc(c1)CCSCc2c[nH]cn2 62a_200011713674_100000707719 [0,0,0,0,0,2|2,0,0]=4 18992 B16R2.2257 c1cncc(c1)CNCCc2c[nH]cn2 270004a_100000755092_100000209961 [0,0,0,0,0,2|1,0,0]=3 18993 B16R2.2257 c1cncc(c1)CSCCc2c[nH]cn2 62a_100000741622_100020628418 [0,0,0,0,0,2|2,0,0]=4 18994 B16R2.2257 c1cncc(c1)CSCCc2c[nH]cn2 62a_100020628418_100000741622 [0,0,0,0,0,2|2,0,0]=4 18995 B16R2.2257 c1cnnc(c1)CNCCc2c[nH]cn2 2230a_100159270163_100020628418 [0,0,0,0,0,2|2,0,0]=4 18996 B16R2.2257 c1ncc(cn1)CNCCc2c[nH]cn2 2230a_100011243677_100020628418 [0,0,0,0,0,2|2,0,0]=4 18997 B16R2.2257 c1ncc(cn1)CNCCc2c[nH]cn2 270004a_100000755092_100000749868 [0,0,0,0,0,2|2,0,0]=4