0 B15R1.3174 C=CC(=O)NCCNCc1nc[nH]c1C 207a_114873766552_100000032982 [0,0,0,0,0,0|2,1,1]=4 1 B15R1.3174 C=CC(=O)NCCNCc1nc[nH]c1C 2230a_114873766552_100000751220 [0,0,0,0,0,0|2,1,1]=4 2 B15R1.3174 C=CC(=O)OCCSCc1nc[nH]c1C 62a_100000751220_100009813456 [0,0,0,0,0,0|2,1,1]=4 3 B15R1.3174 C=CC(=O)OCCSCc1nc[nH]c1C 62a_100009813456_100000751220 [0,0,0,0,0,0|2,1,1]=4 4 B15R1.3174 CCC(=O)NCCNCc1nc[nH]c1C 207a_100132302217_100000032982 [0,0,0,0,0,0|2,1,0]=3 5 B15R1.3174 CCC(=O)NCCNCc1ncoc1C 34a_100132302217_200000693990 [0,0,0,0,0,0|3,1,0]=4 6 B15R1.3174 CCC(=O)NCCOCc1ncoc1C 34a_200000158885_200000693990 [0,0,0,0,0,0|2,2,0]=4 7 B15R1.3174 CCC(=O)NCCOCc1ncoc1C 7a_200000158885_200000693990 [0,0,0,0,0,0|2,2,0]=4 8 B15R1.3174 CCN(C)CCCSCc1nc[nH]c1C 62a_100000751220_100015186262 [0,0,0,0,0,0|4,0,0]=4 9 B15R1.3174 CNC(=O)CCCNCc1nc[nH]c1C 207a_100000740002_100000032982 [0,0,0,0,0,0|2,1,0]=3 10 B15R1.3174 CNC(=O)CCCNCc1nc[nH]c1C 2230a_100000740002_100000751220 [0,0,0,0,0,0|2,1,0]=3 11 B15R1.3174 CNC(=O)CCCNCc1ncoc1C 2230a_100000740002_200000693990 [0,0,0,0,0,0|3,1,0]=4 12 B15R1.3174 CNC(=O)CCCNCc1ncoc1C 34a_100000740002_200000693990 [0,0,0,0,0,0|3,1,0]=4 13 B15R1.3174 CNC(=O)CCCOCc1ncoc1C 34a_100012017639_100000741757 [0,0,0,0,0,0|2,2,0]=4 14 B15R1.3174 CNC(=O)CCCSCc1nc[nH]c1C 62a_100000741757_100000751220 [0,0,0,0,0,0|1,1,0]=2 15 B15R1.3174 CNC(=O)CCCSCc1nc[nH]c1C 62a_100000751220_100000741757 [0,0,0,0,0,0|1,1,0]=2 16 B15R1.3174 CNC(=O)CCCSCc1nccn1C 62a_100000700302_100000741757 [0,0,0,0,0,0|3,1,0]=4 17 B15R1.3174 CNC(=O)CCCSCc1nccn1C 62a_100000741757_100000700302 [0,0,0,0,0,0|3,1,0]=4 18 B15R1.3174 CNC(=O)CCCSCc1ncoc1C 62a_100000741757_200000693990 [0,0,0,0,0,0|2,1,0]=3 19 B15R1.3174 CNC(=O)CCCSCc1ncoc1C 62a_200000693990_100000741757 [0,0,0,0,0,0|2,1,0]=3 20 B15R1.3174 CNC(=O)CCCSCc1nonc1C 62a_100000741757_200000044682 [0,0,0,0,0,0|2,1,1]=4 21 B15R1.3174 CNC(=O)CCCSCc1nonc1C 62a_200000044682_100000741757 [0,0,0,0,0,0|2,1,1]=4 22 B15R1.3174 CNC(=O)NCCNCc1nc[nH]c1C 207a_100015205895_100000032982 [0,0,0,0,0,0|1,1,0]=2 23 B15R1.3174 CNC(=O)NCCNCc1nccn1C 207a_100015205895_100000748660 [0,0,0,0,0,0|3,1,0]=4 24 B15R1.3174 CNC(=O)NCCNCc1nccn1C 34a_100015205895_100000700302 [0,0,0,0,0,0|3,1,0]=4 25 B15R1.3174 CNC(=O)NCCNCc1ncoc1C 34a_100015205895_200000693990 [0,0,0,0,0,0|2,1,0]=3 26 B15R1.3174 CNC(=O)NCCNCc1nonc1C 34a_100015205895_200000044682 [0,0,0,0,0,0|2,1,1]=4 27 B15R1.3174 CNC(=O)NCCNCc1occc1C 207a_100015205895_100000763527 [0,0,0,0,0,0|3,1,0]=4 28 B15R1.3174 CNC(=O)NCCNCc1sccc1C 207a_100015205895_100000210881 [0,0,0,0,0,0|3,1,0]=4 29 B15R1.3174 CNC(=O)NCCNCc1scnc1C 207a_100015205895_100000764165 [0,0,0,0,0,0|2,1,1]=4 30 B15R1.3174 CNC(=O)OCCOCc1ncoc1C 34a_100012017639_200011997002 [0,0,0,0,0,0|2,2,0]=4 31 B15R1.3174 CNC(=O)OCCSCc1nc[nH]c1C 62a_100000751220_200011997002 [0,0,0,0,0,0|1,1,0]=2 32 B15R1.3174 CNC(=O)OCCSCc1nc[nH]c1C 62a_200011997002_100000751220 [0,0,0,0,0,0|1,1,0]=2 33 B15R1.3174 CNC(=O)OCCSCc1nccn1C 62a_100000700302_200011997002 [0,0,0,0,0,0|3,1,0]=4 34 B15R1.3174 CNC(=O)OCCSCc1nccn1C 62a_200011997002_100000700302 [0,0,0,0,0,0|3,1,0]=4 35 B15R1.3174 CNC(=O)OCCSCc1ncoc1C 62a_200000693990_200011997002 [0,0,0,0,0,0|2,1,0]=3 36 B15R1.3174 CNC(=O)OCCSCc1ncoc1C 62a_200011997002_200000693990 [0,0,0,0,0,0|2,1,0]=3 37 B15R1.3174 CNC(=O)OCCSCc1nonc1C 62a_200000044682_200011997002 [0,0,0,0,0,0|2,1,1]=4 38 B15R1.3174 CNC(=O)OCCSCc1nonc1C 62a_200011997002_200000044682 [0,0,0,0,0,0|2,1,1]=4 39 B15R1.3174 COC(=O)/C=C/CSCc1nc[nH]c1C 62a_100000742655_100000751220 [0,0,0,0,0,0|2,1,1]=4 40 B15R1.3174 COC(=O)/C=C/CSCc1nc[nH]c1C 62a_100000751220_100000742655 [0,0,0,0,0,0|2,1,1]=4 41 B15R1.3174 COC(=O)CCCSCc1nc[nH]c1C 62a_100000751220_100011218270 [0,0,0,0,0,0|2,1,0]=3 42 B15R1.3174 COC(=O)CCCSCc1nc[nH]c1C 62a_100011218270_100000751220 [0,0,0,0,0,0|2,1,0]=3 43 B15R1.3174 COC(=O)CCCSCc1ncoc1C 62a_100011218270_200000693990 [0,0,0,0,0,0|3,1,0]=4 44 B15R1.3174 COC(=O)CCCSCc1ncoc1C 62a_200000693990_100011218270 [0,0,0,0,0,0|3,1,0]=4 45 B15R1.3174 COC(=O)NCCOCc1ncoc1C 34a_100000757965_200000693990 [0,0,0,0,0,0|2,2,0]=4 46 B14R1.168 CC(=CCCSCc1nc[nH]c1C)C 62a_100000751220_100011217483 [1,0,0,0,0,0|2,0,0]=3 47 B14R1.168 CC(=CCCSCc1nc[nH]c1C)C 62a_100011217483_100000751220 [1,0,0,0,0,0|2,0,0]=3 48 B14R1.168 CC(=CCCSCc1ncoc1C)C 62a_100011217483_200000693990 [1,0,0,0,0,0|3,0,0]=4 49 B14R1.168 CC(=CCCSCc1ncoc1C)C 62a_200000693990_100011217483 [1,0,0,0,0,0|3,0,0]=4 50 B14R1.168 CC(=O)CCCSCc1nc[nH]c1C 62a_100000751220_100011215641 [1,0,0,0,0,0|1,1,0]=3 51 B14R1.168 CC(=O)CCCSCc1nc[nH]c1C 62a_100011215641_100000751220 [1,0,0,0,0,0|1,1,0]=3 52 B14R1.168 CC(=O)CCCSCc1ncoc1C 62a_100011215641_200000693990 [1,0,0,0,0,0|2,1,0]=4 53 B14R1.168 CC(=O)CCCSCc1ncoc1C 62a_200000693990_100011215641 [1,0,0,0,0,0|2,1,0]=4 54 B14R1.168 CC(=O)NCCNCc1nc[nH]c1C 207a_100000209853_100000032982 [1,0,0,0,0,0|1,1,0]=3 55 B14R1.168 CC(=O)NCCNCc1nc[nH]c1C 2230a_100000209853_100000751220 [1,0,0,0,0,0|1,1,0]=3 56 B14R1.168 CC(=O)NCCNCc1ncoc1C 2230a_100000209853_200000693990 [1,0,0,0,0,0|2,1,0]=4 57 B14R1.168 CC(=O)NCCOCc1ncoc1C 34a_100000158858_200000693990 [1,0,0,0,0,0|1,2,0]=4 58 B14R1.168 CC(=O)NCCSCc1nc[nH]c1C 62a_100000189650_100000751220 [1,0,0,0,0,0|0,1,0]=2 59 B14R1.168 CC(=O)NCCSCc1nc[nH]c1C 62a_100000751220_100000189650 [1,0,0,0,0,0|0,1,0]=2 60 B14R1.168 CC(=O)NCCSCc1nccn1C 62a_100000189650_100000700302 [1,0,0,0,0,0|2,1,0]=4 61 B14R1.168 CC(=O)NCCSCc1nccn1C 62a_100000700302_100000189650 [1,0,0,0,0,0|2,1,0]=4 62 B14R1.168 CC(=O)NCCSCc1ncoc1C 62a_100000189650_200000693990 [1,0,0,0,0,0|1,1,0]=3 63 B14R1.168 CC(=O)NCCSCc1ncoc1C 62a_200000693990_100000189650 [1,0,0,0,0,0|1,1,0]=3 64 B14R1.168 CC(=O)NCCSCc1nonc1C 62a_100000189650_200000044682 [1,0,0,0,0,0|1,1,1]=4 65 B14R1.168 CC(=O)NCCSCc1nonc1C 62a_200000044682_100000189650 [1,0,0,0,0,0|1,1,1]=4 66 B14R1.168 CC(=O)OCCSCc1nc[nH]c1C 62a_100000751220_100009814007 [1,0,0,0,0,0|1,1,0]=3 67 B14R1.168 CC(=O)OCCSCc1nc[nH]c1C 62a_100009814007_100000751220 [1,0,0,0,0,0|1,1,0]=3 68 B14R1.168 CC(=O)OCCSCc1ncoc1C 62a_100009814007_200000693990 [1,0,0,0,0,0|2,1,0]=4 69 B14R1.168 CC(=O)OCCSCc1ncoc1C 62a_200000693990_100009814007 [1,0,0,0,0,0|2,1,0]=4 70 B14R1.168 CC(=S)OCCCSc1nc[nH]c1C 62a_100010186451_200135323944 [1,0,0,0,0,0|3,0,0]=4 71 B14R1.168 CC(=S)OCCCSc1nc[nH]c1C 62a_200135323944_100010186451 [1,0,0,0,0,0|3,0,0]=4 72 B14R1.168 Cc1[nH]cnc1CNCCNC(=O)N 207a_100020590234_100000032982 [1,0,0,0,0,0|1,1,0]=3 73 B14R1.168 Cc1[nH]cnc1CSCCC=C(F)F 62a_100000751220_200009816681 [1,0,0,0,0,0|3,0,0]=4 74 B14R1.168 Cc1[nH]cnc1CSCCC=C(F)F 62a_200009816681_100000751220 [1,0,0,0,0,0|3,0,0]=4 75 B14R1.168 Cc1[nH]cnc1CSCCCC(=O)N 62a_100000751220_100102525003 [1,0,0,0,0,0|1,1,0]=3 76 B14R1.168 Cc1[nH]cnc1CSCCCC(=O)N 62a_100102525003_100000751220 [1,0,0,0,0,0|1,1,0]=3 77 B14R1.168 Cc1[nH]cnc1CSCCCC(C)C 62a_100000751220_100011214892 [1,0,0,0,0,0|2,0,1]=4 78 B14R1.168 Cc1[nH]cnc1CSCCCC(C)C 62a_100011214892_100000751220 [1,0,0,0,0,0|2,0,1]=4 79 B14R1.168 Cc1[nH]cnc1CSCCCC(C)O 62a_100000751220_200000718107 [1,0,0,0,0,0|1,1,1]=4 80 B14R1.168 Cc1[nH]cnc1CSCCCC(C)O 62a_200000718107_100000751220 [1,0,0,0,0,0|1,1,1]=4 81 B14R1.168 Cc1[nH]cnc1CSCCCN(C)C 62a_100000751220_100000757444 [1,0,0,0,0,0|3,0,0]=4 82 B14R1.168 Cc1[nH]cnc1CSCCNC(=O)N 62a_100000751220_200000034859 [1,0,0,0,0,0|0,1,0]=2 83 B14R1.168 Cc1[nH]cnc1CSCCNC(=O)N 62a_200000034859_100000751220 [1,0,0,0,0,0|0,1,0]=2 84 B14R1.168 Cc1[nH]cnc1CSCCOC(=O)N 62a_100000751220_200011214921 [1,0,0,0,0,0|1,1,0]=3 85 B14R1.168 Cc1[nH]cnc1CSCCOC(=O)N 62a_200011214921_100000751220 [1,0,0,0,0,0|1,1,0]=3 86 B14R1.168 Cc1[nH]cnc1CSCCOC(C)C 62a_100000211751_100000751220 [1,0,0,0,0,0|2,0,1]=4 87 B14R1.168 Cc1[nH]cnc1CSCCOC(C)C 62a_100000751220_100000211751 [1,0,0,0,0,0|2,0,1]=4 88 B14R1.168 Cc1[nH]cnc1CSCCSC(C)C 62a_100000730970_100000751220 [1,0,0,0,0,0|2,0,1]=4 89 B14R1.168 Cc1[nH]cnc1CSCCSC(C)C 62a_100000751220_100000730970 [1,0,0,0,0,0|2,0,1]=4 90 B14R1.168 Cc1nonc1CSCCNC(=O)N 62a_200000034859_200000044682 [1,0,0,0,0,0|1,1,1]=4 91 B14R1.168 Cc1nonc1CSCCNC(=O)N 62a_200000044682_200000034859 [1,0,0,0,0,0|1,1,1]=4 92 B14R1.168 Cc1ocnc1CNCCNC(=O)N 34a_100020590234_200000693990 [1,0,0,0,0,0|2,1,0]=4 93 B14R1.168 Cc1ocnc1COCCNC(=O)N 34a_100000181757_200000693990 [1,0,0,0,0,0|1,2,0]=4 94 B14R1.168 Cc1ocnc1CSCCCC(=O)N 62a_100102525003_200000693990 [1,0,0,0,0,0|2,1,0]=4 95 B14R1.168 Cc1ocnc1CSCCCC(=O)N 62a_200000693990_100102525003 [1,0,0,0,0,0|2,1,0]=4 96 B14R1.168 Cc1ocnc1CSCCNC(=O)N 62a_200000034859_200000693990 [1,0,0,0,0,0|1,1,0]=3 97 B14R1.168 Cc1ocnc1CSCCNC(=O)N 62a_200000693990_200000034859 [1,0,0,0,0,0|1,1,0]=3 98 B14R1.168 Cc1ocnc1CSCCOC(=O)N 62a_200000693990_200011214921 [1,0,0,0,0,0|2,1,0]=4 99 B14R1.168 Cc1ocnc1CSCCOC(=O)N 62a_200011214921_200000693990 [1,0,0,0,0,0|2,1,0]=4 100 B14R1.168 Cn1ccnc1CSCCNC(=O)N 62a_100000700302_200000034859 [1,0,0,0,0,0|2,1,0]=4 101 B14R1.168 Cn1ccnc1CSCCNC(=O)N 62a_200000034859_100000700302 [1,0,0,0,0,0|2,1,0]=4 102 B14R1.216 CC/C=C\CCSCc1nc[nH]c1C 62a_100000751220_100015370543 [1,0,0,0,0,0|2,0,0]=3 103 B14R1.216 CC/C=C\CCSCc1nc[nH]c1C 62a_100015370543_100000751220 [1,0,0,0,0,0|2,0,0]=3 104 B14R1.216 CC/C=C\CCSCc1ncoc1C 62a_100015370543_200000693990 [1,0,0,0,0,0|3,0,0]=4 105 B14R1.216 CC/C=C\CCSCc1ncoc1C 62a_200000693990_100015370543 [1,0,0,0,0,0|3,0,0]=4 106 B14R1.216 CCCCCCSCc1nc[nH]c1C 62a_100000210314_100000751220 [1,0,0,0,0,0|2,0,1]=4 107 B14R1.216 CCCCCCSCc1nc[nH]c1C 62a_100000751220_100000210757 [1,0,0,0,0,0|2,0,1]=4 108 B14R1.216 CCCOCCSCc1nc[nH]c1C 62a_100000751220_100011215938 [1,0,0,0,0,0|2,0,1]=4 109 B14R1.216 CCCOCCSCc1nc[nH]c1C 62a_100011215938_100000751220 [1,0,0,0,0,0|2,0,1]=4 110 B14R1.216 CCOCCCSCc1nc[nH]c1C 62a_100000751220_100012232248 [1,0,0,0,0,0|3,0,0]=4 111 B14R1.216 CCOCCCSCc1nc[nH]c1C 62a_100012232248_100000751220 [1,0,0,0,0,0|3,0,0]=4 112 B14R1.216 COCCCCSCc1nc[nH]c1C 62a_100000730899_100000751220 [1,0,0,0,0,0|2,0,1]=4 113 B14R1.216 COCCCCSCc1nc[nH]c1C 62a_100000751220_100000730899 [1,0,0,0,0,0|2,0,1]=4 114 B14R1.730 CCC(=O)NCCNCc1c[nH]cn1 34a_100132302217_100000707719 [1,0,0,0,0,0|2,1,0]=4 115 B14R1.730 CCC(=O)NCCOCc1c[nH]cn1 34a_200000158885_100000707719 [1,0,0,0,0,0|1,2,0]=4 116 B14R1.730 CNC(=O)CCCNCc1c[nH]cn1 2230a_100000740002_100000707719 [1,0,0,0,0,0|2,1,0]=4 117 B14R1.730 CNC(=O)CCCNCc1c[nH]cn1 34a_100000740002_100000707719 [1,0,0,0,0,0|2,1,0]=4 118 B14R1.730 CNC(=O)CCCSCc1c[nH]cn1 62a_100000707719_100000741757 [1,0,0,0,0,0|1,1,0]=3 119 B14R1.730 CNC(=O)CCCSCc1c[nH]cn1 62a_100000741757_100000707719 [1,0,0,0,0,0|1,1,0]=3 120 B14R1.730 CNC(=O)CCCSCc1cscn1 62a_100000205941_100000741757 [1,0,0,0,0,0|2,1,0]=4 121 B14R1.730 CNC(=O)CCCSCc1cscn1 62a_100000741757_100000205941 [1,0,0,0,0,0|2,1,0]=4 122 B14R1.730 CNC(=O)NCCNCc1c[nH]cn1 34a_100015205895_100000707719 [1,0,0,0,0,0|1,1,0]=3 123 B14R1.730 CNC(=O)NCCNCc1cscn1 207a_100015205895_100000743575 [1,0,0,0,0,0|2,1,0]=4 124 B14R1.730 CNC(=O)NCCNCc1cscn1 34a_100015205895_100000205941 [1,0,0,0,0,0|2,1,0]=4 125 B14R1.730 CNC(=O)NCCSCc1ccco1 2708a_100000184675_106832991635 [1,0,0,0,0,0|2,1,0]=4 126 B14R1.730 CNC(=O)NCCSCc1ccco1 2708a_100102657272_100000184675 [1,0,0,0,0,0|2,1,0]=4 127 B14R1.730 CNC(=O)NCCSCc1ccco1 273464a_100000184675_100102657272 [1,0,0,0,0,0|2,1,0]=4 128 B14R1.730 CNC(=O)NCCSCc1ccco1 273464a_100102657272_100000184675 [1,0,0,0,0,0|2,1,0]=4 129 B14R1.730 CNC(=O)NCCSCc1ccco1 512a_100000184675_100102657272 [1,0,0,0,0,0|2,1,0]=4 130 B14R1.730 CNC(=O)NCCSCc1ccco1 512a_106832991638_100000184675 [1,0,0,0,0,0|2,1,0]=4 131 B14R1.730 CNC(=O)OCCSCc1c[nH]cn1 62a_100000707719_200011997002 [1,0,0,0,0,0|1,1,0]=3 132 B14R1.730 CNC(=O)OCCSCc1c[nH]cn1 62a_200011997002_100000707719 [1,0,0,0,0,0|1,1,0]=3 133 B14R1.730 CNC(=O)OCCSCc1cscn1 62a_100000205941_200011997002 [1,0,0,0,0,0|2,1,0]=4 134 B14R1.730 CNC(=O)OCCSCc1cscn1 62a_200011997002_100000205941 [1,0,0,0,0,0|2,1,0]=4 135 B14R1.730 COC(=O)CCCSCc1c[nH]cn1 62a_100000707719_100011218270 [1,0,0,0,0,0|2,1,0]=4 136 B14R1.730 COC(=O)CCCSCc1c[nH]cn1 62a_100011218270_100000707719 [1,0,0,0,0,0|2,1,0]=4 137 B14R1.730 COC(=O)NCCOCc1c[nH]cn1 34a_100000757965_100000707719 [1,0,0,0,0,0|1,2,0]=4 138 B16R1.8784 C=C(C)C(=O)NCCNCc1nc[nH]c1C 207a_100102636416_100000032982 [0,1,0,0,0,0|2,1,0]=4 139 B16R1.8784 C=C(C)C(=O)NCCNCc1nc[nH]c1C 2230a_100102636416_100000751220 [0,1,0,0,0,0|2,1,0]=4 140 B16R1.8784 C=C(C)C(=O)OCCSCc1nc[nH]c1C 62a_100000751220_100009816335 [0,1,0,0,0,0|2,1,0]=4 141 B16R1.8784 C=C(C)C(=O)OCCSCc1nc[nH]c1C 62a_100009816335_100000751220 [0,1,0,0,0,0|2,1,0]=4 142 B16R1.8784 Cc1[nH]cnc1CNCCCC(=O)N(C)C 207a_200000744827_100000032982 [0,1,0,0,0,0|2,1,0]=4 143 B16R1.8784 Cc1[nH]cnc1CNCCCC(=O)N(C)C 2230a_200000744827_100000751220 [0,1,0,0,0,0|2,1,0]=4 144 B16R1.8784 Cc1[nH]cnc1CNCCNC(=O)C(C)C 207a_100000752568_100000032982 [0,1,0,0,0,0|2,1,0]=4 145 B16R1.8784 Cc1[nH]cnc1CNCCNC(=O)C(C)C 2230a_100000752568_100000751220 [0,1,0,0,0,0|2,1,0]=4 146 B16R1.8784 Cc1[nH]cnc1CSCCCC(=O)N(C)C 62a_100000737642_100000751220 [0,1,0,0,0,0|1,1,0]=3 147 B16R1.8784 Cc1[nH]cnc1CSCCCC(=O)N(C)C 62a_100000751220_100000737642 [0,1,0,0,0,0|1,1,0]=3 148 B16R1.8784 Cc1ocnc1CSCCCC(=O)N(C)C 62a_100000737642_200000693990 [0,1,0,0,0,0|2,1,0]=4 149 B16R1.8784 Cc1ocnc1CSCCCC(=O)N(C)C 62a_200000693990_100000737642 [0,1,0,0,0,0|2,1,0]=4 150 B16R1.14009 CCOC(=O)CCCSCc1nc[nH]c1C 62a_100000751220_100009991533 [0,1,0,0,0,0|2,1,0]=4 151 B16R1.14009 CCOC(=O)CCCSCc1nc[nH]c1C 62a_100009991533_100000751220 [0,1,0,0,0,0|2,1,0]=4 152 B16R1.14009 CCOC(=O)NCCSCc1nc[nH]c1C 62a_100000751220_200011445536 [0,1,0,0,0,0|1,1,0]=3 153 B16R1.14009 CCOC(=O)NCCSCc1ncoc1C 62a_200000693990_200011445536 [0,1,0,0,0,0|2,1,0]=4 154 B16R1.16979 CCC(=O)NCCNCc1nc([nH]c1C)C 207a_100132302217_100009834603 [0,1,0,0,0,0|2,1,0]=4 155 B16R1.16979 CNC(=O)CCCNCc1nc([nH]c1C)C 207a_100000740002_100009834603 [0,1,0,0,0,0|2,1,0]=4 156 B16R1.16979 CNC(=O)NCCNCc1nc([nH]c1C)C 207a_100015205895_100009834603 [0,1,0,0,0,0|1,1,0]=3 157 B16R1.17220 COC(=O)C[C@@H](O)CSCc1nc[nH]c1C 62a_100000751220_100000754131 [0,1,0,0,0,0|2,1,0]=4 158 B16R1.17220 COC(=O)C[C@@H](O)CSCc1nc[nH]c1C 62a_100000754131_100000751220 [0,1,0,0,0,0|2,1,0]=4 159 B16R1.17220 COC(=O)NC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000010850 [0,1,0,0,0,0|1,1,1]=4 160 B16R1.17409 COC(=O)C(C)CCSCc1nc[nH]c1C 62a_100000034942_100000751220 [0,1,0,0,0,0|2,1,0]=4 161 B16R1.17409 COC(=O)C(C)CCSCc1nc[nH]c1C 62a_100000751220_100000034942 [0,1,0,0,0,0|2,1,0]=4 162 B16R2.1067 Cc1[nH]cnc1CNC2CCC(=O)NC2 207a_100000748762_100000032982 [0,0,0,1,0,0|2,1,0]=4 163 B16R2.1067 Cc1[nH]cnc1CNC2CCC(=O)NC2 2230a_100000748762_100000751220 [0,0,0,1,0,0|2,1,0]=4 164 B16R2.1067 Cc1ocnc1COC2CNC(=O)NC2 34a_100000080929_200000693990 [0,0,0,1,0,0|1,2,0]=4 165 B16R2.2850 Cc1[nH]cnc1CNCC2CNC(=O)C2 207a_100016993742_100000032982 [0,0,0,1,0,0|2,1,0]=4 166 B16R2.2850 Cc1[nH]cnc1CNCC2CNC(=O)C2 2230a_100016993742_100000751220 [0,0,0,1,0,0|2,1,0]=4 167 B16R2.2850 Cc1[nH]cnc1CNC[C@H]2CCC(=O)N2 207a_100015423886_100000032982 [0,0,0,1,0,0|2,1,0]=4 168 B16R2.2850 Cc1[nH]cnc1CNC[C@H]2CCC(=O)N2 2230a_100015423886_100000751220 [0,0,0,1,0,0|2,1,0]=4 169 B16R2.2850 Cc1[nH]cnc1CSCC2CNC(=O)O2 62a_100000181169_100000751220 [0,0,0,1,0,0|1,1,0]=3 170 B16R2.2850 Cc1[nH]cnc1CSCC2CNC(=O)O2 62a_100000751220_100000181169 [0,0,0,1,0,0|1,1,0]=3 171 B16R2.2850 Cc1[nH]cnc1CSCC2COC(=O)O2 62a_100000073702_100000751220 [0,0,0,1,0,0|2,1,0]=4 172 B16R2.2850 Cc1[nH]cnc1CSCC2COC(=O)O2 62a_100000751220_100000073702 [0,0,0,1,0,0|2,1,0]=4 173 B16R2.2850 Cc1[nH]cnc1CSC[C@@H]2CCC(=O)N2 62a_100000751220_100015189358 [0,0,0,1,0,0|1,1,0]=3 174 B16R2.2850 Cc1[nH]cnc1CSC[C@@H]2CCC(=O)N2 62a_100015189358_100000751220 [0,0,0,1,0,0|1,1,0]=3 175 B16R2.2850 Cc1[nH]cnc1CSC[C@H]2COC(=O)N2 62a_100000751220_100015307671 [0,0,0,1,0,0|1,1,0]=3 176 B16R2.2850 Cc1[nH]cnc1CSC[C@H]2COC(=O)N2 62a_100015307671_100000751220 [0,0,0,1,0,0|1,1,0]=3 177 B16R2.2850 Cc1[nH]cnc1CSCc2n[nH]c(=O)[nH]2 62a_100000751220_100000754189 [0,0,0,1,0,0|1,1,1]=4 178 B16R2.2850 Cc1ocnc1CSCC2CNC(=O)O2 62a_100000181169_200000693990 [0,0,0,1,0,0|2,1,0]=4 179 B16R2.2850 Cc1ocnc1CSCC2CNC(=O)O2 62a_200000693990_100000181169 [0,0,0,1,0,0|2,1,0]=4 180 B16R2.2850 Cc1ocnc1CSC[C@@H]2CCC(=O)N2 62a_100015189358_200000693990 [0,0,0,1,0,0|2,1,0]=4 181 B16R2.2850 Cc1ocnc1CSC[C@@H]2CCC(=O)N2 62a_200000693990_100015189358 [0,0,0,1,0,0|2,1,0]=4 182 B16R2.2850 Cc1ocnc1CSC[C@H]2COC(=O)N2 62a_100015307671_200000693990 [0,0,0,1,0,0|2,1,0]=4 183 B16R2.2850 Cc1ocnc1CSC[C@H]2COC(=O)N2 62a_200000693990_100015307671 [0,0,0,1,0,0|2,1,0]=4 184 B16R2.2930 Cc1[nH]cnc1CN2CCNC(=O)C2C 2230a_100000750721_100000751220 [0,0,0,1,0,0|2,1,0]=4 185 B16R2.2930 Cc1[nH]cnc1CN2CCNC(=O)C2C 269982a_100000750721_100000751220 [0,0,0,1,0,0|2,1,0]=4 186 B16R2.4013 Cc1[nH]cnc1CSCCC2CCC2=O 62a_100000751220_200016118888 [0,0,0,1,0,0|2,1,0]=4 187 B16R2.4013 Cc1[nH]cnc1CSCCC2CCC2=O 62a_200016118888_100000751220 [0,0,0,1,0,0|2,1,0]=4 188 B16R2.14499 Cc1[nH]cnc1CN2CCNC(=O)CC2 2230a_100000698595_100000751220 [0,0,0,1,0,0|2,1,0]=4 189 B16R2.14499 Cc1[nH]cnc1CN2CCNC(=O)CC2 269982a_100000698595_100000751220 [0,0,0,1,0,0|2,1,0]=4 190 B14R1.819 CNC(=O)CCCSc1nc[nH]c1C 62a_100000741757_100010186451 [0,0,0,0,1,0|1,1,0]=3 191 B14R1.819 CNC(=O)CCCSc1nc[nH]c1C 62a_100010186451_100000741757 [0,0,0,0,1,0|1,1,0]=3 192 B14R1.819 CNC(=O)CCCSc1ncsc1C 62a_100000732656_100000741757 [0,0,0,0,1,0|2,1,0]=4 193 B14R1.819 CNC(=O)CCCSc1ncsc1C 62a_100000741757_100000732656 [0,0,0,0,1,0|2,1,0]=4 194 B14R1.819 CNC(=O)CCNCc1nc[nH]c1C 207a_100000738227_100000032982 [0,0,0,0,1,0|1,1,0]=3 195 B14R1.819 CNC(=O)CCNCc1nc[nH]c1C 2230a_100000738227_100000751220 [0,0,0,0,1,0|1,1,0]=3 196 B14R1.819 CNC(=O)CCNCc1ncoc1C 2230a_100000738227_200000693990 [0,0,0,0,1,0|2,1,0]=4 197 B14R1.819 CNC(=O)CCNCc1ncoc1C 34a_100000738227_200000693990 [0,0,0,0,1,0|2,1,0]=4 198 B14R1.819 CNC(=O)CCOCc1ncoc1C 34a_100000754576_200000693990 [0,0,0,0,1,0|1,2,0]=4 199 B14R1.819 CNC(=O)CCOCc1ncoc1C 34a_100012017639_100012179268 [0,0,0,0,1,0|1,2,0]=4 200 B14R1.819 CNC(=O)CCSCc1nc[nH]c1C 62a_100000737683_100000751220 [0,0,0,0,1,0|0,1,0]=2 201 B14R1.819 CNC(=O)CCSCc1nc[nH]c1C 62a_100000751220_100000737683 [0,0,0,0,1,0|0,1,0]=2 202 B14R1.819 CNC(=O)CCSCc1nccn1C 62a_100000700302_100000737683 [0,0,0,0,1,0|2,1,0]=4 203 B14R1.819 CNC(=O)CCSCc1nccn1C 62a_100000737683_100000700302 [0,0,0,0,1,0|2,1,0]=4 204 B14R1.819 CNC(=O)CCSCc1ncoc1C 62a_100000737683_200000693990 [0,0,0,0,1,0|1,1,0]=3 205 B14R1.819 CNC(=O)CCSCc1ncoc1C 62a_200000693990_100000737683 [0,0,0,0,1,0|1,1,0]=3 206 B14R1.819 CNC(=O)CCSCc1nonc1C 62a_100000737683_200000044682 [0,0,0,0,1,0|1,1,1]=4 207 B14R1.819 CNC(=O)CCSCc1nonc1C 62a_200000044682_100000737683 [0,0,0,0,1,0|1,1,1]=4 208 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 2708a_100000736106_106832991635 [0,0,0,0,1,0|2,1,0]=4 209 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 2708a_100102657272_100000736106 [0,0,0,0,1,0|2,1,0]=4 210 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 273464a_100000736106_100102657272 [0,0,0,0,1,0|2,1,0]=4 211 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 273464a_100102657272_100000736106 [0,0,0,0,1,0|2,1,0]=4 212 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 512a_100000736106_100102657272 [0,0,0,0,1,0|2,1,0]=4 213 B14R1.819 CNC(=O)NCCCc1cn[nH]c1C 512a_106832991638_100000736106 [0,0,0,0,1,0|2,1,0]=4 214 B14R1.819 CNC(=O)NCCSc1nccn1C 2708a_100025754576_106832991635 [0,0,0,0,1,0|2,1,0]=4 215 B14R1.819 CNC(=O)NCCSc1nccn1C 2708a_100102657272_100025754576 [0,0,0,0,1,0|2,1,0]=4 216 B14R1.819 CNC(=O)NCCSc1nccn1C 273464a_100025754576_100102657272 [0,0,0,0,1,0|2,1,0]=4 217 B14R1.819 CNC(=O)NCCSc1nccn1C 273464a_100102657272_100025754576 [0,0,0,0,1,0|2,1,0]=4 218 B14R1.819 CNC(=O)NCCSc1nccn1C 512a_100025754576_100102657272 [0,0,0,0,1,0|2,1,0]=4 219 B14R1.819 CNC(=O)NCCSc1nccn1C 512a_106832991638_100025754576 [0,0,0,0,1,0|2,1,0]=4 220 B14R1.819 CNC(=O)OCCSc1nc[nH]c1C 62a_100010186451_200011997002 [0,0,0,0,1,0|1,1,0]=3 221 B14R1.819 CNC(=O)OCCSc1nc[nH]c1C 62a_200011997002_100010186451 [0,0,0,0,1,0|1,1,0]=3 222 B14R1.819 CNC(=O)OCCSc1ncsc1C 62a_100000732656_200011997002 [0,0,0,0,1,0|2,1,0]=4 223 B14R1.819 CNC(=O)OCCSc1ncsc1C 62a_200011997002_100000732656 [0,0,0,0,1,0|2,1,0]=4 224 B14R1.819 COC(=O)CCCSc1nc[nH]c1C 62a_100010186451_100011218270 [0,0,0,0,1,0|2,1,0]=4 225 B14R1.819 COC(=O)CCCSc1nc[nH]c1C 62a_100011218270_100010186451 [0,0,0,0,1,0|2,1,0]=4 226 B14R1.819 COC(=O)CCSCc1nc[nH]c1C 62a_100000204255_100000751220 [0,0,0,0,1,0|1,1,0]=3 227 B14R1.819 COC(=O)CCSCc1nc[nH]c1C 62a_100000751220_100000204255 [0,0,0,0,1,0|1,1,0]=3 228 B14R1.819 COC(=O)CCSCc1ncoc1C 62a_100000204255_200000693990 [0,0,0,0,1,0|2,1,0]=4 229 B14R1.819 COC(=O)CCSCc1ncoc1C 62a_200000693990_100000204255 [0,0,0,0,1,0|2,1,0]=4 230 B14R1.819 COC(=O)OCSCc1nc[nH]c1C 62a_100000751220_100000139417 [0,0,0,0,1,0|2,1,0]=4 231 B16R1.1133 CNC(=O)CCCSCc1cnccc1C 62a_100000690890_100000741757 [0,0,0,0,0,1|2,1,0]=4 232 B16R1.1133 CNC(=O)CCCSCc1cnccc1C 62a_100000741757_100000690890 [0,0,0,0,0,1|2,1,0]=4 233 B16R1.1133 CNC(=O)CCCSCc1ncccc1C 62a_100000696600_100000741757 [0,0,0,0,0,1|2,1,0]=4 234 B16R1.1133 CNC(=O)CCCSCc1ncccc1C 62a_100000741757_100000696600 [0,0,0,0,0,1|2,1,0]=4 235 B16R1.1133 CNC(=O)NCCNCc1cnccc1C 207a_100015205895_100000685662 [0,0,0,0,0,1|2,1,0]=4 236 B16R1.1133 CNC(=O)NCCNCc1cnccc1C 34a_100015205895_100000690890 [0,0,0,0,0,1|2,1,0]=4 237 B16R1.1133 CNC(=O)NCCNCc1ncccc1C 207a_100015205895_100000698913 [0,0,0,0,0,1|2,1,0]=4 238 B16R1.1133 CNC(=O)NCCNCc1ncccc1C 34a_100015205895_100000696600 [0,0,0,0,0,1|2,1,0]=4 239 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 2708a_100102657272_200000189569 [0,0,0,0,0,1|2,1,0]=4 240 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 2708a_200000189569_106832991635 [0,0,0,0,0,1|2,1,0]=4 241 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 273464a_100102657272_200000189569 [0,0,0,0,0,1|2,1,0]=4 242 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 273464a_200000189569_100102657272 [0,0,0,0,0,1|2,1,0]=4 243 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 512a_106832991638_200000189569 [0,0,0,0,0,1|2,1,0]=4 244 B16R1.1133 CNC(=O)NCCSCc1ccccc1C 512a_200000189569_100102657272 [0,0,0,0,0,1|2,1,0]=4 245 B16R1.1133 CNC(=O)OCCSCc1cnccc1C 62a_100000690890_200011997002 [0,0,0,0,0,1|2,1,0]=4 246 B16R1.1133 CNC(=O)OCCSCc1cnccc1C 62a_200011997002_100000690890 [0,0,0,0,0,1|2,1,0]=4 247 B16R1.1133 CNC(=O)OCCSCc1ncccc1C 62a_100000696600_200011997002 [0,0,0,0,0,1|2,1,0]=4 248 B16R1.1133 CNC(=O)OCCSCc1ncccc1C 62a_200011997002_100000696600 [0,0,0,0,0,1|2,1,0]=4 249 B16R1.1146 CNC(=O)CCCSCc1cc(ccn1)C 62a_100000718516_100000741757 [0,0,0,0,0,1|2,1,0]=4 250 B16R1.1146 CNC(=O)CCCSCc1cc(ccn1)C 62a_100000741757_100000718516 [0,0,0,0,0,1|2,1,0]=4 251 B16R1.1146 CNC(=O)NCCNCc1cc(ccn1)C 207a_100015205895_100011361488 [0,0,0,0,0,1|2,1,0]=4 252 B16R1.1146 CNC(=O)NCCNCc1cc(ccn1)C 34a_100015205895_100000718516 [0,0,0,0,0,1|2,1,0]=4 253 B16R1.1146 CNC(=O)OCCSCc1cc(ccn1)C 62a_100000718516_200011997002 [0,0,0,0,0,1|2,1,0]=4 254 B16R1.1146 CNC(=O)OCCSCc1cc(ccn1)C 62a_200011997002_100000718516 [0,0,0,0,0,1|2,1,0]=4 255 B16R1.16885 COC(=O)CCCCSCc1nc[nH]c1C 62a_100000204269_100000751220 [0,0,0,0,0,1|2,1,0]=4 256 B16R1.16885 COC(=O)CCCCSCc1nc[nH]c1C 62a_100000751220_100000204269 [0,0,0,0,0,1|2,1,0]=4 257 B16R1.16885 COC(=O)COCCSCc1nc[nH]c1C 62a_100000090808_100000751220 [0,0,0,0,0,1|2,1,0]=4 258 B16R1.16885 COC(=O)COCCSCc1nc[nH]c1C 62a_100000751220_100000090808 [0,0,0,0,0,1|2,1,0]=4 259 B13R1.343 CC(=CCCSCc1c[nH]cn1)C 62a_100000707719_100011217483 [2,0,0,0,0,0|2,0,0]=4 260 B13R1.343 CC(=CCCSCc1c[nH]cn1)C 62a_100011217483_100000707719 [2,0,0,0,0,0|2,0,0]=4 261 B13R1.343 CC(=O)CCCSCc1c[nH]cn1 62a_100000707719_100011215641 [2,0,0,0,0,0|1,1,0]=4 262 B13R1.343 CC(=O)CCCSCc1c[nH]cn1 62a_100011215641_100000707719 [2,0,0,0,0,0|1,1,0]=4 263 B13R1.343 CC(=O)NCCNCc1c[nH]cn1 2230a_100000209853_100000707719 [2,0,0,0,0,0|1,1,0]=4 264 B13R1.343 CC(=O)NCCOCc1c[nH]cn1 34a_100000158858_100000707719 [2,0,0,0,0,0|0,2,0]=4 265 B13R1.343 CC(=O)NCCSCc1c[nH]cn1 62a_100000189650_100000707719 [2,0,0,0,0,0|0,1,0]=3 266 B13R1.343 CC(=O)NCCSCc1c[nH]cn1 62a_100000707719_100000189650 [2,0,0,0,0,0|0,1,0]=3 267 B13R1.343 CC(=O)NCCSCc1cscn1 62a_100000189650_100000205941 [2,0,0,0,0,0|1,1,0]=4 268 B13R1.343 CC(=O)NCCSCc1cscn1 62a_100000205941_100000189650 [2,0,0,0,0,0|1,1,0]=4 269 B13R1.343 CC(=O)OCCSCc1c[nH]cn1 62a_100000707719_100009814007 [2,0,0,0,0,0|1,1,0]=4 270 B13R1.343 CC(=O)OCCSCc1c[nH]cn1 62a_100009814007_100000707719 [2,0,0,0,0,0|1,1,0]=4 271 B13R1.343 NC(=O)CCCSCc1c[nH]cn1 62a_100000707719_100102525003 [2,0,0,0,0,0|1,1,0]=4 272 B13R1.343 NC(=O)CCCSCc1c[nH]cn1 62a_100102525003_100000707719 [2,0,0,0,0,0|1,1,0]=4 273 B13R1.343 NC(=O)NCCNCc1c[nH]cn1 34a_100020590234_100000707719 [2,0,0,0,0,0|1,1,0]=4 274 B13R1.343 NC(=O)NCCOCc1c[nH]cn1 34a_100000181757_100000707719 [2,0,0,0,0,0|0,2,0]=4 275 B13R1.343 NC(=O)NCCSCc1c[nH]cn1 62a_100000707719_200000034859 [2,0,0,0,0,0|0,1,0]=3 276 B13R1.343 NC(=O)NCCSCc1c[nH]cn1 62a_200000034859_100000707719 [2,0,0,0,0,0|0,1,0]=3 277 B13R1.343 NC(=O)NCCSCc1cscn1 62a_100000205941_200000034859 [2,0,0,0,0,0|1,1,0]=4 278 B13R1.343 NC(=O)NCCSCc1cscn1 62a_200000034859_100000205941 [2,0,0,0,0,0|1,1,0]=4 279 B13R1.343 NC(=O)OCCSCc1c[nH]cn1 62a_100000707719_200011214921 [2,0,0,0,0,0|1,1,0]=4 280 B13R1.343 NC(=O)OCCSCc1c[nH]cn1 62a_200011214921_100000707719 [2,0,0,0,0,0|1,1,0]=4 281 B13R1.654 C=CCCCSCc1nc[nH]c1C 62a_100000751220_100000757094 [2,0,0,0,0,0|1,0,1]=4 282 B13R1.654 C=CCCCSCc1nc[nH]c1C 62a_100011713584_100000751220 [2,0,0,0,0,0|1,0,1]=4 283 B13R1.654 C=COCCSCc1nc[nH]c1C 62a_100000039644_100000751220 [2,0,0,0,0,0|1,0,1]=4 284 B13R1.654 C=COCCSCc1nc[nH]c1C 62a_100000751220_100000039644 [2,0,0,0,0,0|1,0,1]=4 285 B13R1.654 CC/C=C\CCSc1nc[nH]c1C 62a_100010186451_100015370543 [2,0,0,0,0,0|2,0,0]=4 286 B13R1.654 CC/C=C\CCSc1nc[nH]c1C 62a_100015370543_100010186451 [2,0,0,0,0,0|2,0,0]=4 287 B13R1.654 CC/C=C\CSCc1nc[nH]c1C 62a_100000751220_100103147603 [2,0,0,0,0,0|1,0,1]=4 288 B13R1.654 CC/C=C\CSCc1nc[nH]c1C 62a_100103147603_100000751220 [2,0,0,0,0,0|1,0,1]=4 289 B13R1.654 CCCCCSCc1nc[nH]c1C 62a_100000210326_100000751220 [2,0,0,0,0,0|1,0,1]=4 290 B13R1.654 CCCCCSCc1nc[nH]c1C 62a_100000751220_100000210326 [2,0,0,0,0,0|1,0,1]=4 291 B13R1.654 CCOCCSCc1nc[nH]c1C 62a_100000210147_100000751220 [2,0,0,0,0,0|1,0,1]=4 292 B13R1.654 CCOCCSCc1nc[nH]c1C 62a_100000751220_100011215890 [2,0,0,0,0,0|1,0,1]=4 293 B13R1.654 CCSCCSCc1nc[nH]c1C 62a_100000751220_100000757381 [2,0,0,0,0,0|1,0,1]=4 294 B13R1.654 CCSCCSCc1nc[nH]c1C 62a_100000757381_100000751220 [2,0,0,0,0,0|1,0,1]=4 295 B13R1.654 COCCCSCc1nc[nH]c1C 62a_100000709357_100000751220 [2,0,0,0,0,0|1,0,1]=4 296 B13R1.654 COCCCSCc1nc[nH]c1C 62a_100000751220_100000709357 [2,0,0,0,0,0|1,0,1]=4 297 B13R1.654 Cc1[nH]cnc1CSCCCC=O 62a_100000751220_200011292268 [2,0,0,0,0,0|1,1,0]=4 298 B13R1.654 Cc1[nH]cnc1CSCCCC=O 62a_200011292268_100000751220 [2,0,0,0,0,0|1,1,0]=4 299 B13R1.119 CC/C=C\CCSCc1c[nH]cn1 62a_100000707719_100015370543 [2,0,0,0,0,0|2,0,0]=4 300 B13R1.119 CC/C=C\CCSCc1c[nH]cn1 62a_100015370543_100000707719 [2,0,0,0,0,0|2,0,0]=4 301 B15R1.254 CC(=O)NC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000183797 [1,1,0,0,0,0|0,1,1]=4 302 B15R1.254 Cc1[nH]cnc1CSCC(=O)NC(=O)N 62a_100000751220_100000182717 [1,1,0,0,0,0|0,1,1]=4 303 B15R1.5876 CC(=O)NCCC(=O)Cc1nc[nH]c1C 1458a_100000183196_100000751220 [1,1,0,0,0,0|1,1,0]=4 304 B15R1.5876 Cc1[nH]cnc1CC(=O)CCNC(=O)N 1458a_100000181464_100000751220 [1,1,0,0,0,0|1,1,0]=4 305 B15R1.6598 Cc1[nH]cnc1CSCCNS(=O)(=O)C 62a_100000751220_100000754112 [1,1,0,0,0,0|1,1,0]=4 306 B15R1.6598 Cc1[nH]cnc1CSCCNS(=O)(=O)C 62a_100000754112_100000751220 [1,1,0,0,0,0|1,1,0]=4 307 B15R1.22765 CC(=O)NCCNCc1nc([nH]c1C)C 207a_100000209853_100009834603 [1,1,0,0,0,0|1,1,0]=4 308 B15R1.22765 Cc1nc(c([nH]1)C)CNCCNC(=O)N 207a_100020590234_100009834603 [1,1,0,0,0,0|1,1,0]=4 309 B15R1.255 Cc1[nH]cnc1CSCCCCN(C)C 62a_100000751220_100000690147 [1,1,0,0,0,0|1,0,1]=4 310 B15R1.795 CCOC(=O)NCCSCc1c[nH]cn1 62a_100000707719_200011445536 [1,1,0,0,0,0|1,1,0]=4 311 B15R1.961 CNC(=O)CCCSCc1cn(cn1)C 62a_100000717665_100000741757 [1,1,0,0,0,0|1,1,0]=4 312 B15R1.961 CNC(=O)CCCSCc1cn(cn1)C 62a_100000741757_100000717665 [1,1,0,0,0,0|1,1,0]=4 313 B15R1.961 CNC(=O)NCCNCc1c[nH]c(n1)C 207a_100015205895_100011219055 [1,1,0,0,0,0|1,1,0]=4 314 B15R1.961 CNC(=O)NCCNCc1cn(cn1)C 207a_100015205895_100000684808 [1,1,0,0,0,0|1,1,0]=4 315 B15R1.961 CNC(=O)NCCNCc1cn(cn1)C 34a_100015205895_100000717665 [1,1,0,0,0,0|1,1,0]=4 316 B15R1.961 CNC(=O)OCCSCc1cn(cn1)C 62a_100000717665_200011997002 [1,1,0,0,0,0|1,1,0]=4 317 B15R1.961 CNC(=O)OCCSCc1cn(cn1)C 62a_200011997002_100000717665 [1,1,0,0,0,0|1,1,0]=4 318 B15R1.3670 CN(C)C(=O)CCCSCc1c[nH]cn1 62a_100000707719_100000737642 [1,1,0,0,0,0|1,1,0]=4 319 B15R1.3670 CN(C)C(=O)CCCSCc1c[nH]cn1 62a_100000737642_100000707719 [1,1,0,0,0,0|1,1,0]=4 320 B15R1.742 COC(=O)CC(C)SCc1nc[nH]c1C 62a_100000751220_100009817358 [0,1,0,0,1,0|1,1,0]=4 321 B15R1.742 COC(=O)CC(C)SCc1nc[nH]c1C 62a_100009817358_100000751220 [0,1,0,0,1,0|1,1,0]=4 322 B15R1.1417 CNC(=O)C(C)CNCc1nc[nH]c1C 207a_100015187722_100000032982 [0,1,0,0,1,0|1,1,0]=4 323 B15R1.1417 CNC(=O)C(C)CNCc1nc[nH]c1C 2230a_100015187722_100000751220 [0,1,0,0,1,0|1,1,0]=4 324 B15R1.1417 COC(=O)C(C)CSCc1nc[nH]c1C 62a_100000698445_100000751220 [0,1,0,0,1,0|1,1,0]=4 325 B15R1.1417 COC(=O)C(C)CSCc1nc[nH]c1C 62a_100000751220_100000698445 [0,1,0,0,1,0|1,1,0]=4 326 B15R1.5820 CNC(=O)CCC(=O)Cc1nc[nH]c1C 1458a_100011309844_100000751220 [0,1,0,0,1,0|1,1,0]=4 327 B15R1.5820 CNC(=O)CCN(C)Cc1nc[nH]c1C 2230a_100000750875_100000751220 [0,1,0,0,1,0|1,1,0]=4 328 B15R1.5820 CNC(=O)CCN(C)Cc1nc[nH]c1C 269982a_100000750875_100000751220 [0,1,0,0,1,0|1,1,0]=4 329 B15R1.11505 CNC(=O)CCCSc1nc([nH]c1C)C 62a_100000741757_200009820778 [0,1,0,0,1,0|1,1,0]=4 330 B15R1.11505 CNC(=O)CCCSc1nc([nH]c1C)C 62a_200009820778_100000741757 [0,1,0,0,1,0|1,1,0]=4 331 B15R1.11505 CNC(=O)CCNCc1nc([nH]c1C)C 207a_100000738227_100009834603 [0,1,0,0,1,0|1,1,0]=4 332 B15R1.11505 CNC(=O)OCCSc1nc([nH]c1C)C 62a_200009820778_200011997002 [0,1,0,0,1,0|1,1,0]=4 333 B15R1.11505 CNC(=O)OCCSc1nc([nH]c1C)C 62a_200011997002_200009820778 [0,1,0,0,1,0|1,1,0]=4 334 B17R1.9187 Cc1[nH]cnc1CSCCCCC(=O)N(C)C 62a_100000751220_100000752486 [0,1,0,0,0,1|1,1,0]=4 335 B17R1.9187 Cc1[nH]cnc1CSCCCCC(=O)N(C)C 62a_100000752486_100000751220 [0,1,0,0,0,1|1,1,0]=4 336 B17R1.24214 CNC(=O)NC(=O)C(C)SCc1nc[nH]c1C 62a_100000183807_100000751220 [0,2,0,0,0,0|0,1,1]=4 337 B17R1.24214 CNC(=O)NC(=O)C(C)SCc1nc[nH]c1C 62a_100000751220_100000183807 [0,2,0,0,0,0|0,1,1]=4 338 B17R1.9738 CCCNC(=O)CCCSCc1nc[nH]c1C 62a_100000751220_100011194427 [0,2,0,0,0,0|1,1,0]=4 339 B17R1.9738 CCCNC(=O)CCCSCc1nc[nH]c1C 62a_100011194427_100000751220 [0,2,0,0,0,0|1,1,0]=4 340 B17R1.21460 CCNC(=S)SCCC(=O)Cc1nc[nH]c1C 1458a_200009862762_100000751220 [0,2,0,0,0,0|2,0,0]=4 341 B17R1.21809 CCNC(=O)NC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000183762 [0,2,0,0,0,0|0,1,1]=4 342 B17R1.153364 CCc1nc(c([nH]1)C)CNCCNC(=O)NC 207a_100015205895_100000041053 [0,2,0,0,0,0|1,1,0]=4 343 B15R2.287 Cc1[nH]cnc1CNC2CNC(=O)C2 207a_100000697751_100000032982 [1,0,0,1,0,0|1,1,0]=4 344 B15R2.287 Cc1[nH]cnc1CNC2CNC(=O)C2 2230a_100000697751_100000751220 [1,0,0,1,0,0|1,1,0]=4 345 B15R2.335 Cc1[nH]cnc1CN2CCNC(=O)C2 2230a_100000184651_100000751220 [1,0,0,1,0,0|1,1,0]=4 346 B15R2.7608 Cc1[nH]cnc1CSCC2CC(=O)C2 62a_100000751220_100009874392 [1,0,0,1,0,0|1,1,0]=4 347 B15R2.7608 Cc1[nH]cnc1CSCC2CC(=O)C2 62a_100009874392_100000751220 [1,0,0,1,0,0|1,1,0]=4 348 B15R2.100 O=C1NCC(CN1)OCc2c[nH]cn2 34a_100000080929_100000707719 [1,0,0,1,0,0|0,2,0]=4 349 B15R2.286 O=C1CC[C@H](N1)CSCc2c[nH]cn2 62a_100000707719_100015189358 [1,0,0,1,0,0|1,1,0]=4 350 B15R2.286 O=C1CC[C@H](N1)CSCc2c[nH]cn2 62a_100015189358_100000707719 [1,0,0,1,0,0|1,1,0]=4 351 B15R2.286 O=C1NCC(O1)CSCc2c[nH]cn2 62a_100000181169_100000707719 [1,0,0,1,0,0|1,1,0]=4 352 B15R2.286 O=C1NCC(O1)CSCc2c[nH]cn2 62a_100000707719_100000181169 [1,0,0,1,0,0|1,1,0]=4 353 B15R2.286 O=C1N[C@H](CO1)CSCc2c[nH]cn2 62a_100000707719_100015307671 [1,0,0,1,0,0|1,1,0]=4 354 B15R2.286 O=C1N[C@H](CO1)CSCc2c[nH]cn2 62a_100015307671_100000707719 [1,0,0,1,0,0|1,1,0]=4 355 B17R2.23548 Cc1[nH]cnc1CSCc2n[nH]c(=O)n2C 62a_100000751220_100010408635 [0,0,0,1,0,1|0,1,1]=4 356 B17R2.23548 Cc1[nH]cnc1CSCc2n[nH]c(=O)n2C 62a_100010408635_100000751220 [0,0,0,1,0,1|0,1,1]=4 357 B17R2.5040 Cc1[nH]cnc1CNCCN2CCNC2=O 207a_100011207550_100000032982 [0,1,0,1,0,0|1,1,0]=4 358 B17R2.5040 Cc1[nH]cnc1CNCCN2CCNC2=O 2230a_100011207550_100000751220 [0,1,0,1,0,0|1,1,0]=4 359 B17R2.5040 Cc1[nH]cnc1CSCCN2CCCC2=O 62a_100000739059_100000751220 [0,1,0,1,0,0|1,1,0]=4 360 B17R2.5040 Cc1[nH]cnc1CSCCN2CCCC2=O 62a_100000751220_100000739059 [0,1,0,1,0,0|1,1,0]=4 361 B17R2.5040 Cc1[nH]cnc1CSCCN2CCNC2=O 62a_100000090651_100000751220 [0,1,0,1,0,0|0,1,0]=3 362 B17R2.5040 Cc1[nH]cnc1CSCCN2CCNC2=O 62a_100000751220_100000090651 [0,1,0,1,0,0|0,1,0]=3 363 B17R2.5040 Cc1ocnc1CSCCN2CCNC2=O 62a_100000090651_200000693990 [0,1,0,1,0,0|1,1,0]=4 364 B17R2.5040 Cc1ocnc1CSCCN2CCNC2=O 62a_200000693990_100000090651 [0,1,0,1,0,0|1,1,0]=4 365 B13R1.167 C=C(C)CCSCc1nc[nH]c1C 62a_100000730704_100000751220 [1,0,0,0,1,0|1,0,0]=3 366 B13R1.167 C=C(C)CCSCc1nc[nH]c1C 62a_100000751220_100000730704 [1,0,0,0,1,0|1,0,0]=3 367 B13R1.167 C=C(C)CCSCc1ncoc1C 62a_100000730704_200000693990 [1,0,0,0,1,0|2,0,0]=4 368 B13R1.167 C=C(C)CCSCc1ncoc1C 62a_200000693990_100000730704 [1,0,0,0,1,0|2,0,0]=4 369 B13R1.167 CC(=CCCSc1nc[nH]c1C)C 62a_100010186451_100011217483 [1,0,0,0,1,0|2,0,0]=4 370 B13R1.167 CC(=CCCSc1nc[nH]c1C)C 62a_100011217483_100010186451 [1,0,0,0,1,0|2,0,0]=4 371 B13R1.167 CC(=CCSCc1nc[nH]c1C)C 62a_100000751220_100000761012 [1,0,0,0,1,0|1,0,1]=4 372 B13R1.167 CC(=CCSCc1nc[nH]c1C)C 62a_100000761012_100000751220 [1,0,0,0,1,0|1,0,1]=4 373 B13R1.167 CC(=O)CCCSc1nc[nH]c1C 62a_100010186451_100011215641 [1,0,0,0,1,0|1,1,0]=4 374 B13R1.167 CC(=O)CCCSc1nc[nH]c1C 62a_100011215641_100010186451 [1,0,0,0,1,0|1,1,0]=4 375 B13R1.167 CC(=O)CCSCc1nc[nH]c1C 62a_100000053229_100000751220 [1,0,0,0,1,0|0,1,0]=3 376 B13R1.167 CC(=O)CCSCc1nc[nH]c1C 62a_100000751220_100000053229 [1,0,0,0,1,0|0,1,0]=3 377 B13R1.167 CC(=O)CCSCc1ncoc1C 62a_100000053229_200000693990 [1,0,0,0,1,0|1,1,0]=4 378 B13R1.167 CC(=O)CCSCc1ncoc1C 62a_200000693990_100000053229 [1,0,0,0,1,0|1,1,0]=4 379 B13R1.167 CC(=O)NCCSc1nc[nH]c1C 62a_100000189650_100010186451 [1,0,0,0,1,0|0,1,0]=3 380 B13R1.167 CC(=O)NCCSc1nc[nH]c1C 62a_100010186451_100000189650 [1,0,0,0,1,0|0,1,0]=3 381 B13R1.167 CC(=O)NCCSc1ncsc1C 62a_100000189650_100000732656 [1,0,0,0,1,0|1,1,0]=4 382 B13R1.167 CC(=O)NCCSc1ncsc1C 62a_100000732656_100000189650 [1,0,0,0,1,0|1,1,0]=4 383 B13R1.167 CC(=O)OCCSc1nc[nH]c1C 62a_100009814007_100010186451 [1,0,0,0,1,0|1,1,0]=4 384 B13R1.167 CC(=O)OCCSc1nc[nH]c1C 62a_100010186451_100009814007 [1,0,0,0,1,0|1,1,0]=4 385 B13R1.167 CC(=O)OCSCc1nc[nH]c1C 62a_100000076356_100000751220 [1,0,0,0,1,0|1,1,0]=4 386 B13R1.167 CC(=O)OCSCc1nc[nH]c1C 62a_100000751220_100000076356 [1,0,0,0,1,0|1,1,0]=4 387 B13R1.167 Cc1[nH]cnc1CNCCC(=O)N 207a_100000740010_100000032982 [1,0,0,0,1,0|1,1,0]=4 388 B13R1.167 Cc1[nH]cnc1CSCCC(=O)N 62a_100000744528_100000751220 [1,0,0,0,1,0|0,1,0]=3 389 B13R1.167 Cc1[nH]cnc1CSCCC(=O)N 62a_100000751220_100000744528 [1,0,0,0,1,0|0,1,0]=3 390 B13R1.167 Cc1[nH]cnc1CSCCC(C)C 62a_100000210312_100000751220 [1,0,0,0,1,0|1,0,1]=4 391 B13R1.167 Cc1[nH]cnc1CSCCC(C)C 62a_100000751220_100000210312 [1,0,0,0,1,0|1,0,1]=4 392 B13R1.167 Cc1[nH]cnc1CSCCC(C)O 62a_100000751220_100012276601 [1,0,0,0,1,0|0,1,1]=4 393 B13R1.167 Cc1[nH]cnc1CSCCC(C)O 62a_100012276601_100000751220 [1,0,0,0,1,0|0,1,1]=4 394 B13R1.167 Cc1[nH]cnc1CSCCN(C)C 62a_100000751220_100000755713 [1,0,0,0,1,0|2,0,0]=4 395 B13R1.167 Cc1[nH]cnc1SCCCC(=O)N 62a_100010186451_100102525003 [1,0,0,0,1,0|1,1,0]=4 396 B13R1.167 Cc1[nH]cnc1SCCCC(=O)N 62a_100102525003_100010186451 [1,0,0,0,1,0|1,1,0]=4 397 B13R1.167 Cc1[nH]cnc1SCCNC(=O)N 62a_100010186451_200000034859 [1,0,0,0,1,0|0,1,0]=3 398 B13R1.167 Cc1[nH]cnc1SCCNC(=O)N 62a_200000034859_100010186451 [1,0,0,0,1,0|0,1,0]=3 399 B13R1.167 Cc1[nH]cnc1SCCOC(=O)N 62a_100010186451_200011214921 [1,0,0,0,1,0|1,1,0]=4 400 B13R1.167 Cc1[nH]cnc1SCCOC(=O)N 62a_200011214921_100010186451 [1,0,0,0,1,0|1,1,0]=4 401 B13R1.167 Cc1ocnc1CSCCC(=O)N 62a_100000744528_200000693990 [1,0,0,0,1,0|1,1,0]=4 402 B13R1.167 Cc1ocnc1CSCCC(=O)N 62a_200000693990_100000744528 [1,0,0,0,1,0|1,1,0]=4 403 B13R1.167 Cc1scnc1SCCNC(=O)N 62a_100000732656_200000034859 [1,0,0,0,1,0|1,1,0]=4 404 B13R1.167 Cc1scnc1SCCNC(=O)N 62a_200000034859_100000732656 [1,0,0,0,1,0|1,1,0]=4 405 B13R1.536 CNC(=O)CCCSc1c[nH]cn1 62a_100000741757_100000756875 [1,0,0,0,1,0|1,1,0]=4 406 B13R1.536 CNC(=O)CCCSc1c[nH]cn1 62a_100000756875_100000741757 [1,0,0,0,1,0|1,1,0]=4 407 B13R1.536 CNC(=O)CCNCc1c[nH]cn1 2230a_100000738227_100000707719 [1,0,0,0,1,0|1,1,0]=4 408 B13R1.536 CNC(=O)CCNCc1c[nH]cn1 34a_100000738227_100000707719 [1,0,0,0,1,0|1,1,0]=4 409 B13R1.536 CNC(=O)CCOCc1c[nH]cn1 34a_100000754576_100000707719 [1,0,0,0,1,0|0,2,0]=4 410 B13R1.536 CNC(=O)CCSCc1c[nH]cn1 62a_100000707719_100000737683 [1,0,0,0,1,0|0,1,0]=3 411 B13R1.536 CNC(=O)CCSCc1c[nH]cn1 62a_100000737683_100000707719 [1,0,0,0,1,0|0,1,0]=3 412 B13R1.536 CNC(=O)CCSCc1cscn1 62a_100000205941_100000737683 [1,0,0,0,1,0|1,1,0]=4 413 B13R1.536 CNC(=O)CCSCc1cscn1 62a_100000737683_100000205941 [1,0,0,0,1,0|1,1,0]=4 414 B13R1.536 CNC(=O)OCCSc1c[nH]cn1 62a_100000756875_200011997002 [1,0,0,0,1,0|1,1,0]=4 415 B13R1.536 CNC(=O)OCCSc1c[nH]cn1 62a_200011997002_100000756875 [1,0,0,0,1,0|1,1,0]=4 416 B13R1.536 COC(=O)CCSCc1c[nH]cn1 62a_100000204255_100000707719 [1,0,0,0,1,0|1,1,0]=4 417 B13R1.536 COC(=O)CCSCc1c[nH]cn1 62a_100000707719_100000204255 [1,0,0,0,1,0|1,1,0]=4 418 B13R1.599 CCC(=O)CSCc1nc[nH]c1C 62a_100000747405_100000751220 [0,0,0,0,2,0|1,1,0]=4 419 B13R1.599 CCC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000747405 [0,0,0,0,2,0|1,1,0]=4 420 B13R1.599 CNC(=O)CCSc1nc[nH]c1C 62a_100000737683_100010186451 [0,0,0,0,2,0|0,1,0]=3 421 B13R1.599 CNC(=O)CCSc1nc[nH]c1C 62a_100010186451_100000737683 [0,0,0,0,2,0|0,1,0]=3 422 B13R1.599 CNC(=O)CCSc1ncsc1C 62a_100000732656_100000737683 [0,0,0,0,2,0|1,1,0]=4 423 B13R1.599 CNC(=O)CCSc1ncsc1C 62a_100000737683_100000732656 [0,0,0,0,2,0|1,1,0]=4 424 B13R1.599 CNC(=O)CNCc1nc[nH]c1C 207a_100000693194_100000032982 [0,0,0,0,2,0|1,1,0]=4 425 B13R1.599 CNC(=O)CNCc1nc[nH]c1C 2230a_100000693194_100000751220 [0,0,0,0,2,0|1,1,0]=4 426 B13R1.599 CNC(=O)CSCc1nc[nH]c1C 62a_100000183359_100000751220 [0,0,0,0,2,0|0,1,0]=3 427 B13R1.599 CNC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000183359 [0,0,0,0,2,0|0,1,0]=3 428 B13R1.599 CNC(=O)CSCc1ncoc1C 62a_100000183359_200000693990 [0,0,0,0,2,0|1,1,0]=4 429 B13R1.599 CNC(=O)CSCc1ncoc1C 62a_200000693990_100000183359 [0,0,0,0,2,0|1,1,0]=4 430 B13R1.599 COC(=O)CCSc1nc[nH]c1C 62a_100000204255_100010186451 [0,0,0,0,2,0|1,1,0]=4 431 B13R1.599 COC(=O)CCSc1nc[nH]c1C 62a_100010186451_100000204255 [0,0,0,0,2,0|1,1,0]=4 432 B13R1.599 COC(=O)CSCc1nc[nH]c1C 62a_100000747449_100000751220 [0,0,0,0,2,0|1,1,0]=4 433 B13R1.599 COC(=O)CSCc1nc[nH]c1C 62a_100000751220_100000747449 [0,0,0,0,2,0|1,1,0]=4 434 B15R1.119 CC(=O)NCCSCc1cc(ccn1)C 62a_100000189650_100000718516 [1,0,0,0,0,1|1,1,0]=4 435 B15R1.119 CC(=O)NCCSCc1cc(ccn1)C 62a_100000718516_100000189650 [1,0,0,0,0,1|1,1,0]=4 436 B15R1.119 Cc1ccnc(c1)CSCCNC(=O)N 62a_100000718516_200000034859 [1,0,0,0,0,1|1,1,0]=4 437 B15R1.119 Cc1ccnc(c1)CSCCNC(=O)N 62a_200000034859_100000718516 [1,0,0,0,0,1|1,1,0]=4 438 B15R1.131 CC(=O)NCCSCc1cnccc1C 62a_100000189650_100000690890 [1,0,0,0,0,1|1,1,0]=4 439 B15R1.131 CC(=O)NCCSCc1cnccc1C 62a_100000690890_100000189650 [1,0,0,0,0,1|1,1,0]=4 440 B15R1.131 CC(=O)NCCSCc1ncccc1C 62a_100000189650_100000696600 [1,0,0,0,0,1|1,1,0]=4 441 B15R1.131 CC(=O)NCCSCc1ncccc1C 62a_100000696600_100000189650 [1,0,0,0,0,1|1,1,0]=4 442 B15R1.131 Cc1cccnc1CSCCNC(=O)N 62a_100000696600_200000034859 [1,0,0,0,0,1|1,1,0]=4 443 B15R1.131 Cc1cccnc1CSCCNC(=O)N 62a_200000034859_100000696600 [1,0,0,0,0,1|1,1,0]=4 444 B15R1.131 Cc1ccncc1CSCCNC(=O)N 62a_100000690890_200000034859 [1,0,0,0,0,1|1,1,0]=4 445 B15R1.131 Cc1ccncc1CSCCNC(=O)N 62a_200000034859_100000690890 [1,0,0,0,0,1|1,1,0]=4