0 B8R1.8 C=C=Cc1ccoc1 271570a_100015277604_100011215275 [0,0,0,0,0,0|1,1,2]=4 1 B8R1.8 C=C=Cc1ccsc1 271570a_100015277604_100000738268 [0,0,0,0,0,0|1,0,2]=3 2 B8R1.8 C=C=Cc1ccsn1 271570a_100015277604_100009818082 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.8 C=C=Cc1cnsc1 271570a_100015277604_100009815736 [0,0,0,0,0,0|2,0,2]=4 4 B8R1.8 C=C=Cc1cscn1 271570a_100015277604_100000751502 [0,0,0,0,0,0|2,0,2]=4 5 B8R1.8 CC=Cc1ccoc1 271570a_100016259895_100011215275 [0,0,0,0,0,0|1,1,2]=4 6 B8R1.8 CC=Cc1ccsc1 271570a_100016259895_100000738268 [0,0,0,0,0,0|1,0,2]=3 7 B8R1.8 CC=Cc1ccsn1 271570a_100016259895_100009818082 [0,0,0,0,0,0|2,0,2]=4 8 B8R1.8 CC=Cc1cnsc1 271570a_100016259895_100009815736 [0,0,0,0,0,0|2,0,2]=4 9 B8R1.8 CC=Cc1cscn1 271570a_100016259895_100000751502 [0,0,0,0,0,0|2,0,2]=4 10 B8R1.8 CCOc1ccsc1 34a_100000106738_100000210202 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.8 CCOc1ccsc1 7a_100000106738_100000210202 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.8 CCSc1c[nH]cn1 62a_100000210202_100000756875 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.8 CCSc1c[nH]cn1 62a_100000756875_100000210202 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.8 CCSc1cc[nH]n1 62a_100000062575_100000210202 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.8 CCSc1cc[nH]n1 62a_100000210202_100000062575 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.8 CCSc1ccco1 62a_100000210202_100009814098 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.8 CCSc1ccco1 62a_100009814098_100000210202 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.8 CCSc1cccs1 62a_100000210202_100011215356 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.8 CCSc1cccs1 62a_100011215356_100000210202 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.8 CCSc1ccoc1 62a_100000210202_100011215275 [0,0,0,0,0,0|2,1,0]=3 21 B8R1.8 CCSc1ccoc1 62a_100011215275_100000210202 [0,0,0,0,0,0|2,1,0]=3 22 B8R1.8 CCSc1ccon1 62a_100000210202_100009818083 [0,0,0,0,0,0|3,1,0]=4 23 B8R1.8 CCSc1ccon1 62a_100009818083_100000210202 [0,0,0,0,0,0|3,1,0]=4 24 B8R1.8 CCSc1ccsc1 62a_100000210202_100000738268 [0,0,0,0,0,0|2,0,0]=2 25 B8R1.8 CCSc1ccsc1 62a_100000738268_100000210202 [0,0,0,0,0,0|2,0,0]=2 26 B8R1.8 CCSc1ccsn1 62a_100000210202_100009818082 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.8 CCSc1ccsn1 62a_100009818082_100000210202 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.8 CCSc1cn[nH]c1 62a_100000210202_100000238712 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.8 CCSc1cn[nH]c1 62a_100000238712_100000210202 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.8 CCSc1cnco1 62a_100000210202_100020591547 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.8 CCSc1cnco1 62a_100020591547_100000210202 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.8 CCSc1cncs1 62a_100000210202_100011934649 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.8 CCSc1cncs1 62a_100011934649_100000210202 [0,0,0,0,0,0|4,0,0]=4 34 B8R1.8 CCSc1cnoc1 62a_100000210202_100009815712 [0,0,0,0,0,0|3,1,0]=4 35 B8R1.8 CCSc1cnoc1 62a_100009815712_100000210202 [0,0,0,0,0,0|3,1,0]=4 36 B8R1.8 CCSc1cnsc1 62a_100000210202_100009815736 [0,0,0,0,0,0|3,0,0]=3 37 B8R1.8 CCSc1cnsc1 62a_100009815736_100000210202 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.8 CCSc1cscn1 62a_100000210202_100000751502 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.8 CCSc1cscn1 62a_100000751502_100000210202 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.8 CNCc1c[nH]cn1 2230a_106832991635_100000707719 [0,0,0,0,0,0|4,0,0]=4 41 B8R1.8 CNCc1c[nH]cn1 34a_100102657272_100000707719 [0,0,0,0,0,0|4,0,0]=4 42 B8R1.8 CNCc1cc[nH]n1 207a_100102657272_100000738523 [0,0,0,0,0,0|4,0,0]=4 43 B8R1.8 CNCc1cc[nH]n1 270004a_106832991635_100000738523 [0,0,0,0,0,0|4,0,0]=4 44 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [0,0,0,0,0,0|4,0,0]=4 45 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [0,0,0,0,0,0|4,0,0]=4 47 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [0,0,0,0,0,0|4,0,0]=4 48 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [0,0,0,0,0,0|4,0,0]=4 49 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [0,0,0,0,0,0|4,0,0]=4 50 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [0,0,0,0,0,0|4,0,0]=4 51 B8R1.8 CNCc1ccn[nH]1 2230a_106832991635_100000728653 [0,0,0,0,0,0|4,0,0]=4 52 B8R1.8 CNCc1ccn[nH]1 34a_100102657272_100000728653 [0,0,0,0,0,0|4,0,0]=4 53 B8R1.8 CNCc1ccn[nH]1 7a_106832991635_100000728653 [0,0,0,0,0,0|4,0,0]=4 54 B8R1.8 CNCc1ccoc1 207a_100102657272_100011215517 [0,0,0,0,0,0|2,1,0]=3 55 B8R1.8 CNCc1ccoc1 2230a_100015206860_200000210301 [0,0,0,0,0,0|2,1,0]=3 56 B8R1.8 CNCc1ccoc1 270004a_106832991635_100011215517 [0,0,0,0,0,0|2,1,0]=3 57 B8R1.8 CNCc1ccoc1 34a_100015206860_200000210301 [0,0,0,0,0,0|2,1,0]=3 58 B8R1.8 CNCc1ccon1 2230a_106832991635_100000234950 [0,0,0,0,0,0|3,1,0]=4 59 B8R1.8 CNCc1ccon1 34a_100102657272_100000234950 [0,0,0,0,0,0|3,1,0]=4 60 B8R1.8 CNCc1ccon1 7a_106832991635_100000234950 [0,0,0,0,0,0|3,1,0]=4 61 B8R1.8 CNCc1ccsc1 207a_100102657272_100000188534 [0,0,0,0,0,0|2,0,0]=2 62 B8R1.8 CNCc1ccsc1 2230a_100000186416_200000210301 [0,0,0,0,0,0|2,0,0]=2 63 B8R1.8 CNCc1ccsc1 2230a_106832991635_100011261437 [0,0,0,0,0,0|2,0,0]=2 64 B8R1.8 CNCc1ccsc1 270004a_106832991635_100000188534 [0,0,0,0,0,0|2,0,0]=2 65 B8R1.8 CNCc1ccsc1 34a_100000186416_200000210301 [0,0,0,0,0,0|2,0,0]=2 66 B8R1.8 CNCc1ccsc1 34a_100102657272_100011261437 [0,0,0,0,0,0|2,0,0]=2 67 B8R1.8 CNCc1ccsc1 7a_106832991635_100011261437 [0,0,0,0,0,0|2,0,0]=2 68 B8R1.8 CNCc1cn[nH]c1 207a_100102657272_100016992096 [0,0,0,0,0,0|4,0,0]=4 69 B8R1.8 CNCc1cn[nH]c1 270004a_106832991635_100016992096 [0,0,0,0,0,0|4,0,0]=4 70 B8R1.8 CNCc1cnc[nH]1 207a_100102657272_100000742939 [0,0,0,0,0,0|4,0,0]=4 71 B8R1.8 CNCc1cnco1 270004a_106832991635_100000064291 [0,0,0,0,0,0|4,0,0]=4 72 B8R1.8 CNCc1cncs1 207a_100102657272_100000749870 [0,0,0,0,0,0|4,0,0]=4 73 B8R1.8 CNCc1cncs1 2230a_100016987365_200000210301 [0,0,0,0,0,0|4,0,0]=4 74 B8R1.8 CNCc1cncs1 2230a_106832991635_100015185245 [0,0,0,0,0,0|4,0,0]=4 75 B8R1.8 CNCc1cncs1 270004a_106832991635_100000749870 [0,0,0,0,0,0|4,0,0]=4 76 B8R1.8 CNCc1cncs1 34a_100102657272_100015185245 [0,0,0,0,0,0|4,0,0]=4 77 B8R1.8 CNCc1cncs1 7a_106832991635_100015185245 [0,0,0,0,0,0|4,0,0]=4 78 B8R1.8 CNCc1cocn1 270004a_106832991635_100000050382 [0,0,0,0,0,0|3,1,0]=4 79 B8R1.8 CNCc1cscn1 207a_100102657272_100000743575 [0,0,0,0,0,0|3,0,0]=3 80 B8R1.8 CNCc1cscn1 2230a_100015185402_200000210301 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.8 CNCc1cscn1 2230a_106832991635_100000205941 [0,0,0,0,0,0|3,0,0]=3 82 B8R1.8 CNCc1cscn1 270004a_106832991635_100000743575 [0,0,0,0,0,0|3,0,0]=3 83 B8R1.8 CNCc1cscn1 34a_100102657272_100000205941 [0,0,0,0,0,0|3,0,0]=3 84 B8R1.8 CNCc1cscn1 7a_106832991635_100000205941 [0,0,0,0,0,0|3,0,0]=3 85 B8R1.8 CNCc1csnn1 270004a_106832991635_100000738508 [0,0,0,0,0,0|4,0,0]=4 86 B8R1.8 COCc1c[nH]cn1 34a_100138415774_100000707719 [0,0,0,0,0,0|4,0,0]=4 87 B8R1.8 COCc1ccco1 34a_100000210059_200000210301 [0,0,0,0,0,0|4,0,0]=4 88 B8R1.8 COCc1cccs1 34a_100000211240_200000210301 [0,0,0,0,0,0|4,0,0]=4 89 B8R1.8 COCc1ccn[nH]1 34a_100138415774_100000728653 [0,0,0,0,0,0|4,0,0]=4 90 B8R1.8 COCc1ccno1 34a_100000740478_200000210301 [0,0,0,0,0,0|4,0,0]=4 91 B8R1.8 COCc1ccoc1 34a_100011215357_200000210301 [0,0,0,0,0,0|2,1,0]=3 92 B8R1.8 COCc1ccon1 34a_100138415774_100000234950 [0,0,0,0,0,0|3,1,0]=4 93 B8R1.8 COCc1ccsc1 34a_100011215551_200000210301 [0,0,0,0,0,0|2,0,0]=2 94 B8R1.8 COCc1ccsc1 34a_100138415774_100011261437 [0,0,0,0,0,0|2,0,0]=2 95 B8R1.8 COCc1cncs1 34a_100138415774_100015185245 [0,0,0,0,0,0|4,0,0]=4 96 B8R1.8 COCc1cscn1 34a_100138415774_100000205941 [0,0,0,0,0,0|3,0,0]=3 97 B8R1.8 CSCc1c[nH]cn1 62a_100000707719_200000210301 [0,0,0,0,0,0|4,0,0]=4 98 B8R1.8 CSCc1c[nH]cn1 62a_200000210301_100000707719 [0,0,0,0,0,0|4,0,0]=4 99 B8R1.8 CSCc1ccn[nH]1 62a_100000728653_200000210301 [0,0,0,0,0,0|4,0,0]=4 100 B8R1.8 CSCc1ccn[nH]1 62a_200000210301_100000728653 [0,0,0,0,0,0|4,0,0]=4 101 B8R1.8 CSCc1ccon1 62a_100000234950_200000210301 [0,0,0,0,0,0|3,1,0]=4 102 B8R1.8 CSCc1ccon1 62a_200000210301_100000234950 [0,0,0,0,0,0|3,1,0]=4 103 B8R1.8 CSCc1ccsc1 62a_100011261437_200000210301 [0,0,0,0,0,0|2,0,0]=2 104 B8R1.8 CSCc1ccsc1 62a_200000210301_100011233845 [0,0,0,0,0,0|2,0,0]=2 105 B8R1.8 CSCc1cncs1 62a_100015185245_200000210301 [0,0,0,0,0,0|4,0,0]=4 106 B8R1.8 CSCc1cncs1 62a_200000210301_100015185245 [0,0,0,0,0,0|4,0,0]=4 107 B8R1.8 CSCc1cscn1 62a_100000205941_200000210301 [0,0,0,0,0,0|3,0,0]=3 108 B8R1.8 CSCc1cscn1 62a_200000210301_100000205941 [0,0,0,0,0,0|3,0,0]=3 109 B8R1.8 FCOc1ccsc1 34a_100000106738_100015361967 [0,0,0,0,0,0|2,0,0]=2 110 B8R1.8 FCOc1ccsc1 7a_100000106738_100015361967 [0,0,0,0,0,0|2,0,0]=2 111 B8R1.8 FCSc1c[nH]cn1 62a_100000756875_100015361967 [0,0,0,0,0,0|4,0,0]=4 112 B8R1.8 FCSc1c[nH]cn1 62a_100015361967_100000756875 [0,0,0,0,0,0|4,0,0]=4 113 B8R1.8 FCSc1cc[nH]n1 62a_100000062575_100015361967 [0,0,0,0,0,0|4,0,0]=4 114 B8R1.8 FCSc1cc[nH]n1 62a_100015361967_100000062575 [0,0,0,0,0,0|4,0,0]=4 115 B8R1.8 FCSc1ccco1 62a_100009814098_100015361967 [0,0,0,0,0,0|4,0,0]=4 116 B8R1.8 FCSc1ccco1 62a_100015361967_100009814098 [0,0,0,0,0,0|4,0,0]=4 117 B8R1.8 FCSc1cccs1 62a_100011215356_100015361967 [0,0,0,0,0,0|4,0,0]=4 118 B8R1.8 FCSc1cccs1 62a_100015361967_100011215356 [0,0,0,0,0,0|4,0,0]=4 119 B8R1.8 FCSc1ccoc1 62a_100011215275_100015361967 [0,0,0,0,0,0|2,1,0]=3 120 B8R1.8 FCSc1ccoc1 62a_100015361967_100011215275 [0,0,0,0,0,0|2,1,0]=3 121 B8R1.8 FCSc1ccon1 62a_100009818083_100015361967 [0,0,0,0,0,0|3,1,0]=4 122 B8R1.8 FCSc1ccon1 62a_100015361967_100009818083 [0,0,0,0,0,0|3,1,0]=4 123 B8R1.8 FCSc1ccsc1 62a_100000738268_100015361967 [0,0,0,0,0,0|2,0,0]=2 124 B8R1.8 FCSc1ccsc1 62a_100015361967_100000738268 [0,0,0,0,0,0|2,0,0]=2 125 B8R1.8 FCSc1ccsn1 62a_100009818082_100015361967 [0,0,0,0,0,0|3,0,0]=3 126 B8R1.8 FCSc1ccsn1 62a_100015361967_100009818082 [0,0,0,0,0,0|3,0,0]=3 127 B8R1.8 FCSc1cn[nH]c1 62a_100000238712_100015361967 [0,0,0,0,0,0|4,0,0]=4 128 B8R1.8 FCSc1cn[nH]c1 62a_100015361967_100000238712 [0,0,0,0,0,0|4,0,0]=4 129 B8R1.8 FCSc1cnco1 62a_100015361967_100020591547 [0,0,0,0,0,0|4,0,0]=4 130 B8R1.8 FCSc1cnco1 62a_100020591547_100015361967 [0,0,0,0,0,0|4,0,0]=4 131 B8R1.8 FCSc1cncs1 62a_100011934649_100015361967 [0,0,0,0,0,0|4,0,0]=4 132 B8R1.8 FCSc1cncs1 62a_100015361967_100011934649 [0,0,0,0,0,0|4,0,0]=4 133 B8R1.8 FCSc1cnoc1 62a_100009815712_100015361967 [0,0,0,0,0,0|3,1,0]=4 134 B8R1.8 FCSc1cnoc1 62a_100015361967_100009815712 [0,0,0,0,0,0|3,1,0]=4 135 B8R1.8 FCSc1cnsc1 62a_100009815736_100015361967 [0,0,0,0,0,0|3,0,0]=3 136 B8R1.8 FCSc1cnsc1 62a_100015361967_100009815736 [0,0,0,0,0,0|3,0,0]=3 137 B8R1.8 FCSc1cscn1 62a_100000751502_100015361967 [0,0,0,0,0,0|3,0,0]=3 138 B8R1.8 FCSc1cscn1 62a_100015361967_100000751502 [0,0,0,0,0,0|3,0,0]=3 139 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [0,0,0,0,0,0|4,0,0]=4 140 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [0,0,0,0,0,0|4,0,0]=4 141 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [0,0,0,0,0,0|4,0,0]=4 142 B8R1.8 [13CH3]NCc1ccoc1 2230a_100015206860_200025704644 [0,0,0,0,0,0|2,1,0]=3 143 B8R1.8 [13CH3]NCc1ccoc1 34a_100015206860_200025704644 [0,0,0,0,0,0|2,1,0]=3 144 B8R1.8 [13CH3]NCc1ccsc1 2230a_100000186416_200025704644 [0,0,0,0,0,0|2,0,0]=2 145 B8R1.8 [13CH3]NCc1ccsc1 34a_100000186416_200025704644 [0,0,0,0,0,0|2,0,0]=2 146 B8R1.8 [13CH3]NCc1cncs1 2230a_100016987365_200025704644 [0,0,0,0,0,0|4,0,0]=4 147 B8R1.8 [13CH3]NCc1cscn1 2230a_100015185402_200025704644 [0,0,0,0,0,0|3,0,0]=3 148 B8R1.8 [13CH3]OCc1ccco1 34a_100000210059_200025704644 [0,0,0,0,0,0|4,0,0]=4 149 B8R1.8 [13CH3]OCc1cccs1 34a_100000211240_200025704644 [0,0,0,0,0,0|4,0,0]=4 150 B8R1.8 [13CH3]OCc1ccno1 34a_100000740478_200025704644 [0,0,0,0,0,0|4,0,0]=4 151 B8R1.8 [13CH3]OCc1ccoc1 34a_100011215357_200025704644 [0,0,0,0,0,0|2,1,0]=3 152 B8R1.8 [13CH3]OCc1ccsc1 34a_100011215551_200025704644 [0,0,0,0,0,0|2,0,0]=2 153 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_100000707719_200025704644 [0,0,0,0,0,0|4,0,0]=4 154 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_200025704644_100000707719 [0,0,0,0,0,0|4,0,0]=4 155 B8R1.8 [13CH3]SCc1ccn[nH]1 62a_100000728653_200025704644 [0,0,0,0,0,0|4,0,0]=4 156 B8R1.8 [13CH3]SCc1ccn[nH]1 62a_200025704644_100000728653 [0,0,0,0,0,0|4,0,0]=4 157 B8R1.8 [13CH3]SCc1ccon1 62a_100000234950_200025704644 [0,0,0,0,0,0|3,1,0]=4 158 B8R1.8 [13CH3]SCc1ccon1 62a_200025704644_100000234950 [0,0,0,0,0,0|3,1,0]=4 159 B8R1.8 [13CH3]SCc1ccsc1 62a_100011261437_200025704644 [0,0,0,0,0,0|2,0,0]=2 160 B8R1.8 [13CH3]SCc1ccsc1 62a_200025704644_100011233845 [0,0,0,0,0,0|2,0,0]=2 161 B8R1.8 [13CH3]SCc1cncs1 62a_100015185245_200025704644 [0,0,0,0,0,0|4,0,0]=4 162 B8R1.8 [13CH3]SCc1cncs1 62a_200025704644_100015185245 [0,0,0,0,0,0|4,0,0]=4 163 B8R1.8 [13CH3]SCc1cscn1 62a_100000205941_200025704644 [0,0,0,0,0,0|3,0,0]=3 164 B8R1.8 [13CH3]SCc1cscn1 62a_200025704644_100000205941 [0,0,0,0,0,0|3,0,0]=3 165 B7R1.1 C=Cc1ccoc1 271570a_100011290941_100011215275 [1,0,0,0,0,0|0,1,2]=4 166 B7R1.1 C=Cc1ccsc1 271570a_100011290941_100000738268 [1,0,0,0,0,0|0,0,2]=3 167 B7R1.1 C=Cc1ccsn1 271570a_100011290941_100009818082 [1,0,0,0,0,0|1,0,2]=4 168 B7R1.1 C=Cc1cnsc1 271570a_100011290941_100009815736 [1,0,0,0,0,0|1,0,2]=4 169 B7R1.1 C=Cc1cscn1 271570a_100011290941_100000751502 [1,0,0,0,0,0|1,0,2]=4 170 B7R1.1 COc1ccsc1 34a_100000106738_200000210301 [1,0,0,0,0,0|1,0,0]=2 171 B7R1.1 COc1ccsc1 7a_100000106738_200000210301 [1,0,0,0,0,0|1,0,0]=2 172 B7R1.1 CSc1c[nH]cn1 62a_100000756875_200000210301 [1,0,0,0,0,0|3,0,0]=4 173 B7R1.1 CSc1c[nH]cn1 62a_200000210301_100000756875 [1,0,0,0,0,0|3,0,0]=4 174 B7R1.1 CSc1cc[nH]n1 62a_100000062575_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B7R1.1 CSc1cc[nH]n1 62a_200000210301_100000062575 [1,0,0,0,0,0|3,0,0]=4 176 B7R1.1 CSc1ccco1 62a_100009814098_200000210301 [1,0,0,0,0,0|3,0,0]=4 177 B7R1.1 CSc1ccco1 62a_200000210301_100009814098 [1,0,0,0,0,0|3,0,0]=4 178 B7R1.1 CSc1cccs1 62a_100011215356_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B7R1.1 CSc1cccs1 62a_200000210301_100011215356 [1,0,0,0,0,0|3,0,0]=4 180 B7R1.1 CSc1ccoc1 62a_100011215275_200000210301 [1,0,0,0,0,0|1,1,0]=3 181 B7R1.1 CSc1ccoc1 62a_200000210301_100011215275 [1,0,0,0,0,0|1,1,0]=3 182 B7R1.1 CSc1ccon1 62a_100009818083_200000210301 [1,0,0,0,0,0|2,1,0]=4 183 B7R1.1 CSc1ccon1 62a_200000210301_100009818083 [1,0,0,0,0,0|2,1,0]=4 184 B7R1.1 CSc1ccsc1 62a_100000738268_200000210301 [1,0,0,0,0,0|1,0,0]=2 185 B7R1.1 CSc1ccsc1 62a_200000210301_100000738268 [1,0,0,0,0,0|1,0,0]=2 186 B7R1.1 CSc1ccsn1 62a_100009818082_200000210301 [1,0,0,0,0,0|2,0,0]=3 187 B7R1.1 CSc1ccsn1 62a_200000210301_100009818082 [1,0,0,0,0,0|2,0,0]=3 188 B7R1.1 CSc1cn[nH]c1 62a_100000238712_200000210301 [1,0,0,0,0,0|3,0,0]=4 189 B7R1.1 CSc1cn[nH]c1 62a_200000210301_100000238712 [1,0,0,0,0,0|3,0,0]=4 190 B7R1.1 CSc1cnco1 62a_100020591547_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B7R1.1 CSc1cnco1 62a_200000210301_100020591547 [1,0,0,0,0,0|3,0,0]=4 192 B7R1.1 CSc1cncs1 62a_100011934649_200000210301 [1,0,0,0,0,0|3,0,0]=4 193 B7R1.1 CSc1cncs1 62a_200000210301_100011934649 [1,0,0,0,0,0|3,0,0]=4 194 B7R1.1 CSc1cnoc1 62a_100009815712_200000210301 [1,0,0,0,0,0|2,1,0]=4 195 B7R1.1 CSc1cnoc1 62a_200000210301_100009815712 [1,0,0,0,0,0|2,1,0]=4 196 B7R1.1 CSc1cnsc1 62a_100009815736_200000210301 [1,0,0,0,0,0|2,0,0]=3 197 B7R1.1 CSc1cnsc1 62a_200000210301_100009815736 [1,0,0,0,0,0|2,0,0]=3 198 B7R1.1 CSc1cscn1 62a_100000751502_200000210301 [1,0,0,0,0,0|2,0,0]=3 199 B7R1.1 CSc1cscn1 62a_200000210301_100000751502 [1,0,0,0,0,0|2,0,0]=3 200 B7R1.1 [13CH3]Oc1ccsc1 34a_100000106738_200025704644 [1,0,0,0,0,0|1,0,0]=2 201 B7R1.1 [13CH3]Oc1ccsc1 7a_100000106738_200025704644 [1,0,0,0,0,0|1,0,0]=2 202 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_100000756875_200025704644 [1,0,0,0,0,0|3,0,0]=4 203 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_200025704644_100000756875 [1,0,0,0,0,0|3,0,0]=4 204 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_100000062575_200025704644 [1,0,0,0,0,0|3,0,0]=4 205 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_200025704644_100000062575 [1,0,0,0,0,0|3,0,0]=4 206 B7R1.1 [13CH3]Sc1ccco1 62a_100009814098_200025704644 [1,0,0,0,0,0|3,0,0]=4 207 B7R1.1 [13CH3]Sc1ccco1 62a_200025704644_100009814098 [1,0,0,0,0,0|3,0,0]=4 208 B7R1.1 [13CH3]Sc1cccs1 62a_100011215356_200025704644 [1,0,0,0,0,0|3,0,0]=4 209 B7R1.1 [13CH3]Sc1cccs1 62a_200025704644_100011215356 [1,0,0,0,0,0|3,0,0]=4 210 B7R1.1 [13CH3]Sc1ccoc1 62a_100011215275_200025704644 [1,0,0,0,0,0|1,1,0]=3 211 B7R1.1 [13CH3]Sc1ccoc1 62a_200025704644_100011215275 [1,0,0,0,0,0|1,1,0]=3 212 B7R1.1 [13CH3]Sc1ccon1 62a_100009818083_200025704644 [1,0,0,0,0,0|2,1,0]=4 213 B7R1.1 [13CH3]Sc1ccon1 62a_200025704644_100009818083 [1,0,0,0,0,0|2,1,0]=4 214 B7R1.1 [13CH3]Sc1ccsc1 62a_100000738268_200025704644 [1,0,0,0,0,0|1,0,0]=2 215 B7R1.1 [13CH3]Sc1ccsc1 62a_200025704644_100000738268 [1,0,0,0,0,0|1,0,0]=2 216 B7R1.1 [13CH3]Sc1ccsn1 62a_100009818082_200025704644 [1,0,0,0,0,0|2,0,0]=3 217 B7R1.1 [13CH3]Sc1ccsn1 62a_200025704644_100009818082 [1,0,0,0,0,0|2,0,0]=3 218 B7R1.1 [13CH3]Sc1cn[nH]c1 62a_100000238712_200025704644 [1,0,0,0,0,0|3,0,0]=4 219 B7R1.1 [13CH3]Sc1cn[nH]c1 62a_200025704644_100000238712 [1,0,0,0,0,0|3,0,0]=4 220 B7R1.1 [13CH3]Sc1cnco1 62a_100020591547_200025704644 [1,0,0,0,0,0|3,0,0]=4 221 B7R1.1 [13CH3]Sc1cnco1 62a_200025704644_100020591547 [1,0,0,0,0,0|3,0,0]=4 222 B7R1.1 [13CH3]Sc1cncs1 62a_100011934649_200025704644 [1,0,0,0,0,0|3,0,0]=4 223 B7R1.1 [13CH3]Sc1cncs1 62a_200025704644_100011934649 [1,0,0,0,0,0|3,0,0]=4 224 B7R1.1 [13CH3]Sc1cnoc1 62a_100009815712_200025704644 [1,0,0,0,0,0|2,1,0]=4 225 B7R1.1 [13CH3]Sc1cnoc1 62a_200025704644_100009815712 [1,0,0,0,0,0|2,1,0]=4 226 B7R1.1 [13CH3]Sc1cnsc1 62a_100009815736_200025704644 [1,0,0,0,0,0|2,0,0]=3 227 B7R1.1 [13CH3]Sc1cnsc1 62a_200025704644_100009815736 [1,0,0,0,0,0|2,0,0]=3 228 B7R1.1 [13CH3]Sc1cscn1 62a_100000751502_200025704644 [1,0,0,0,0,0|2,0,0]=3 229 B7R1.1 [13CH3]Sc1cscn1 62a_200025704644_100000751502 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.7 C=C=Cc1csc(c1)C 271570a_100015277604_100000759034 [0,1,0,0,0,0|1,0,2]=4 231 B9R1.7 CC=Cc1csc(c1)C 271570a_100016259895_100000759034 [0,1,0,0,0,0|1,0,2]=4 232 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.7 CCSc1csc(c1)C 62a_100000210202_100000759034 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.7 CCSc1csc(c1)C 62a_100000759034_100000210202 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.7 CCSc1csc(n1)C 62a_100000210202_100011934587 [0,1,0,0,0,0|3,0,0]=4 236 B9R1.7 CCSc1csc(n1)C 62a_100011934587_100000210202 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.7 CCSc1csc(n1)N 62a_100000210202_100011998049 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.7 CCSc1csc(n1)N 62a_100011998049_100000210202 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.7 CNCc1cc(sn1)C 207a_100102657272_200000100279 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.7 CNCc1cc(sn1)C 270004a_106832991635_200000100279 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.7 CNCc1csc(c1)Br 207a_100102657272_100000737087 [0,1,0,0,0,0|2,0,0]=3 242 B9R1.7 CNCc1csc(c1)Br 270004a_106832991635_100000737087 [0,1,0,0,0,0|2,0,0]=3 243 B9R1.7 CNCc1csc(c1)C 207a_100102657272_100011998532 [0,1,0,0,0,0|2,0,0]=3 244 B9R1.7 CNCc1csc(c1)C 270004a_106832991635_100011998532 [0,1,0,0,0,0|2,0,0]=3 245 B9R1.7 CNCc1csc(c1)Cl 207a_100102657272_100009844934 [0,1,0,0,0,0|2,0,0]=3 246 B9R1.7 CNCc1csc(c1)Cl 270004a_106832991635_100009844934 [0,1,0,0,0,0|2,0,0]=3 247 B9R1.7 CNCc1csc(n1)Br 270004a_106832991635_100009816748 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.7 CNCc1csc(n1)C 207a_100102657272_100000203724 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.7 CNCc1csc(n1)C 2230a_106832991635_100015186478 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.7 CNCc1csc(n1)C 270004a_106832991635_100000203724 [0,1,0,0,0,0|3,0,0]=4 251 B9R1.7 CNCc1csc(n1)C 34a_100000707933_200000210301 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.7 CNCc1csc(n1)C 34a_100102657272_100015186478 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.7 CNCc1csc(n1)C 7a_106832991635_100015186478 [0,1,0,0,0,0|3,0,0]=4 254 B9R1.7 CNCc1csc(n1)Cl 2230a_106832991635_100000024076 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.7 CNCc1csc(n1)Cl 270004a_106832991635_100011935135 [0,1,0,0,0,0|3,0,0]=4 256 B9R1.7 CNCc1csc(n1)Cl 34a_100102657272_100000024076 [0,1,0,0,0,0|3,0,0]=4 257 B9R1.7 CNCc1csc(n1)Cl 7a_106832991635_100000024076 [0,1,0,0,0,0|3,0,0]=4 258 B9R1.7 COCc1csc(c1)Cl 34a_100009863405_200000210301 [0,1,0,0,0,0|2,0,0]=3 259 B9R1.7 COCc1csc(c1)Cl 7a_100009863405_200000210301 [0,1,0,0,0,0|2,0,0]=3 260 B9R1.7 COCc1csc(n1)C 34a_100000735831_200000210301 [0,1,0,0,0,0|3,0,0]=4 261 B9R1.7 COCc1csc(n1)C 34a_100138415774_100015186478 [0,1,0,0,0,0|3,0,0]=4 262 B9R1.7 COCc1csc(n1)Cl 34a_100138415774_100000024076 [0,1,0,0,0,0|3,0,0]=4 263 B9R1.7 CSCc1csc(n1)C 62a_100015186478_200000210301 [0,1,0,0,0,0|3,0,0]=4 264 B9R1.7 CSCc1csc(n1)C 62a_200000210301_100015186478 [0,1,0,0,0,0|3,0,0]=4 265 B9R1.7 CSCc1csc(n1)Cl 62a_100000024076_200000210301 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.7 CSCc1csc(n1)Cl 62a_200000210301_100000024076 [0,1,0,0,0,0|3,0,0]=4 267 B9R1.7 Cc1cc(cs1)SCF 62a_100000759034_100015361967 [0,1,0,0,0,0|2,0,0]=3 268 B9R1.7 Cc1cc(cs1)SCF 62a_100015361967_100000759034 [0,1,0,0,0,0|2,0,0]=3 269 B9R1.7 Cc1nc(cs1)CN[13CH3] 34a_100000707933_200025704644 [0,1,0,0,0,0|3,0,0]=4 270 B9R1.7 Cc1nc(cs1)CO[13CH3] 34a_100000735831_200025704644 [0,1,0,0,0,0|3,0,0]=4 271 B9R1.7 Cc1nc(cs1)CS[13CH3] 62a_100015186478_200025704644 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.7 Cc1nc(cs1)CS[13CH3] 62a_200025704644_100015186478 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.7 Cc1nc(cs1)SCF 62a_100011934587_100015361967 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.7 Cc1nc(cs1)SCF 62a_100015361967_100011934587 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.7 Cn1cc(nn1)CCN 274090a_200000210301_100000755551 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.7 NCCn1cc(cn1)O 271570a_203496583355_100000730845 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.7 Nc1nc(cs1)SCF 62a_100011998049_100015361967 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.7 Nc1nc(cs1)SCF 62a_100015361967_100011998049 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.7 [13CH3]OCc1csc(c1)Cl 34a_100009863405_200025704644 [0,1,0,0,0,0|2,0,0]=3 280 B9R1.7 [13CH3]OCc1csc(c1)Cl 7a_100009863405_200025704644 [0,1,0,0,0,0|2,0,0]=3 281 B9R1.7 [13CH3]SCc1csc(n1)Cl 62a_100000024076_200025704644 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.7 [13CH3]SCc1csc(n1)Cl 62a_200025704644_100000024076 [0,1,0,0,0,0|3,0,0]=4 283 B9R1.7 [13CH3]n1cc(nn1)CCN 274090a_200025704644_100000755551 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.11 CC(N[13CH3])c1ccoc1 2230a_100000690049_200025704644 [0,1,0,0,0,0|2,1,0]=4 285 B9R1.11 CC(N[13CH3])c1ccsc1 2230a_100000748604_200025704644 [0,1,0,0,0,0|2,0,0]=3 286 B9R1.11 CC(O[13CH3])c1ccsc1 34a_100011350980_200025704644 [0,1,0,0,0,0|2,0,0]=3 287 B9R1.11 CC(O[13CH3])c1ccsc1 7a_100011350980_200025704644 [0,1,0,0,0,0|2,0,0]=3 288 B9R1.11 CNC(C)c1cc[nH]c1 269862a_106832991636_100000753940 [0,1,0,0,0,0|3,0,0]=4 289 B9R1.11 CNC(C)c1ccoc1 2230a_100000690049_200000210301 [0,1,0,0,0,0|2,1,0]=4 290 B9R1.11 CNC(C)c1ccsc1 2230a_100000748604_200000210301 [0,1,0,0,0,0|2,0,0]=3 291 B9R1.11 CNC(C)c1ccsc1 269862a_106832991636_100000747891 [0,1,0,0,0,0|2,0,0]=3 292 B9R1.11 CNC(C)c1cscn1 269862a_106832991636_100000693406 [0,1,0,0,0,0|3,0,0]=4 293 B9R1.11 COC(C)c1ccsc1 34a_100011350980_200000210301 [0,1,0,0,0,0|2,0,0]=3 294 B9R1.11 COC(C)c1ccsc1 7a_100011350980_200000210301 [0,1,0,0,0,0|2,0,0]=3 295 B9R1.12 C#CCOc1ccsc1 34a_100000106738_100000184674 [0,1,0,0,0,0|1,0,1]=3 296 B9R1.12 C#CCOc1ccsc1 7a_100000106738_100000038162 [0,1,0,0,0,0|1,0,1]=3 297 B9R1.12 C#CCSc1ccoc1 62a_100000038162_100011215275 [0,1,0,0,0,0|1,1,1]=4 298 B9R1.12 C#CCSc1ccsc1 62a_100000038162_100000738268 [0,1,0,0,0,0|1,0,1]=3 299 B9R1.12 C#CCSc1ccsn1 62a_100000038162_100009818082 [0,1,0,0,0,0|2,0,1]=4 300 B9R1.12 C#CCSc1cnsc1 62a_100000038162_100009815736 [0,1,0,0,0,0|2,0,1]=4 301 B9R1.12 C#CCSc1cscn1 62a_100000038162_100000751502 [0,1,0,0,0,0|2,0,1]=4 302 B9R1.12 C=CCOc1ccsc1 34a_100000106738_100015514636 [0,1,0,0,0,0|1,0,1]=3 303 B9R1.12 C=CCOc1ccsc1 7a_100000106738_100015514636 [0,1,0,0,0,0|1,0,1]=3 304 B9R1.12 C=CCSc1ccoc1 62a_100000210623_100011215275 [0,1,0,0,0,0|1,1,1]=4 305 B9R1.12 C=CCSc1ccoc1 62a_100011215275_100000210623 [0,1,0,0,0,0|1,1,1]=4 306 B9R1.12 C=CCSc1ccsc1 62a_100000210623_100000738268 [0,1,0,0,0,0|1,0,1]=3 307 B9R1.12 C=CCSc1ccsc1 62a_100000738268_100000210623 [0,1,0,0,0,0|1,0,1]=3 308 B9R1.12 C=CCSc1ccsn1 62a_100000210623_100009818082 [0,1,0,0,0,0|2,0,1]=4 309 B9R1.12 C=CCSc1ccsn1 62a_100009818082_100000210623 [0,1,0,0,0,0|2,0,1]=4 310 B9R1.12 C=CCSc1cnsc1 62a_100000210623_100009815736 [0,1,0,0,0,0|2,0,1]=4 311 B9R1.12 C=CCSc1cnsc1 62a_100009815736_100000210623 [0,1,0,0,0,0|2,0,1]=4 312 B9R1.12 C=CCSc1cscn1 62a_100000210623_100000751502 [0,1,0,0,0,0|2,0,1]=4 313 B9R1.12 C=CCSc1cscn1 62a_100000751502_100000210623 [0,1,0,0,0,0|2,0,1]=4 314 B9R1.12 CCCCc1c[nH]cn1 271570a_100020621405_100000756875 [0,1,0,0,0,0|3,0,0]=4 315 B9R1.12 CCCCc1cc[nH]n1 271570a_100020621405_100000062575 [0,1,0,0,0,0|3,0,0]=4 316 B9R1.12 CCCCc1ccco1 271570a_100020621405_100009814098 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.12 CCCCc1cccs1 271570a_100020621405_100011215356 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.12 CCCCc1ccoc1 271570a_100020621405_100011215275 [0,1,0,0,0,0|1,1,0]=3 319 B9R1.12 CCCCc1ccsc1 271570a_100020621405_100000738268 [0,1,0,0,0,0|1,0,0]=2 320 B9R1.12 CCCCc1ccsn1 271570a_100020621405_100009818082 [0,1,0,0,0,0|2,0,0]=3 321 B9R1.12 CCCCc1cn[nH]c1 271570a_100020621405_100000238712 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.12 CCCCc1cnco1 271570a_100020621405_100020591547 [0,1,0,0,0,0|3,0,0]=4 323 B9R1.12 CCCCc1cncs1 271570a_100020621405_100011934649 [0,1,0,0,0,0|3,0,0]=4 324 B9R1.12 CCCCc1cnoc1 271570a_100020621405_100009815712 [0,1,0,0,0,0|2,1,0]=4 325 B9R1.12 CCCCc1cnsc1 271570a_100020621405_100009815736 [0,1,0,0,0,0|2,0,0]=3 326 B9R1.12 CCCCc1cscn1 271570a_100020621405_100000751502 [0,1,0,0,0,0|2,0,0]=3 327 B9R1.12 CCCOc1ccsc1 34a_100000106738_100000210303 [0,1,0,0,0,0|1,0,0]=2 328 B9R1.12 CCCOc1ccsc1 7a_100000106738_100000210303 [0,1,0,0,0,0|1,0,0]=2 329 B9R1.12 CCCSc1c[nH]cn1 62a_100000210303_100000756875 [0,1,0,0,0,0|3,0,0]=4 330 B9R1.12 CCCSc1c[nH]cn1 62a_100000756875_100000210303 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.12 CCCSc1cc[nH]n1 62a_100000062575_100000210303 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.12 CCCSc1cc[nH]n1 62a_100000210303_100000062575 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.12 CCCSc1ccco1 62a_100000210303_100009814098 [0,1,0,0,0,0|3,0,0]=4 334 B9R1.12 CCCSc1ccco1 62a_100009814098_100000210303 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.12 CCCSc1cccs1 62a_100000210303_100011215356 [0,1,0,0,0,0|3,0,0]=4 336 B9R1.12 CCCSc1cccs1 62a_100011215356_100000210303 [0,1,0,0,0,0|3,0,0]=4 337 B9R1.12 CCCSc1ccoc1 62a_100000210303_100011215275 [0,1,0,0,0,0|1,1,0]=3 338 B9R1.12 CCCSc1ccoc1 62a_100011215275_100000210303 [0,1,0,0,0,0|1,1,0]=3 339 B9R1.12 CCCSc1ccon1 62a_100000210303_100009818083 [0,1,0,0,0,0|2,1,0]=4 340 B9R1.12 CCCSc1ccon1 62a_100009818083_100000210303 [0,1,0,0,0,0|2,1,0]=4 341 B9R1.12 CCCSc1ccsc1 62a_100000210303_100000738268 [0,1,0,0,0,0|1,0,0]=2 342 B9R1.12 CCCSc1ccsc1 62a_100000738268_100000210303 [0,1,0,0,0,0|1,0,0]=2 343 B9R1.12 CCCSc1ccsn1 62a_100000210303_100009818082 [0,1,0,0,0,0|2,0,0]=3 344 B9R1.12 CCCSc1ccsn1 62a_100009818082_100000210303 [0,1,0,0,0,0|2,0,0]=3 345 B9R1.12 CCCSc1cn[nH]c1 62a_100000210303_100000238712 [0,1,0,0,0,0|3,0,0]=4 346 B9R1.12 CCCSc1cn[nH]c1 62a_100000238712_100000210303 [0,1,0,0,0,0|3,0,0]=4 347 B9R1.12 CCCSc1cnco1 62a_100000210303_100020591547 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.12 CCCSc1cnco1 62a_100020591547_100000210303 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.12 CCCSc1cncs1 62a_100000210303_100011934649 [0,1,0,0,0,0|3,0,0]=4 350 B9R1.12 CCCSc1cncs1 62a_100011934649_100000210303 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.12 CCCSc1cnoc1 62a_100000210303_100009815712 [0,1,0,0,0,0|2,1,0]=4 352 B9R1.12 CCCSc1cnoc1 62a_100009815712_100000210303 [0,1,0,0,0,0|2,1,0]=4 353 B9R1.12 CCCSc1cnsc1 62a_100000210303_100009815736 [0,1,0,0,0,0|2,0,0]=3 354 B9R1.12 CCCSc1cnsc1 62a_100009815736_100000210303 [0,1,0,0,0,0|2,0,0]=3 355 B9R1.12 CCCSc1cscn1 62a_100000210303_100000751502 [0,1,0,0,0,0|2,0,0]=3 356 B9R1.12 CCCSc1cscn1 62a_100000751502_100000210303 [0,1,0,0,0,0|2,0,0]=3 357 B9R1.12 CCNCc1c[nH]cn1 2230a_100015525214_100000707719 [0,1,0,0,0,0|3,0,0]=4 358 B9R1.12 CCNCc1cc[nH]n1 207a_100015525214_100000738523 [0,1,0,0,0,0|3,0,0]=4 359 B9R1.12 CCNCc1cc[nH]n1 270004a_100015525214_100000738523 [0,1,0,0,0,0|3,0,0]=4 360 B9R1.12 CCNCc1ccco1 207a_100015525214_100000186105 [0,1,0,0,0,0|3,0,0]=4 361 B9R1.12 CCNCc1ccco1 2230a_100000185738_100000210202 [0,1,0,0,0,0|3,0,0]=4 362 B9R1.12 CCNCc1ccco1 270004a_100015525214_100000186105 [0,1,0,0,0,0|3,0,0]=4 363 B9R1.12 CCNCc1ccco1 34a_100000185738_100000210202 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.12 CCNCc1cccs1 207a_100015525214_100000209959 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.12 CCNCc1cccs1 2230a_100000211653_100000210202 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.12 CCNCc1cccs1 270004a_100015525214_100000209959 [0,1,0,0,0,0|3,0,0]=4 367 B9R1.12 CCNCc1ccn[nH]1 2230a_100015525214_100000728653 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.12 CCNCc1ccoc1 207a_100015525214_100011215517 [0,1,0,0,0,0|1,1,0]=3 369 B9R1.12 CCNCc1ccoc1 2230a_100015206860_100000210202 [0,1,0,0,0,0|1,1,0]=3 370 B9R1.12 CCNCc1ccoc1 270004a_100015525214_100011215517 [0,1,0,0,0,0|1,1,0]=3 371 B9R1.12 CCNCc1ccoc1 34a_100015206860_100000210202 [0,1,0,0,0,0|1,1,0]=3 372 B9R1.12 CCNCc1ccon1 2230a_100015525214_100000234950 [0,1,0,0,0,0|2,1,0]=4 373 B9R1.12 CCNCc1ccsc1 207a_100015525214_100000188534 [0,1,0,0,0,0|1,0,0]=2 374 B9R1.12 CCNCc1ccsc1 2230a_100000186416_100000210202 [0,1,0,0,0,0|1,0,0]=2 375 B9R1.12 CCNCc1ccsc1 2230a_100015525214_100011261437 [0,1,0,0,0,0|1,0,0]=2 376 B9R1.12 CCNCc1ccsc1 270004a_100015525214_100000188534 [0,1,0,0,0,0|1,0,0]=2 377 B9R1.12 CCNCc1ccsc1 34a_100000186416_100000210202 [0,1,0,0,0,0|1,0,0]=2 378 B9R1.12 CCNCc1cn[nH]c1 207a_100015525214_100016992096 [0,1,0,0,0,0|3,0,0]=4 379 B9R1.12 CCNCc1cn[nH]c1 270004a_100015525214_100016992096 [0,1,0,0,0,0|3,0,0]=4 380 B9R1.12 CCNCc1cnc[nH]1 207a_100015525214_100000742939 [0,1,0,0,0,0|3,0,0]=4 381 B9R1.12 CCNCc1cnco1 270004a_100015525214_100000064291 [0,1,0,0,0,0|3,0,0]=4 382 B9R1.12 CCNCc1cncs1 207a_100015525214_100000749870 [0,1,0,0,0,0|3,0,0]=4 383 B9R1.12 CCNCc1cncs1 2230a_100015525214_100015185245 [0,1,0,0,0,0|3,0,0]=4 384 B9R1.12 CCNCc1cncs1 2230a_100016987365_100000210202 [0,1,0,0,0,0|3,0,0]=4 385 B9R1.12 CCNCc1cncs1 270004a_100015525214_100000749870 [0,1,0,0,0,0|3,0,0]=4 386 B9R1.12 CCNCc1cocn1 270004a_100015525214_100000050382 [0,1,0,0,0,0|2,1,0]=4 387 B9R1.12 CCNCc1cscn1 207a_100015525214_100000743575 [0,1,0,0,0,0|2,0,0]=3 388 B9R1.12 CCNCc1cscn1 2230a_100015185402_100000210202 [0,1,0,0,0,0|2,0,0]=3 389 B9R1.12 CCNCc1cscn1 2230a_100015525214_100000205941 [0,1,0,0,0,0|2,0,0]=3 390 B9R1.12 CCNCc1cscn1 270004a_100015525214_100000743575 [0,1,0,0,0,0|2,0,0]=3 391 B9R1.12 CCNCc1csnn1 270004a_100015525214_100000738508 [0,1,0,0,0,0|3,0,0]=4 392 B9R1.12 CCOCc1c[nH]cn1 34a_100121572206_100000707719 [0,1,0,0,0,0|3,0,0]=4 393 B9R1.12 CCOCc1ccco1 34a_100000210059_100000210202 [0,1,0,0,0,0|3,0,0]=4 394 B9R1.12 CCOCc1cccs1 34a_100000211240_100000210202 [0,1,0,0,0,0|3,0,0]=4 395 B9R1.12 CCOCc1ccn[nH]1 34a_100121572206_100000728653 [0,1,0,0,0,0|3,0,0]=4 396 B9R1.12 CCOCc1ccno1 34a_100000740478_100000210202 [0,1,0,0,0,0|3,0,0]=4 397 B9R1.12 CCOCc1ccoc1 34a_100011215357_100000210202 [0,1,0,0,0,0|1,1,0]=3 398 B9R1.12 CCOCc1ccon1 34a_100121572206_100000234950 [0,1,0,0,0,0|2,1,0]=4 399 B9R1.12 CCOCc1ccsc1 34a_100011215551_100000210202 [0,1,0,0,0,0|1,0,0]=2 400 B9R1.12 CCOCc1ccsc1 34a_100121572206_100011261437 [0,1,0,0,0,0|1,0,0]=2 401 B9R1.12 CCOCc1cncs1 34a_100121572206_100015185245 [0,1,0,0,0,0|3,0,0]=4 402 B9R1.12 CCOCc1cscn1 34a_100121572206_100000205941 [0,1,0,0,0,0|2,0,0]=3 403 B9R1.12 CCSCc1c[nH]cn1 62a_100000210202_100000707719 [0,1,0,0,0,0|3,0,0]=4 404 B9R1.12 CCSCc1c[nH]cn1 62a_100000707719_100000210202 [0,1,0,0,0,0|3,0,0]=4 405 B9R1.12 CCSCc1ccn[nH]1 62a_100000210202_100000728653 [0,1,0,0,0,0|3,0,0]=4 406 B9R1.12 CCSCc1ccn[nH]1 62a_100000728653_100000210202 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.12 CCSCc1ccon1 62a_100000210202_100000234950 [0,1,0,0,0,0|2,1,0]=4 408 B9R1.12 CCSCc1ccon1 62a_100000234950_100000210202 [0,1,0,0,0,0|2,1,0]=4 409 B9R1.12 CCSCc1ccsc1 62a_100000210202_100011233845 [0,1,0,0,0,0|1,0,0]=2 410 B9R1.12 CCSCc1ccsc1 62a_100011261437_100000210202 [0,1,0,0,0,0|1,0,0]=2 411 B9R1.12 CCSCc1cncs1 62a_100000210202_100015185245 [0,1,0,0,0,0|3,0,0]=4 412 B9R1.12 CCSCc1cncs1 62a_100015185245_100000210202 [0,1,0,0,0,0|3,0,0]=4 413 B9R1.12 CCSCc1cscn1 62a_100000205941_100000210202 [0,1,0,0,0,0|2,0,0]=3 414 B9R1.12 CCSCc1cscn1 62a_100000210202_100000205941 [0,1,0,0,0,0|2,0,0]=3 415 B9R1.12 CNCCc1c[nH]cn1 2230a_106832991635_100020628418 [0,1,0,0,0,0|2,0,0]=3 416 B9R1.12 CNCCc1c[nH]cn1 7a_106832991635_100020628418 [0,1,0,0,0,0|2,0,0]=3 417 B9R1.12 CNCCc1ccco1 2230a_100000694680_200000210301 [0,1,0,0,0,0|2,0,0]=3 418 B9R1.12 CNCCc1ccco1 34a_100000694680_200000210301 [0,1,0,0,0,0|2,0,0]=3 419 B9R1.12 CNCCc1cccs1 2230a_100000203755_200000210301 [0,1,0,0,0,0|2,0,0]=3 420 B9R1.12 CNCCc1cccs1 2230a_106832991635_100000748579 [0,1,0,0,0,0|2,0,0]=3 421 B9R1.12 CNCCc1cccs1 34a_100000203755_200000210301 [0,1,0,0,0,0|2,0,0]=3 422 B9R1.12 CNCCc1cccs1 34a_100102657272_100000748579 [0,1,0,0,0,0|2,0,0]=3 423 B9R1.12 CNCCc1cccs1 7a_106832991635_100000748579 [0,1,0,0,0,0|2,0,0]=3 424 B9R1.12 CNCCc1ccsc1 2230a_100000692642_200000210301 [0,1,0,0,0,0|0,0,0]=1 425 B9R1.12 CNCCc1ccsc1 34a_100000692642_200000210301 [0,1,0,0,0,0|0,0,0]=1 426 B9R1.12 CNCCc1cn[nH]c1 2230a_100000732747_200000210301 [0,1,0,0,0,0|2,0,0]=3 427 B9R1.12 CNCCc1cn[nH]c1 2230a_106832991635_100000743252 [0,1,0,0,0,0|2,0,0]=3 428 B9R1.12 CNCCc1cn[nH]c1 7a_106832991635_100000743252 [0,1,0,0,0,0|2,0,0]=3 429 B9R1.12 CNCCc1cncs1 2230a_100016991637_200000210301 [0,1,0,0,0,0|2,0,0]=3 430 B9R1.12 CNCCc1nccs1 2230a_100015186391_200000210301 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.12 CNCCn1cccc1 2230a_106832991635_200009811947 [0,1,0,0,0,0|2,0,0]=3 432 B9R1.12 CNCCn1cccc1 34a_100011368172_200000210301 [0,1,0,0,0,0|2,0,0]=3 433 B9R1.12 CNCCn1cccc1 7a_106832991635_200000035178 [0,1,0,0,0,0|2,0,0]=3 434 B9R1.12 CNCCn1cccn1 2230a_100011200920_200000210301 [0,1,0,0,0,0|3,0,0]=4 435 B9R1.12 CNCCn1cccn1 2230a_106832991635_100000685285 [0,1,0,0,0,0|3,0,0]=4 436 B9R1.12 CNCCn1cccn1 34a_100102657272_100015204718 [0,1,0,0,0,0|3,0,0]=4 437 B9R1.12 CNCCn1cccn1 7a_106832991635_100000685285 [0,1,0,0,0,0|3,0,0]=4 438 B9R1.12 CNCCn1ccnc1 7a_106832991635_100000702546 [0,1,0,0,0,0|2,0,0]=3 439 B9R1.12 CNCCn1cncn1 2230a_106832991635_100000731791 [0,1,0,0,0,0|3,0,0]=4 440 B9R1.12 CNCCn1cncn1 2230a_200000738561_200000210301 [0,1,0,0,0,0|3,0,0]=4 441 B9R1.12 CNCCn1cncn1 34a_100102657272_200000749826 [0,1,0,0,0,0|3,0,0]=4 442 B9R1.12 CNCCn1cncn1 7a_106832991635_100000731791 [0,1,0,0,0,0|3,0,0]=4 443 B9R1.12 COCC[n+]1ccsc1 34a_200000100414_200000210301 [0,1,0,0,0,0|2,0,0]=3 444 B9R1.12 COCCc1cccs1 34a_100011216825_200000210301 [0,1,0,0,0,0|3,0,0]=4 445 B9R1.12 COCCc1cccs1 34a_100138415774_100000748579 [0,1,0,0,0,0|3,0,0]=4 446 B9R1.12 COCCc1cccs1 7a_100011216825_200000210301 [0,1,0,0,0,0|3,0,0]=4 447 B9R1.12 COCCc1ccsc1 34a_100000748821_200000210301 [0,1,0,0,0,0|1,0,0]=2 448 B9R1.12 COCCc1cn[nH]c1 34a_100000766553_200000210301 [0,1,0,0,0,0|3,0,0]=4 449 B9R1.12 COCCc1cnoc1 34a_100000732699_200000210301 [0,1,0,0,0,0|2,1,0]=4 450 B9R1.12 COCCn1cccc1 34a_100000179382_200000210301 [0,1,0,0,0,0|3,0,0]=4 451 B9R1.12 COCCn1ccnc1 34a_100000719764_200000210301 [0,1,0,0,0,0|3,0,0]=4 452 B9R1.12 COCSc1ccoc1 62a_100000766300_100011215275 [0,1,0,0,0,0|2,1,0]=4 453 B9R1.12 COCSc1ccoc1 62a_100011215275_100000766300 [0,1,0,0,0,0|2,1,0]=4 454 B9R1.12 COCSc1ccsc1 62a_100000738268_100000766300 [0,1,0,0,0,0|2,0,0]=3 455 B9R1.12 COCSc1ccsc1 62a_100000766300_100000738268 [0,1,0,0,0,0|2,0,0]=3 456 B9R1.12 COCSc1ccsn1 62a_100000766300_100009818082 [0,1,0,0,0,0|3,0,0]=4 457 B9R1.12 COCSc1ccsn1 62a_100009818082_100000766300 [0,1,0,0,0,0|3,0,0]=4 458 B9R1.12 COCSc1cnsc1 62a_100000766300_100009815736 [0,1,0,0,0,0|3,0,0]=4 459 B9R1.12 COCSc1cnsc1 62a_100009815736_100000766300 [0,1,0,0,0,0|3,0,0]=4 460 B9R1.12 COCSc1cscn1 62a_100000751502_100000766300 [0,1,0,0,0,0|3,0,0]=4 461 B9R1.12 COCSc1cscn1 62a_100000766300_100000751502 [0,1,0,0,0,0|3,0,0]=4 462 B9R1.12 CSCCc1c[nH]cn1 62a_100020628418_200000210301 [0,1,0,0,0,0|3,0,0]=4 463 B9R1.12 CSCCc1c[nH]cn1 62a_200000210301_100020628418 [0,1,0,0,0,0|3,0,0]=4 464 B9R1.12 CSCCc1cccs1 62a_100000748579_200000210301 [0,1,0,0,0,0|3,0,0]=4 465 B9R1.12 CSCCc1cccs1 62a_200000210301_100000748579 [0,1,0,0,0,0|3,0,0]=4 466 B9R1.12 CSCCc1cn[nH]c1 62a_100000743252_200000210301 [0,1,0,0,0,0|3,0,0]=4 467 B9R1.12 CSCCc1cn[nH]c1 62a_200000210301_100000743252 [0,1,0,0,0,0|3,0,0]=4 468 B9R1.12 CSCCn1cccc1 62a_200000210301_200000035178 [0,1,0,0,0,0|3,0,0]=4 469 B9R1.12 CSCCn1cccc1 62a_200009811947_200000210301 [0,1,0,0,0,0|3,0,0]=4 470 B9R1.12 CSCCn1ccnc1 62a_100000702546_200000210301 [0,1,0,0,0,0|3,0,0]=4 471 B9R1.12 CSCCn1ccnc1 62a_200000210301_100000702546 [0,1,0,0,0,0|3,0,0]=4 472 B9R1.12 CSCOc1ccsc1 34a_100000106738_100011218213 [0,1,0,0,0,0|2,0,0]=3 473 B9R1.12 CSCSc1ccoc1 62a_100011215275_100011218213 [0,1,0,0,0,0|2,1,0]=4 474 B9R1.12 CSCSc1ccoc1 62a_100011218213_100011215275 [0,1,0,0,0,0|2,1,0]=4 475 B9R1.12 CSCSc1ccsc1 62a_100000738268_100011218213 [0,1,0,0,0,0|2,0,0]=3 476 B9R1.12 CSCSc1ccsc1 62a_100011218213_100000738268 [0,1,0,0,0,0|2,0,0]=3 477 B9R1.12 CSCSc1ccsn1 62a_100009818082_100011218213 [0,1,0,0,0,0|3,0,0]=4 478 B9R1.12 CSCSc1ccsn1 62a_100011218213_100009818082 [0,1,0,0,0,0|3,0,0]=4 479 B9R1.12 CSCSc1cnsc1 62a_100009815736_100011218213 [0,1,0,0,0,0|3,0,0]=4 480 B9R1.12 CSCSc1cnsc1 62a_100011218213_100009815736 [0,1,0,0,0,0|3,0,0]=4 481 B9R1.12 CSCSc1cscn1 62a_100000751502_100011218213 [0,1,0,0,0,0|3,0,0]=4 482 B9R1.12 CSCSc1cscn1 62a_100011218213_100000751502 [0,1,0,0,0,0|3,0,0]=4 483 B9R1.12 FCCOc1ccsc1 34a_100000106738_100011217306 [0,1,0,0,0,0|1,0,0]=2 484 B9R1.12 FCCOc1ccsc1 7a_100000106738_100011217306 [0,1,0,0,0,0|1,0,0]=2 485 B9R1.12 FCCSc1c[nH]cn1 62a_100000756875_100011217306 [0,1,0,0,0,0|3,0,0]=4 486 B9R1.12 FCCSc1c[nH]cn1 62a_100011217306_100000756875 [0,1,0,0,0,0|3,0,0]=4 487 B9R1.12 FCCSc1cc[nH]n1 62a_100000062575_100011217306 [0,1,0,0,0,0|3,0,0]=4 488 B9R1.12 FCCSc1cc[nH]n1 62a_100011217306_100000062575 [0,1,0,0,0,0|3,0,0]=4 489 B9R1.12 FCCSc1ccco1 62a_100009814098_100011217306 [0,1,0,0,0,0|3,0,0]=4 490 B9R1.12 FCCSc1ccco1 62a_100011217306_100009814098 [0,1,0,0,0,0|3,0,0]=4 491 B9R1.12 FCCSc1cccs1 62a_100011215356_100011217306 [0,1,0,0,0,0|3,0,0]=4 492 B9R1.12 FCCSc1cccs1 62a_100011217306_100011215356 [0,1,0,0,0,0|3,0,0]=4 493 B9R1.12 FCCSc1ccoc1 62a_100011215275_100011217306 [0,1,0,0,0,0|1,1,0]=3 494 B9R1.12 FCCSc1ccoc1 62a_100011217306_100011215275 [0,1,0,0,0,0|1,1,0]=3 495 B9R1.12 FCCSc1ccon1 62a_100009818083_100011217306 [0,1,0,0,0,0|2,1,0]=4 496 B9R1.12 FCCSc1ccon1 62a_100011217306_100009818083 [0,1,0,0,0,0|2,1,0]=4 497 B9R1.12 FCCSc1ccsc1 62a_100000738268_100011217306 [0,1,0,0,0,0|1,0,0]=2 498 B9R1.12 FCCSc1ccsc1 62a_100011217306_100000738268 [0,1,0,0,0,0|1,0,0]=2 499 B9R1.12 FCCSc1ccsn1 62a_100009818082_100011217306 [0,1,0,0,0,0|2,0,0]=3 500 B9R1.12 FCCSc1ccsn1 62a_100011217306_100009818082 [0,1,0,0,0,0|2,0,0]=3 501 B9R1.12 FCCSc1cn[nH]c1 62a_100000238712_100011217306 [0,1,0,0,0,0|3,0,0]=4 502 B9R1.12 FCCSc1cn[nH]c1 62a_100011217306_100000238712 [0,1,0,0,0,0|3,0,0]=4 503 B9R1.12 FCCSc1cnco1 62a_100011217306_100020591547 [0,1,0,0,0,0|3,0,0]=4 504 B9R1.12 FCCSc1cnco1 62a_100020591547_100011217306 [0,1,0,0,0,0|3,0,0]=4 505 B9R1.12 FCCSc1cncs1 62a_100011217306_100011934649 [0,1,0,0,0,0|3,0,0]=4 506 B9R1.12 FCCSc1cncs1 62a_100011934649_100011217306 [0,1,0,0,0,0|3,0,0]=4 507 B9R1.12 FCCSc1cnoc1 62a_100009815712_100011217306 [0,1,0,0,0,0|2,1,0]=4 508 B9R1.12 FCCSc1cnoc1 62a_100011217306_100009815712 [0,1,0,0,0,0|2,1,0]=4 509 B9R1.12 FCCSc1cnsc1 62a_100009815736_100011217306 [0,1,0,0,0,0|2,0,0]=3 510 B9R1.12 FCCSc1cnsc1 62a_100011217306_100009815736 [0,1,0,0,0,0|2,0,0]=3 511 B9R1.12 FCCSc1cscn1 62a_100000751502_100011217306 [0,1,0,0,0,0|2,0,0]=3 512 B9R1.12 FCCSc1cscn1 62a_100011217306_100000751502 [0,1,0,0,0,0|2,0,0]=3 513 B9R1.12 FCNCc1ccco1 34a_100000185738_100015361967 [0,1,0,0,0,0|3,0,0]=4 514 B9R1.12 FCNCc1ccoc1 34a_100015206860_100015361967 [0,1,0,0,0,0|1,1,0]=3 515 B9R1.12 FCNCc1ccsc1 34a_100000186416_100015361967 [0,1,0,0,0,0|1,0,0]=2 516 B9R1.12 FCOCc1ccco1 34a_100000210059_100015361967 [0,1,0,0,0,0|3,0,0]=4 517 B9R1.12 FCOCc1cccs1 34a_100000211240_100015361967 [0,1,0,0,0,0|3,0,0]=4 518 B9R1.12 FCOCc1ccno1 34a_100000740478_100015361967 [0,1,0,0,0,0|3,0,0]=4 519 B9R1.12 FCOCc1ccoc1 34a_100011215357_100015361967 [0,1,0,0,0,0|1,1,0]=3 520 B9R1.12 FCOCc1ccsc1 34a_100011215551_100015361967 [0,1,0,0,0,0|1,0,0]=2 521 B9R1.12 FCSCc1c[nH]cn1 62a_100000707719_100015361967 [0,1,0,0,0,0|3,0,0]=4 522 B9R1.12 FCSCc1c[nH]cn1 62a_100015361967_100000707719 [0,1,0,0,0,0|3,0,0]=4 523 B9R1.12 FCSCc1ccn[nH]1 62a_100000728653_100015361967 [0,1,0,0,0,0|3,0,0]=4 524 B9R1.12 FCSCc1ccn[nH]1 62a_100015361967_100000728653 [0,1,0,0,0,0|3,0,0]=4 525 B9R1.12 FCSCc1ccon1 62a_100000234950_100015361967 [0,1,0,0,0,0|2,1,0]=4 526 B9R1.12 FCSCc1ccon1 62a_100015361967_100000234950 [0,1,0,0,0,0|2,1,0]=4 527 B9R1.12 FCSCc1ccsc1 62a_100011261437_100015361967 [0,1,0,0,0,0|1,0,0]=2 528 B9R1.12 FCSCc1ccsc1 62a_100015361967_100011233845 [0,1,0,0,0,0|1,0,0]=2 529 B9R1.12 FCSCc1cncs1 62a_100015185245_100015361967 [0,1,0,0,0,0|3,0,0]=4 530 B9R1.12 FCSCc1cncs1 62a_100015361967_100015185245 [0,1,0,0,0,0|3,0,0]=4 531 B9R1.12 FCSCc1cscn1 62a_100000205941_100015361967 [0,1,0,0,0,0|2,0,0]=3 532 B9R1.12 FCSCc1cscn1 62a_100015361967_100000205941 [0,1,0,0,0,0|2,0,0]=3 533 B9R1.12 N#CCOc1ccsc1 7a_100000106738_100011215382 [0,1,0,0,0,0|0,0,2]=3 534 B9R1.12 N#CCSc1ccoc1 62a_100011215275_100011215382 [0,1,0,0,0,0|0,1,2]=4 535 B9R1.12 N#CCSc1ccoc1 62a_100011215382_100011215275 [0,1,0,0,0,0|0,1,2]=4 536 B9R1.12 N#CCSc1ccsc1 62a_100000738268_100011215382 [0,1,0,0,0,0|0,0,2]=3 537 B9R1.12 N#CCSc1ccsc1 62a_100011215382_100000738268 [0,1,0,0,0,0|0,0,2]=3 538 B9R1.12 N#CCSc1ccsn1 62a_100009818082_100011215382 [0,1,0,0,0,0|1,0,2]=4 539 B9R1.12 N#CCSc1ccsn1 62a_100011215382_100009818082 [0,1,0,0,0,0|1,0,2]=4 540 B9R1.12 N#CCSc1cnsc1 62a_100009815736_100011215382 [0,1,0,0,0,0|1,0,2]=4 541 B9R1.12 N#CCSc1cnsc1 62a_100011215382_100009815736 [0,1,0,0,0,0|1,0,2]=4 542 B9R1.12 N#CCSc1cscn1 62a_100000751502_100011215382 [0,1,0,0,0,0|1,0,2]=4 543 B9R1.12 N#CCSc1cscn1 62a_100011215382_100000751502 [0,1,0,0,0,0|1,0,2]=4 544 B9R1.12 O=CCOc1ccsc1 34a_100000106738_200009817547 [0,1,0,0,0,0|1,0,1]=3 545 B9R1.12 O=CCOc1ccsc1 7a_100000106738_200015260668 [0,1,0,0,0,0|1,0,1]=3 546 B9R1.12 O=CCSc1ccoc1 62a_100011215275_200015260668 [0,1,0,0,0,0|1,1,1]=4 547 B9R1.12 O=CCSc1ccoc1 62a_200015260668_100011215275 [0,1,0,0,0,0|1,1,1]=4 548 B9R1.12 O=CCSc1ccsc1 62a_100000738268_200015260668 [0,1,0,0,0,0|1,0,1]=3 549 B9R1.12 O=CCSc1ccsc1 62a_200015260668_100000738268 [0,1,0,0,0,0|1,0,1]=3 550 B9R1.12 O=CCSc1ccsn1 62a_100009818082_200015260668 [0,1,0,0,0,0|2,0,1]=4 551 B9R1.12 O=CCSc1ccsn1 62a_200015260668_100009818082 [0,1,0,0,0,0|2,0,1]=4 552 B9R1.12 O=CCSc1cnsc1 62a_100009815736_200015260668 [0,1,0,0,0,0|2,0,1]=4 553 B9R1.12 O=CCSc1cnsc1 62a_200015260668_100009815736 [0,1,0,0,0,0|2,0,1]=4 554 B9R1.12 O=CCSc1cscn1 62a_100000751502_200015260668 [0,1,0,0,0,0|2,0,1]=4 555 B9R1.12 O=CCSc1cscn1 62a_200015260668_100000751502 [0,1,0,0,0,0|2,0,1]=4 556 B9R1.12 OCCOc1ccsc1 34a_100000106738_100000211926 [0,1,0,0,0,0|1,0,0]=2 557 B9R1.12 OCCOc1ccsc1 7a_100000106738_100000211926 [0,1,0,0,0,0|1,0,0]=2 558 B9R1.12 OCCSc1c[nH]cn1 62a_100000211926_100000756875 [0,1,0,0,0,0|3,0,0]=4 559 B9R1.12 OCCSc1c[nH]cn1 62a_100000756875_100000211926 [0,1,0,0,0,0|3,0,0]=4 560 B9R1.12 OCCSc1cc[nH]n1 62a_100000062575_100000211926 [0,1,0,0,0,0|3,0,0]=4 561 B9R1.12 OCCSc1cc[nH]n1 62a_100000211926_100000062575 [0,1,0,0,0,0|3,0,0]=4 562 B9R1.12 OCCSc1ccco1 62a_100000211926_100009814098 [0,1,0,0,0,0|3,0,0]=4 563 B9R1.12 OCCSc1ccco1 62a_100009814098_100000211926 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.12 OCCSc1cccs1 62a_100000211926_100011215356 [0,1,0,0,0,0|3,0,0]=4 565 B9R1.12 OCCSc1cccs1 62a_100011215356_100000211926 [0,1,0,0,0,0|3,0,0]=4 566 B9R1.12 OCCSc1ccoc1 62a_100000211926_100011215275 [0,1,0,0,0,0|1,1,0]=3 567 B9R1.12 OCCSc1ccoc1 62a_100011215275_100000211926 [0,1,0,0,0,0|1,1,0]=3 568 B9R1.12 OCCSc1ccon1 62a_100000211926_100009818083 [0,1,0,0,0,0|2,1,0]=4 569 B9R1.12 OCCSc1ccon1 62a_100009818083_100000211926 [0,1,0,0,0,0|2,1,0]=4 570 B9R1.12 OCCSc1ccsc1 62a_100000211926_100000738268 [0,1,0,0,0,0|1,0,0]=2 571 B9R1.12 OCCSc1ccsc1 62a_100000738268_100000211926 [0,1,0,0,0,0|1,0,0]=2 572 B9R1.12 OCCSc1ccsn1 62a_100000211926_100009818082 [0,1,0,0,0,0|2,0,0]=3 573 B9R1.12 OCCSc1ccsn1 62a_100009818082_100000211926 [0,1,0,0,0,0|2,0,0]=3 574 B9R1.12 OCCSc1cn[nH]c1 62a_100000211926_100000238712 [0,1,0,0,0,0|3,0,0]=4 575 B9R1.12 OCCSc1cn[nH]c1 62a_100000238712_100000211926 [0,1,0,0,0,0|3,0,0]=4 576 B9R1.12 OCCSc1cnco1 62a_100000211926_100020591547 [0,1,0,0,0,0|3,0,0]=4 577 B9R1.12 OCCSc1cnco1 62a_100020591547_100000211926 [0,1,0,0,0,0|3,0,0]=4 578 B9R1.12 OCCSc1cncs1 62a_100000211926_100011934649 [0,1,0,0,0,0|3,0,0]=4 579 B9R1.12 OCCSc1cncs1 62a_100011934649_100000211926 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.12 OCCSc1cnoc1 62a_100000211926_100009815712 [0,1,0,0,0,0|2,1,0]=4 581 B9R1.12 OCCSc1cnoc1 62a_100009815712_100000211926 [0,1,0,0,0,0|2,1,0]=4 582 B9R1.12 OCCSc1cnsc1 62a_100000211926_100009815736 [0,1,0,0,0,0|2,0,0]=3 583 B9R1.12 OCCSc1cnsc1 62a_100009815736_100000211926 [0,1,0,0,0,0|2,0,0]=3 584 B9R1.12 OCCSc1cscn1 62a_100000211926_100000751502 [0,1,0,0,0,0|2,0,0]=3 585 B9R1.12 OCCSc1cscn1 62a_100000751502_100000211926 [0,1,0,0,0,0|2,0,0]=3 586 B9R1.12 [13CH3]NCCc1ccco1 2230a_100000694680_200025704644 [0,1,0,0,0,0|2,0,0]=3 587 B9R1.12 [13CH3]NCCc1ccco1 34a_100000694680_200025704644 [0,1,0,0,0,0|2,0,0]=3 588 B9R1.12 [13CH3]NCCc1cccs1 2230a_100000203755_200025704644 [0,1,0,0,0,0|2,0,0]=3 589 B9R1.12 [13CH3]NCCc1cccs1 34a_100000203755_200025704644 [0,1,0,0,0,0|2,0,0]=3 590 B9R1.12 [13CH3]NCCc1ccsc1 2230a_100000692642_200025704644 [0,1,0,0,0,0|0,0,0]=1 591 B9R1.12 [13CH3]NCCc1ccsc1 34a_100000692642_200025704644 [0,1,0,0,0,0|0,0,0]=1 592 B9R1.12 [13CH3]NCCc1cn[nH]c1 2230a_100000732747_200025704644 [0,1,0,0,0,0|2,0,0]=3 593 B9R1.12 [13CH3]NCCc1cncs1 2230a_100016991637_200025704644 [0,1,0,0,0,0|2,0,0]=3 594 B9R1.12 [13CH3]NCCc1nccs1 2230a_100015186391_200025704644 [0,1,0,0,0,0|3,0,0]=4 595 B9R1.12 [13CH3]NCCn1cccc1 34a_100011368172_200025704644 [0,1,0,0,0,0|2,0,0]=3 596 B9R1.12 [13CH3]NCCn1cccn1 2230a_100011200920_200025704644 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.12 [13CH3]NCCn1cncn1 2230a_200000738561_200025704644 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.12 [13CH3]OCC[n+]1ccsc1 34a_200000100414_200025704644 [0,1,0,0,0,0|2,0,0]=3 599 B9R1.12 [13CH3]OCCc1cccs1 34a_100011216825_200025704644 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.12 [13CH3]OCCc1cccs1 7a_100011216825_200025704644 [0,1,0,0,0,0|3,0,0]=4 601 B9R1.12 [13CH3]OCCc1ccsc1 34a_100000748821_200025704644 [0,1,0,0,0,0|1,0,0]=2 602 B9R1.12 [13CH3]OCCc1cn[nH]c1 34a_100000766553_200025704644 [0,1,0,0,0,0|3,0,0]=4 603 B9R1.12 [13CH3]OCCc1cnoc1 34a_100000732699_200025704644 [0,1,0,0,0,0|2,1,0]=4 604 B9R1.12 [13CH3]OCCn1cccc1 34a_100000179382_200025704644 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.12 [13CH3]OCCn1ccnc1 34a_100000719764_200025704644 [0,1,0,0,0,0|3,0,0]=4 606 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_100020628418_200025704644 [0,1,0,0,0,0|3,0,0]=4 607 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_200025704644_100020628418 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.12 [13CH3]SCCc1cccs1 62a_100000748579_200025704644 [0,1,0,0,0,0|3,0,0]=4 609 B9R1.12 [13CH3]SCCc1cccs1 62a_200025704644_100000748579 [0,1,0,0,0,0|3,0,0]=4 610 B9R1.12 [13CH3]SCCc1cn[nH]c1 62a_100000743252_200025704644 [0,1,0,0,0,0|3,0,0]=4 611 B9R1.12 [13CH3]SCCc1cn[nH]c1 62a_200025704644_100000743252 [0,1,0,0,0,0|3,0,0]=4 612 B9R1.12 [13CH3]SCCn1cccc1 62a_200009811947_200025704644 [0,1,0,0,0,0|3,0,0]=4 613 B9R1.12 [13CH3]SCCn1cccc1 62a_200025704644_200000035178 [0,1,0,0,0,0|3,0,0]=4 614 B9R1.12 [13CH3]SCCn1ccnc1 62a_100000702546_200025704644 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.12 [13CH3]SCCn1ccnc1 62a_200025704644_100000702546 [0,1,0,0,0,0|3,0,0]=4 616 B9R1.13 CC(=Cc1ccsc1)C 271570a_100102525489_100000738268 [0,1,0,0,0,0|1,0,2]=4 617 B9R1.13 CC(=O)Cc1ccoc1 1458a_100000684892_200000210301 [0,1,0,0,0,0|1,1,1]=4 618 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000070787_100011233845 [0,1,0,0,0,0|1,0,1]=3 619 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000184062_200000210301 [0,1,0,0,0,0|1,0,1]=3 620 B9R1.13 CC(=O)Cc1cscn1 1458a_100000070787_100000205941 [0,1,0,0,0,0|2,0,1]=4 621 B9R1.13 CC(=O)Cc1cscn1 1458a_100011438297_200000210301 [0,1,0,0,0,0|2,0,1]=4 622 B9R1.13 CC(C)Oc1ccsc1 34a_100000106738_100000210206 [0,1,0,0,0,0|2,0,0]=3 623 B9R1.13 CC(C)Oc1ccsc1 7a_100000106738_100000210206 [0,1,0,0,0,0|2,0,0]=3 624 B9R1.13 CC(C)Sc1ccoc1 62a_100000210206_100011215275 [0,1,0,0,0,0|2,1,0]=4 625 B9R1.13 CC(C)Sc1ccoc1 62a_100011215275_100000210206 [0,1,0,0,0,0|2,1,0]=4 626 B9R1.13 CC(C)Sc1ccsc1 62a_100000210206_100000738268 [0,1,0,0,0,0|2,0,0]=3 627 B9R1.13 CC(C)Sc1ccsc1 62a_100000738268_100000210206 [0,1,0,0,0,0|2,0,0]=3 628 B9R1.13 CC(C)Sc1ccsn1 62a_100000210206_100009818082 [0,1,0,0,0,0|3,0,0]=4 629 B9R1.13 CC(C)Sc1ccsn1 62a_100009818082_100000210206 [0,1,0,0,0,0|3,0,0]=4 630 B9R1.13 CC(C)Sc1cnsc1 62a_100000210206_100009815736 [0,1,0,0,0,0|3,0,0]=4 631 B9R1.13 CC(C)Sc1cnsc1 62a_100009815736_100000210206 [0,1,0,0,0,0|3,0,0]=4 632 B9R1.13 CC(C)Sc1cscn1 62a_100000210206_100000751502 [0,1,0,0,0,0|3,0,0]=4 633 B9R1.13 CC(C)Sc1cscn1 62a_100000751502_100000210206 [0,1,0,0,0,0|3,0,0]=4 634 B9R1.13 CN(C)Cc1ccoc1 270004a_100102631434_100011215517 [0,1,0,0,0,0|2,1,0]=4 635 B9R1.13 CN(C)Cc1ccsc1 2230a_100020654213_200000210301 [0,1,0,0,0,0|2,0,0]=3 636 B9R1.13 CN(C)Cc1ccsc1 2230a_100102631434_100011261437 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.13 CN(C)Cc1ccsc1 269982a_100020654213_200000210301 [0,1,0,0,0,0|2,0,0]=3 638 B9R1.13 CN(C)Cc1ccsc1 269982a_100102631434_100011233845 [0,1,0,0,0,0|2,0,0]=3 639 B9R1.13 CN(C)Cc1ccsc1 270004a_100102631434_100000188534 [0,1,0,0,0,0|2,0,0]=3 640 B9R1.13 CN(C)Cc1cscn1 2230a_100000225794_200000210301 [0,1,0,0,0,0|3,0,0]=4 641 B9R1.13 CN(C)Cc1cscn1 2230a_100102631434_100000205941 [0,1,0,0,0,0|3,0,0]=4 642 B9R1.13 CN(C)Cc1cscn1 269982a_100000225794_200000210301 [0,1,0,0,0,0|3,0,0]=4 643 B9R1.13 CN(C)Cc1cscn1 269982a_100102631434_100000205941 [0,1,0,0,0,0|3,0,0]=4 644 B9R1.13 CN(C)Cc1cscn1 270004a_100102631434_100000743575 [0,1,0,0,0,0|3,0,0]=4 645 B9R1.13 CN([13CH3])Cc1ccsc1 2230a_100020654213_200025704644 [0,1,0,0,0,0|2,0,0]=3 646 B9R1.13 CN([13CH3])Cc1ccsc1 269982a_100020654213_200025704644 [0,1,0,0,0,0|2,0,0]=3 647 B9R1.13 CN([13CH3])Cc1cscn1 2230a_100000225794_200025704644 [0,1,0,0,0,0|3,0,0]=4 648 B9R1.13 CN([13CH3])Cc1cscn1 269982a_100000225794_200025704644 [0,1,0,0,0,0|3,0,0]=4 649 B9R1.13 [13CH3]C(=O)Cc1ccoc1 1458a_100000684892_200025704644 [0,1,0,0,0,0|1,1,1]=4 650 B9R1.13 [13CH3]C(=O)Cc1ccsc1 1458a_100000184062_200025704644 [0,1,0,0,0,0|1,0,1]=3 651 B9R1.13 [13CH3]C(=O)Cc1cscn1 1458a_100011438297_200025704644 [0,1,0,0,0,0|2,0,1]=4 652 B9R1.33 C=C=Cc1ccsc1C 271570a_100015277604_100000684487 [0,1,0,0,0,0|1,0,2]=4 653 B9R1.33 C=C=Cc1cscc1Br 271570a_100015277604_100010143727 [0,1,0,0,0,0|1,0,2]=4 654 B9R1.33 C=C=Cc1cscc1C 271570a_100015277604_100000759966 [0,1,0,0,0,0|1,0,2]=4 655 B9R1.33 CC=Cc1ccsc1C 271570a_100016259895_100000684487 [0,1,0,0,0,0|1,0,2]=4 656 B9R1.33 CC=Cc1cscc1Br 271570a_100016259895_100010143727 [0,1,0,0,0,0|1,0,2]=4 657 B9R1.33 CC=Cc1cscc1C 271570a_100016259895_100000759966 [0,1,0,0,0,0|1,0,2]=4 658 B9R1.33 CCSc1ccsc1C 62a_100000210202_100000684487 [0,1,0,0,0,0|2,0,0]=3 659 B9R1.33 CCSc1ccsc1C 62a_100000684487_100000210202 [0,1,0,0,0,0|2,0,0]=3 660 B9R1.33 CCSc1cscc1Br 62a_100000210202_100010143727 [0,1,0,0,0,0|2,0,0]=3 661 B9R1.33 CCSc1cscc1Br 62a_100010143727_100000210202 [0,1,0,0,0,0|2,0,0]=3 662 B9R1.33 CCSc1cscc1C 62a_100000210202_100000759966 [0,1,0,0,0,0|2,0,0]=3 663 B9R1.33 CCSc1cscc1C 62a_100000759966_100000210202 [0,1,0,0,0,0|2,0,0]=3 664 B9R1.33 CCSc1ncsc1C 62a_100000210202_100000732656 [0,1,0,0,0,0|3,0,0]=4 665 B9R1.33 CCSc1ncsc1C 62a_100000732656_100000210202 [0,1,0,0,0,0|3,0,0]=4 666 B9R1.33 CNCc1ccsc1Br 207a_100102657272_100009816921 [0,1,0,0,0,0|2,0,0]=3 667 B9R1.33 CNCc1ccsc1Br 2230a_100000727803_200000210301 [0,1,0,0,0,0|2,0,0]=3 668 B9R1.33 CNCc1ccsc1Br 2230a_106832991635_100009814289 [0,1,0,0,0,0|2,0,0]=3 669 B9R1.33 CNCc1ccsc1Br 270004a_106832991635_100009816921 [0,1,0,0,0,0|2,0,0]=3 670 B9R1.33 CNCc1ccsc1Br 34a_100000727803_200000210301 [0,1,0,0,0,0|2,0,0]=3 671 B9R1.33 CNCc1ccsc1Br 34a_100102657272_100009814289 [0,1,0,0,0,0|2,0,0]=3 672 B9R1.33 CNCc1ccsc1Br 7a_106832991635_100009814289 [0,1,0,0,0,0|2,0,0]=3 673 B9R1.33 CNCc1ccsc1Cl 207a_100102657272_100000089901 [0,1,0,0,0,0|2,0,0]=3 674 B9R1.33 CNCc1ccsc1Cl 2230a_106832991635_100010167017 [0,1,0,0,0,0|2,0,0]=3 675 B9R1.33 CNCc1ccsc1Cl 270004a_106832991635_100000089901 [0,1,0,0,0,0|2,0,0]=3 676 B9R1.33 CNCc1ccsc1Cl 34a_100102657272_100010167017 [0,1,0,0,0,0|2,0,0]=3 677 B9R1.33 CNCc1ccsc1Cl 7a_106832991635_100010167017 [0,1,0,0,0,0|2,0,0]=3 678 B9R1.33 CNCc1ccsc1O 271570a_203496583355_100009817074 [0,1,0,0,0,0|2,0,0]=3 679 B9R1.33 CNCc1cscc1Br 207a_100102657272_100000685484 [0,1,0,0,0,0|2,0,0]=3 680 B9R1.33 CNCc1cscc1Br 270004a_106832991635_100000685484 [0,1,0,0,0,0|2,0,0]=3 681 B9R1.33 CNCc1cscc1O 271570a_203496583355_100011935083 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.33 COCc1ccoc1C 34a_100011219433_200000210301 [0,1,0,0,0,0|2,1,0]=4 683 B9R1.33 COCc1ccoc1C 7a_100011219433_200000210301 [0,1,0,0,0,0|2,1,0]=4 684 B9R1.33 COCc1ccsc1Br 34a_100009816922_200000210301 [0,1,0,0,0,0|2,0,0]=3 685 B9R1.33 COCc1ccsc1Br 34a_100138415774_100009814289 [0,1,0,0,0,0|2,0,0]=3 686 B9R1.33 COCc1ccsc1Br 7a_100009816922_200000210301 [0,1,0,0,0,0|2,0,0]=3 687 B9R1.33 COCc1ccsc1Cl 34a_100138415774_100010167017 [0,1,0,0,0,0|2,0,0]=3 688 B9R1.33 COCc1cscc1Br 34a_100000724555_200000210301 [0,1,0,0,0,0|2,0,0]=3 689 B9R1.33 CSCc1ccsc1Br 62a_100009814289_200000210301 [0,1,0,0,0,0|2,0,0]=3 690 B9R1.33 CSCc1ccsc1Br 62a_200000210301_100009814289 [0,1,0,0,0,0|2,0,0]=3 691 B9R1.33 CSCc1ccsc1Cl 62a_100010167017_200000210301 [0,1,0,0,0,0|2,0,0]=3 692 B9R1.33 CSCc1ccsc1Cl 62a_200000210301_100010167017 [0,1,0,0,0,0|2,0,0]=3 693 B9R1.33 Cc1cscc1SCF 62a_100000759966_100015361967 [0,1,0,0,0,0|2,0,0]=3 694 B9R1.33 Cc1cscc1SCF 62a_100015361967_100000759966 [0,1,0,0,0,0|2,0,0]=3 695 B9R1.33 Cc1occc1CO[13CH3] 34a_100011219433_200025704644 [0,1,0,0,0,0|2,1,0]=4 696 B9R1.33 Cc1occc1CO[13CH3] 7a_100011219433_200025704644 [0,1,0,0,0,0|2,1,0]=4 697 B9R1.33 Cc1sccc1SCF 62a_100000684487_100015361967 [0,1,0,0,0,0|2,0,0]=3 698 B9R1.33 Cc1sccc1SCF 62a_100015361967_100000684487 [0,1,0,0,0,0|2,0,0]=3 699 B9R1.33 Cc1scnc1SCF 62a_100000732656_100015361967 [0,1,0,0,0,0|3,0,0]=4 700 B9R1.33 Cc1scnc1SCF 62a_100015361967_100000732656 [0,1,0,0,0,0|3,0,0]=4 701 B9R1.33 FCSc1cscc1Br 62a_100010143727_100015361967 [0,1,0,0,0,0|2,0,0]=3 702 B9R1.33 FCSc1cscc1Br 62a_100015361967_100010143727 [0,1,0,0,0,0|2,0,0]=3 703 B9R1.33 [13CH3]NCc1ccsc1Br 2230a_100000727803_200025704644 [0,1,0,0,0,0|2,0,0]=3 704 B9R1.33 [13CH3]NCc1ccsc1Br 34a_100000727803_200025704644 [0,1,0,0,0,0|2,0,0]=3 705 B9R1.33 [13CH3]OCc1ccsc1Br 34a_100009816922_200025704644 [0,1,0,0,0,0|2,0,0]=3 706 B9R1.33 [13CH3]OCc1ccsc1Br 7a_100009816922_200025704644 [0,1,0,0,0,0|2,0,0]=3 707 B9R1.33 [13CH3]OCc1cscc1Br 34a_100000724555_200025704644 [0,1,0,0,0,0|2,0,0]=3 708 B9R1.33 [13CH3]SCc1ccsc1Br 62a_100009814289_200025704644 [0,1,0,0,0,0|2,0,0]=3 709 B9R1.33 [13CH3]SCc1ccsc1Br 62a_200025704644_100009814289 [0,1,0,0,0,0|2,0,0]=3 710 B9R1.33 [13CH3]SCc1ccsc1Cl 62a_100010167017_200025704644 [0,1,0,0,0,0|2,0,0]=3 711 B9R1.33 [13CH3]SCc1ccsc1Cl 62a_200025704644_100010167017 [0,1,0,0,0,0|2,0,0]=3 712 B7R0.1 C=CCCOCCN 34a_100000210304_100000754431 [0,0,1,0,0,0|2,0,1]=4 713 B7R0.1 C=CCOCCCN 34a_100000182051_100015514636 [0,0,1,0,0,0|2,0,1]=4 714 B7R0.7 CC=CC(=O)CCC 1458a_100000210699_100000210303 [0,0,1,0,0,0|3,0,0]=4 715 B7R0.7 CC=CC(=O)CCF 1458a_100000210699_100011217306 [0,0,1,0,0,0|3,0,0]=4 716 B7R0.7 CC=CC(=O)CCO 1458a_100000210699_100000211926 [0,0,1,0,0,0|3,0,0]=4 717 B7R0.7 CCCC(=O)C=CBr 1458a_100016273825_100000210303 [0,0,1,0,0,0|3,0,0]=4 718 B7R0.7 CCCC(=O)C=CCl 1458a_200016279998_100000210303 [0,0,1,0,0,0|3,0,0]=4 719 B7R0.7 CCCC(=O)C=CI 1458a_100016256311_100000210303 [0,0,1,0,0,0|3,0,0]=4 720 B7R0.7 O=C(C=CBr)CCF 1458a_100016273825_100011217306 [0,0,1,0,0,0|3,0,0]=4 721 B7R0.7 O=C(C=CBr)CCO 1458a_100016273825_100000211926 [0,0,1,0,0,0|3,0,0]=4 722 B7R0.7 O=C(C=CCl)CCF 1458a_200016279998_100011217306 [0,0,1,0,0,0|3,0,0]=4 723 B7R0.7 O=C(C=CCl)CCO 1458a_200016279998_100000211926 [0,0,1,0,0,0|3,0,0]=4 724 B7R0.7 O=C(C=CI)CCF 1458a_100016256311_100011217306 [0,0,1,0,0,0|3,0,0]=4 725 B7R0.7 O=C(C=CI)CCO 1458a_100016256311_100000211926 [0,0,1,0,0,0|3,0,0]=4 726 B9R2.2 c1cc(co1)C2CC2 271570a_100011220607_100011215275 [0,0,0,1,0,0|1,1,0]=3 727 B9R2.2 c1cc(cs1)C2CC2 271570a_100011220607_100000738268 [0,0,0,1,0,0|1,0,0]=2 728 B9R2.2 c1cc(n[nH]1)C2CC2 271570a_100011220607_100000062575 [0,0,0,1,0,0|3,0,0]=4 729 B9R2.2 c1cc(ns1)C2CC2 271570a_100011220607_100009818082 [0,0,0,1,0,0|2,0,0]=3 730 B9R2.2 c1coc(c1)C2CC2 271570a_100011220607_100009814098 [0,0,0,1,0,0|3,0,0]=4 731 B9R2.2 c1csc(c1)C2CC2 271570a_100011220607_100011215356 [0,0,0,1,0,0|3,0,0]=4 732 B9R2.2 c1n[nH]cc1C2CC2 271570a_100011220607_100000238712 [0,0,0,1,0,0|3,0,0]=4 733 B9R2.2 c1nc(c[nH]1)C2CC2 271570a_100011220607_100000756875 [0,0,0,1,0,0|3,0,0]=4 734 B9R2.2 c1nc(cs1)C2CC2 271570a_100011220607_100000751502 [0,0,0,1,0,0|2,0,0]=3 735 B9R2.2 c1ncc(o1)C2CC2 271570a_100011220607_100020591547 [0,0,0,1,0,0|3,0,0]=4 736 B9R2.2 c1ncc(s1)C2CC2 271570a_100011220607_100011934649 [0,0,0,1,0,0|3,0,0]=4 737 B9R2.2 c1nocc1C2CC2 271570a_100011220607_100009815712 [0,0,0,1,0,0|2,1,0]=4 738 B9R2.2 c1nscc1C2CC2 271570a_100011220607_100009815736 [0,0,0,1,0,0|2,0,0]=3 739 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [0,0,0,0,0,1|3,0,0]=4 740 B9R1.8 CCNc1ccncn1 27a_100015525214_100000703185 [0,0,0,0,0,1|3,0,0]=4 741 B9R1.8 CCNc1cnccn1 27a_100015525214_100000211759 [0,0,0,0,0,1|3,0,0]=4 742 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [0,0,0,0,0,1|3,0,0]=4 743 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [0,0,0,0,0,1|3,0,0]=4 744 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [0,0,0,0,0,1|3,0,0]=4 745 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [0,0,0,0,0,1|3,0,0]=4 746 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [0,0,0,0,0,1|3,0,0]=4 747 B9R1.8 CCOc1ccnnc1 34a_100015204005_100000210202 [0,0,0,0,0,1|3,0,0]=4 748 B9R1.8 CCOc1cncnc1 7a_100000754086_100000210202 [0,0,0,0,0,1|3,0,0]=4 749 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [0,0,0,0,0,1|3,0,0]=4 750 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [0,0,0,0,0,1|3,0,0]=4 751 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [0,0,0,0,0,1|3,0,0]=4 752 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [0,0,0,0,0,1|3,0,0]=4 753 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [0,0,0,0,0,1|3,0,0]=4 754 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [0,0,0,0,0,1|3,0,0]=4 755 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [0,0,0,0,0,1|3,0,0]=4 756 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [0,0,0,0,0,1|3,0,0]=4 757 B9R1.8 CCSc1ccncn1 62a_100000210202_100000703185 [0,0,0,0,0,1|3,0,0]=4 758 B9R1.8 CCSc1ccncn1 62a_100000703185_100000210202 [0,0,0,0,0,1|3,0,0]=4 759 B9R1.8 CCSc1ccnnc1 62a_100000210202_100000732662 [0,0,0,0,0,1|3,0,0]=4 760 B9R1.8 CCSc1ccnnc1 62a_100000732662_100000210202 [0,0,0,0,0,1|3,0,0]=4 761 B9R1.8 CCSc1cnccn1 62a_100000210202_100000211759 [0,0,0,0,0,1|3,0,0]=4 762 B9R1.8 CCSc1cnccn1 62a_100000211759_100000210202 [0,0,0,0,0,1|3,0,0]=4 763 B9R1.8 CCSc1cncnc1 62a_100000210202_100011206942 [0,0,0,0,0,1|3,0,0]=4 764 B9R1.8 CCSc1cncnc1 62a_100011206942_100000210202 [0,0,0,0,0,1|3,0,0]=4 765 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [0,0,0,0,0,1|3,0,0]=4 766 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [0,0,0,0,0,1|3,0,0]=4 767 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [0,0,0,0,0,1|3,0,0]=4 768 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [0,0,0,0,0,1|3,0,0]=4 769 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [0,0,0,0,0,1|3,0,0]=4 770 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [0,0,0,0,0,1|3,0,0]=4 771 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [0,0,0,0,0,1|3,0,0]=4 772 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [0,0,0,0,0,1|3,0,0]=4 773 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [0,0,0,0,0,1|3,0,0]=4 774 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [0,0,0,0,0,1|3,0,0]=4 775 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [0,0,0,0,0,1|3,0,0]=4 776 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [0,0,0,0,0,1|3,0,0]=4 777 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [0,0,0,0,0,1|3,0,0]=4 778 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [0,0,0,0,0,1|3,0,0]=4 779 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [0,0,0,0,0,1|3,0,0]=4 780 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [0,0,0,0,0,1|3,0,0]=4 781 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [0,0,0,0,0,1|3,0,0]=4 782 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [0,0,0,0,0,1|3,0,0]=4 783 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [0,0,0,0,0,1|3,0,0]=4 784 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [0,0,0,0,0,1|3,0,0]=4 785 B9R1.8 CNCc1ccnnc1 270004a_106832991635_100011934578 [0,0,0,0,0,1|3,0,0]=4 786 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [0,0,0,0,0,1|3,0,0]=4 787 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [0,0,0,0,0,1|3,0,0]=4 788 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [0,0,0,0,0,1|3,0,0]=4 789 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [0,0,0,0,0,1|3,0,0]=4 790 B9R1.8 CNCc1cncnc1 2230a_100011243677_200000210301 [0,0,0,0,0,1|3,0,0]=4 791 B9R1.8 CNCc1cncnc1 2230a_106832991635_100015196519 [0,0,0,0,0,1|3,0,0]=4 792 B9R1.8 CNCc1cncnc1 270004a_106832991635_100000749868 [0,0,0,0,0,1|3,0,0]=4 793 B9R1.8 CNCc1cncnc1 34a_100102657272_100015196519 [0,0,0,0,0,1|3,0,0]=4 794 B9R1.8 CNCc1cncnc1 7a_106832991635_100015196519 [0,0,0,0,0,1|3,0,0]=4 795 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [0,0,0,0,0,1|3,0,0]=4 796 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [0,0,0,0,0,1|3,0,0]=4 797 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [0,0,0,0,0,1|3,0,0]=4 798 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [0,0,0,0,0,1|3,0,0]=4 799 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [0,0,0,0,0,1|3,0,0]=4 800 B9R1.8 COCc1cnccn1 34a_100138415774_100016995436 [0,0,0,0,0,1|3,0,0]=4 801 B9R1.8 COCc1cncnc1 34a_100138415774_100015196519 [0,0,0,0,0,1|3,0,0]=4 802 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [0,0,0,0,0,1|3,0,0]=4 803 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [0,0,0,0,0,1|3,0,0]=4 804 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [0,0,0,0,0,1|3,0,0]=4 805 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [0,0,0,0,0,1|3,0,0]=4 806 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [0,0,0,0,0,1|3,0,0]=4 807 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [0,0,0,0,0,1|3,0,0]=4 808 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [0,0,0,0,0,1|3,0,0]=4 809 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [0,0,0,0,0,1|3,0,0]=4 810 B9R1.8 CSCc1cnccn1 62a_100016995436_200000210301 [0,0,0,0,0,1|3,0,0]=4 811 B9R1.8 CSCc1cnccn1 62a_200000210301_100016995436 [0,0,0,0,0,1|3,0,0]=4 812 B9R1.8 CSCc1cncnc1 62a_100015196519_200000210301 [0,0,0,0,0,1|3,0,0]=4 813 B9R1.8 CSCc1cncnc1 62a_200000210301_100015196519 [0,0,0,0,0,1|3,0,0]=4 814 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [0,0,0,0,0,1|3,0,0]=4 815 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [0,0,0,0,0,1|3,0,0]=4 816 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [0,0,0,0,0,1|3,0,0]=4 817 B9R1.8 FCOc1cccnc1 34a_100000210849_100015361967 [0,0,0,0,0,1|3,0,0]=4 818 B9R1.8 FCOc1cccnc1 7a_100000210849_100015361967 [0,0,0,0,0,1|3,0,0]=4 819 B9R1.8 FCOc1ccncc1 34a_100000212176_100015361967 [0,0,0,0,0,1|3,0,0]=4 820 B9R1.8 FCOc1ccnnc1 34a_100015204005_100015361967 [0,0,0,0,0,1|3,0,0]=4 821 B9R1.8 FCOc1cncnc1 7a_100000754086_100015361967 [0,0,0,0,0,1|3,0,0]=4 822 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [0,0,0,0,0,1|3,0,0]=4 823 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [0,0,0,0,0,1|3,0,0]=4 824 B9R1.8 FCSc1ccccn1 62a_100011216584_100015361967 [0,0,0,0,0,1|3,0,0]=4 825 B9R1.8 FCSc1ccccn1 62a_100015361967_100011216584 [0,0,0,0,0,1|3,0,0]=4 826 B9R1.8 FCSc1cccnc1 62a_100000210063_100015361967 [0,0,0,0,0,1|3,0,0]=4 827 B9R1.8 FCSc1cccnc1 62a_100015361967_100000210063 [0,0,0,0,0,1|3,0,0]=4 828 B9R1.8 FCSc1ccncc1 62a_100000728582_100015361967 [0,0,0,0,0,1|3,0,0]=4 829 B9R1.8 FCSc1ccncc1 62a_100015361967_100000728582 [0,0,0,0,0,1|3,0,0]=4 830 B9R1.8 FCSc1ccncn1 62a_100000703185_100015361967 [0,0,0,0,0,1|3,0,0]=4 831 B9R1.8 FCSc1ccncn1 62a_100015361967_100000703185 [0,0,0,0,0,1|3,0,0]=4 832 B9R1.8 FCSc1ccnnc1 62a_100000732662_100015361967 [0,0,0,0,0,1|3,0,0]=4 833 B9R1.8 FCSc1ccnnc1 62a_100015361967_100000732662 [0,0,0,0,0,1|3,0,0]=4 834 B9R1.8 FCSc1cnccn1 62a_100000211759_100015361967 [0,0,0,0,0,1|3,0,0]=4 835 B9R1.8 FCSc1cnccn1 62a_100015361967_100000211759 [0,0,0,0,0,1|3,0,0]=4 836 B9R1.8 FCSc1cncnc1 62a_100011206942_100015361967 [0,0,0,0,0,1|3,0,0]=4 837 B9R1.8 FCSc1cncnc1 62a_100015361967_100011206942 [0,0,0,0,0,1|3,0,0]=4 838 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [0,0,0,0,0,1|3,0,0]=4 839 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [0,0,0,0,0,1|3,0,0]=4 840 B9R1.8 [13CH3]NCc1cncnc1 2230a_100011243677_200025704644 [0,0,0,0,0,1|3,0,0]=4 841 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [0,0,0,0,0,1|3,0,0]=4 842 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [0,0,0,0,0,1|3,0,0]=4 843 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [0,0,0,0,0,1|3,0,0]=4 844 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [0,0,0,0,0,1|3,0,0]=4 845 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [0,0,0,0,0,1|3,0,0]=4 846 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [0,0,0,0,0,1|3,0,0]=4 847 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [0,0,0,0,0,1|3,0,0]=4 848 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [0,0,0,0,0,1|3,0,0]=4 849 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [0,0,0,0,0,1|3,0,0]=4 850 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [0,0,0,0,0,1|3,0,0]=4 851 B9R1.8 [13CH3]SCc1cnccn1 62a_100016995436_200025704644 [0,0,0,0,0,1|3,0,0]=4 852 B9R1.8 [13CH3]SCc1cnccn1 62a_200025704644_100016995436 [0,0,0,0,0,1|3,0,0]=4 853 B9R1.8 [13CH3]SCc1cncnc1 62a_100015196519_200025704644 [0,0,0,0,0,1|3,0,0]=4 854 B9R1.8 [13CH3]SCc1cncnc1 62a_200025704644_100015196519 [0,0,0,0,0,1|3,0,0]=4 855 B6R0.6 C=CCOCCN 34a_100000210304_100015514636 [1,0,1,0,0,0|1,0,1]=4 856 B6R0.6 CC/C=C\CSC 62a_100103147603_200000210301 [1,0,1,0,0,0|0,0,2]=4 857 B6R0.6 CC/C=C\CSC 62a_200000210301_100103147603 [1,0,1,0,0,0|0,0,2]=4 858 B6R0.6 CC/C=C\CS[13CH3] 62a_100103147603_200025704644 [1,0,1,0,0,0|0,0,2]=4 859 B6R0.6 CC/C=C\CS[13CH3] 62a_200025704644_100103147603 [1,0,1,0,0,0|0,0,2]=4 860 B6R0.1 C=CC(=O)CCC 1458a_100000185746_100000210303 [1,0,1,0,0,0|1,1,0]=4 861 B6R0.1 C=CC(=O)CCF 1458a_100000185746_100011217306 [1,0,1,0,0,0|1,1,0]=4 862 B6R0.1 C=CC(=O)CCO 1458a_100000185746_100000211926 [1,0,1,0,0,0|1,1,0]=4 863 B6R0.1 CC=CC(=O)CC 1458a_100000210699_100000210202 [1,0,1,0,0,0|2,0,0]=4 864 B6R0.1 CCC(=O)C=CBr 1458a_100016273825_100000210202 [1,0,1,0,0,0|2,0,0]=4 865 B6R0.1 CCC(=O)C=CCl 1458a_200016279998_100000210202 [1,0,1,0,0,0|2,0,0]=4 866 B6R0.1 CCC(=O)C=CI 1458a_100016256311_100000210202 [1,0,1,0,0,0|2,0,0]=4 867 B6R1.2 Oc1ccoc1 271570a_203496583355_100011215275 [2,0,0,0,0,0|1,1,0]=4 868 B6R1.2 Oc1ccsc1 271570a_203496583355_100000738268 [2,0,0,0,0,0|1,0,0]=3 869 B6R1.2 Oc1ccsn1 271570a_203496583355_100009818082 [2,0,0,0,0,0|2,0,0]=4 870 B6R1.2 Oc1cnsc1 271570a_203496583355_100009815736 [2,0,0,0,0,0|2,0,0]=4 871 B6R1.2 Oc1cscn1 271570a_203496583355_100000751502 [2,0,0,0,0,0|2,0,0]=4 872 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [0,1,1,0,0,0|2,0,0]=4 873 B8R0.1 C=CC=CC(=O)CCF 1458a_100016291481_100011217306 [0,1,1,0,0,0|2,0,0]=4 874 B8R0.1 C=CC=CC(=O)CCO 1458a_100016291481_100000211926 [0,1,1,0,0,0|2,0,0]=4 875 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,1,0,0,0,0|0,0,2]=4 876 B8R1.1 CCc1cc(cs1)O 271570a_203496583355_100009846239 [1,1,0,0,0,0|2,0,0]=4 877 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,1,0,0,0,0|2,0,0]=4 878 B8R1.1 CCn1cnc(c1)O 271570a_203496583355_100010368372 [1,1,0,0,0,0|2,0,0]=4 879 B8R1.1 CSc1csc(c1)C 62a_100000759034_200000210301 [1,1,0,0,0,0|1,0,0]=3 880 B8R1.1 CSc1csc(c1)C 62a_200000210301_100000759034 [1,1,0,0,0,0|1,0,0]=3 881 B8R1.1 CSc1csc(n1)C 62a_100011934587_200000210301 [1,1,0,0,0,0|2,0,0]=4 882 B8R1.1 CSc1csc(n1)C 62a_200000210301_100011934587 [1,1,0,0,0,0|2,0,0]=4 883 B8R1.1 CSc1csc(n1)N 62a_100011998049_200000210301 [1,1,0,0,0,0|2,0,0]=4 884 B8R1.1 CSc1csc(n1)N 62a_200000210301_100011998049 [1,1,0,0,0,0|2,0,0]=4 885 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_100000759034_200025704644 [1,1,0,0,0,0|1,0,0]=3 886 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_200025704644_100000759034 [1,1,0,0,0,0|1,0,0]=3 887 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_100011934587_200025704644 [1,1,0,0,0,0|2,0,0]=4 888 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_200025704644_100011934587 [1,1,0,0,0,0|2,0,0]=4 889 B8R1.1 NCc1ccc(o1)O 271570a_203496583355_100000708654 [1,1,0,0,0,0|2,0,0]=4 890 B8R1.1 NCc1ccc(s1)O 271570a_203496583355_100000737305 [1,1,0,0,0,0|2,0,0]=4 891 B8R1.1 NCc1cnc(s1)O 271570a_203496583355_100000726991 [1,1,0,0,0,0|2,0,0]=4 892 B8R1.1 O=Cc1csc(c1)O 271570a_203496583355_100000737087 [1,1,0,0,0,0|1,0,1]=4 893 B8R1.1 OCc1csc(n1)O 271570a_203496583355_100009816749 [1,1,0,0,0,0|2,0,0]=4 894 B8R1.1 [13CH3]Sc1csc(n1)N 62a_100011998049_200025704644 [1,1,0,0,0,0|2,0,0]=4 895 B8R1.1 [13CH3]Sc1csc(n1)N 62a_200025704644_100011998049 [1,1,0,0,0,0|2,0,0]=4 896 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,1,0,0,0,0|0,1,1]=4 897 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,1,0,0,0,0|0,0,1]=3 898 B8R1.7 C=C(C)c1ccsn1 271570a_100000694244_100009818082 [1,1,0,0,0,0|1,0,1]=4 899 B8R1.7 C=C(C)c1cnsc1 271570a_100000694244_100009815736 [1,1,0,0,0,0|1,0,1]=4 900 B8R1.7 C=C(C)c1cscn1 271570a_100000694244_100000751502 [1,1,0,0,0,0|1,0,1]=4 901 B8R1.11 C=Cc1ccsc1C 271570a_100011290941_100000684487 [1,1,0,0,0,0|0,0,2]=4 902 B8R1.11 C=Cc1cscc1Br 271570a_100011290941_100010143727 [1,1,0,0,0,0|0,0,2]=4 903 B8R1.11 C=Cc1cscc1C 271570a_100011290941_100000759966 [1,1,0,0,0,0|0,0,2]=4 904 B8R1.11 CCc1ccsc1O 271570a_203496583355_200009875468 [1,1,0,0,0,0|0,0,0]=2 905 B8R1.11 CCc1cscc1O 271570a_203496583355_100011068457 [1,1,0,0,0,0|0,0,0]=2 906 B8R1.11 CCn1ccnc1O 271570a_203496583355_100011617267 [1,1,0,0,0,0|2,0,0]=4 907 B8R1.11 CSc1ccsc1C 62a_100000684487_200000210301 [1,1,0,0,0,0|1,0,0]=3 908 B8R1.11 CSc1ccsc1C 62a_200000210301_100000684487 [1,1,0,0,0,0|1,0,0]=3 909 B8R1.11 CSc1cscc1Br 62a_100010143727_200000210301 [1,1,0,0,0,0|1,0,0]=3 910 B8R1.11 CSc1cscc1Br 62a_200000210301_100010143727 [1,1,0,0,0,0|1,0,0]=3 911 B8R1.11 CSc1cscc1C 62a_100000759966_200000210301 [1,1,0,0,0,0|1,0,0]=3 912 B8R1.11 CSc1cscc1C 62a_200000210301_100000759966 [1,1,0,0,0,0|1,0,0]=3 913 B8R1.11 CSc1ncsc1C 62a_100000732656_200000210301 [1,1,0,0,0,0|2,0,0]=4 914 B8R1.11 CSc1ncsc1C 62a_200000210301_100000732656 [1,1,0,0,0,0|2,0,0]=4 915 B8R1.11 Cc1cscc1S[13CH3] 62a_100000759966_200025704644 [1,1,0,0,0,0|1,0,0]=3 916 B8R1.11 Cc1cscc1S[13CH3] 62a_200025704644_100000759966 [1,1,0,0,0,0|1,0,0]=3 917 B8R1.11 Cc1sccc1S[13CH3] 62a_100000684487_200025704644 [1,1,0,0,0,0|1,0,0]=3 918 B8R1.11 Cc1sccc1S[13CH3] 62a_200025704644_100000684487 [1,1,0,0,0,0|1,0,0]=3 919 B8R1.11 Cc1scnc1S[13CH3] 62a_100000732656_200025704644 [1,1,0,0,0,0|2,0,0]=4 920 B8R1.11 Cc1scnc1S[13CH3] 62a_200025704644_100000732656 [1,1,0,0,0,0|2,0,0]=4 921 B8R1.11 N#Cc1ccsc1O 271570a_203496583355_100009817073 [1,1,0,0,0,0|0,0,2]=4 922 B8R1.11 N#Cc1cscc1O 271570a_203496583355_100011934119 [1,1,0,0,0,0|0,0,2]=4 923 B8R1.11 NCc1ccsc1O 271570a_203496583355_100000727803 [1,1,0,0,0,0|0,0,0]=2 924 B8R1.11 O=Cc1ccsc1O 271570a_203496583355_100009816921 [1,1,0,0,0,0|1,0,1]=4 925 B8R1.11 O=Cc1cscc1O 271570a_203496583355_100000685484 [1,1,0,0,0,0|1,0,1]=4 926 B8R1.11 OCc1ccsc1O 271570a_203496583355_100009816922 [1,1,0,0,0,0|1,0,0]=3 927 B8R1.11 OCc1cscc1O 271570a_203496583355_100000724555 [1,1,0,0,0,0|1,0,0]=3 928 B8R1.11 [13CH3]Sc1cscc1Br 62a_100010143727_200025704644 [1,1,0,0,0,0|1,0,0]=3 929 B8R1.11 [13CH3]Sc1cscc1Br 62a_200025704644_100010143727 [1,1,0,0,0,0|1,0,0]=3 930 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [0,1,0,0,0,1|2,0,0]=4 931 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [0,1,0,0,0,1|2,0,0]=4 932 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [0,1,0,0,0,1|1,0,0]=3 933 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [0,1,0,0,0,1|2,0,0]=4 934 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [0,1,0,0,0,1|2,0,0]=4 935 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [0,1,0,0,0,1|2,0,0]=4 936 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [0,1,0,0,0,1|2,0,0]=4 937 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [0,1,0,0,0,1|2,0,0]=4 938 B10R1.4 CCCc1ncncc1O 271570a_203496583355_100009816987 [0,1,0,0,0,1|2,0,0]=4 939 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [0,1,0,0,0,1|1,0,0]=3 940 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [0,1,0,0,0,1|2,0,0]=4 941 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [0,1,0,0,0,1|2,0,0]=4 942 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [0,1,0,0,0,1|2,0,0]=4 943 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [0,1,0,0,0,1|1,0,0]=3 944 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [0,1,0,0,0,1|2,0,0]=4 945 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [0,1,0,0,0,1|2,0,0]=4 946 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [0,1,0,0,0,1|2,0,0]=4 947 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [0,1,0,0,0,1|2,0,0]=4 948 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [0,1,0,0,0,1|2,0,0]=4 949 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [0,1,0,0,0,1|2,0,0]=4 950 B10R1.17 CCCCc1ccncc1 271570a_100020621405_100000035832 [0,1,0,0,0,1|2,0,0]=4 951 B10R1.17 CCCCc1ccncn1 271570a_100020621405_100000703185 [0,1,0,0,0,1|2,0,0]=4 952 B10R1.17 CCCCc1ccnnc1 271570a_100020621405_100000732662 [0,1,0,0,0,1|2,0,0]=4 953 B10R1.17 CCCCc1cnccn1 271570a_100020621405_100000758340 [0,1,0,0,0,1|2,0,0]=4 954 B10R1.17 CCCCc1cncnc1 271570a_100020621405_100011206942 [0,1,0,0,0,1|2,0,0]=4 955 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [0,1,0,0,0,1|2,0,0]=4 956 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [0,1,0,0,0,1|2,0,0]=4 957 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [0,1,0,0,0,1|2,0,0]=4 958 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [0,1,0,0,0,1|2,0,0]=4 959 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [0,1,0,0,0,1|2,0,0]=4 960 B10R1.17 CCCOc1ccncc1 34a_100000212176_100000210303 [0,1,0,0,0,1|2,0,0]=4 961 B10R1.17 CCCOc1ccnnc1 34a_100015204005_100000210303 [0,1,0,0,0,1|2,0,0]=4 962 B10R1.17 CCCOc1cncnc1 7a_100000754086_100000210303 [0,1,0,0,0,1|2,0,0]=4 963 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [0,1,0,0,0,1|2,0,0]=4 964 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [0,1,0,0,0,1|2,0,0]=4 965 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [0,1,0,0,0,1|2,0,0]=4 966 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [0,1,0,0,0,1|2,0,0]=4 967 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [0,1,0,0,0,1|2,0,0]=4 968 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [0,1,0,0,0,1|2,0,0]=4 969 B10R1.17 CCCSc1ccncc1 62a_100000210303_100000728582 [0,1,0,0,0,1|2,0,0]=4 970 B10R1.17 CCCSc1ccncc1 62a_100000728582_100000210303 [0,1,0,0,0,1|2,0,0]=4 971 B10R1.17 CCCSc1ccncn1 62a_100000210303_100000703185 [0,1,0,0,0,1|2,0,0]=4 972 B10R1.17 CCCSc1ccncn1 62a_100000703185_100000210303 [0,1,0,0,0,1|2,0,0]=4 973 B10R1.17 CCCSc1ccnnc1 62a_100000210303_100000732662 [0,1,0,0,0,1|2,0,0]=4 974 B10R1.17 CCCSc1ccnnc1 62a_100000732662_100000210303 [0,1,0,0,0,1|2,0,0]=4 975 B10R1.17 CCCSc1cnccn1 62a_100000210303_100000211759 [0,1,0,0,0,1|2,0,0]=4 976 B10R1.17 CCCSc1cnccn1 62a_100000211759_100000210303 [0,1,0,0,0,1|2,0,0]=4 977 B10R1.17 CCCSc1cncnc1 62a_100000210303_100011206942 [0,1,0,0,0,1|2,0,0]=4 978 B10R1.17 CCCSc1cncnc1 62a_100011206942_100000210303 [0,1,0,0,0,1|2,0,0]=4 979 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [0,1,0,0,0,1|2,0,0]=4 980 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [0,1,0,0,0,1|2,0,0]=4 981 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [0,1,0,0,0,1|2,0,0]=4 982 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [0,1,0,0,0,1|2,0,0]=4 983 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [0,1,0,0,0,1|2,0,0]=4 984 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [0,1,0,0,0,1|2,0,0]=4 985 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [0,1,0,0,0,1|2,0,0]=4 986 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [0,1,0,0,0,1|2,0,0]=4 987 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [0,1,0,0,0,1|2,0,0]=4 988 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [0,1,0,0,0,1|2,0,0]=4 989 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [0,1,0,0,0,1|2,0,0]=4 990 B10R1.17 CCNCc1ccncc1 207a_100015525214_100000186114 [0,1,0,0,0,1|2,0,0]=4 991 B10R1.17 CCNCc1ccncc1 2230a_100015525214_100015193705 [0,1,0,0,0,1|2,0,0]=4 992 B10R1.17 CCNCc1ccnnc1 270004a_100015525214_100011934578 [0,1,0,0,0,1|2,0,0]=4 993 B10R1.17 CCNCc1cnccn1 2230a_100015525214_100016995436 [0,1,0,0,0,1|2,0,0]=4 994 B10R1.17 CCNCc1cnccn1 270004a_100015525214_100000749867 [0,1,0,0,0,1|2,0,0]=4 995 B10R1.17 CCNCc1cncnc1 2230a_100011243677_100000210202 [0,1,0,0,0,1|2,0,0]=4 996 B10R1.17 CCNCc1cncnc1 2230a_100015525214_100015196519 [0,1,0,0,0,1|2,0,0]=4 997 B10R1.17 CCNCc1cncnc1 270004a_100015525214_100000749868 [0,1,0,0,0,1|2,0,0]=4 998 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [0,1,0,0,0,1|2,0,0]=4 999 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [0,1,0,0,0,1|2,0,0]=4 1000 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [0,1,0,0,0,1|2,0,0]=4 1001 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [0,1,0,0,0,1|2,0,0]=4 1002 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [0,1,0,0,0,1|2,0,0]=4 1003 B10R1.17 CCOCc1cnccn1 34a_100121572206_100016995436 [0,1,0,0,0,1|2,0,0]=4 1004 B10R1.17 CCOCc1cncnc1 34a_100121572206_100015196519 [0,1,0,0,0,1|2,0,0]=4 1005 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [0,1,0,0,0,1|2,0,0]=4 1006 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [0,1,0,0,0,1|2,0,0]=4 1007 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [0,1,0,0,0,1|2,0,0]=4 1008 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [0,1,0,0,0,1|2,0,0]=4 1009 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [0,1,0,0,0,1|2,0,0]=4 1010 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [0,1,0,0,0,1|2,0,0]=4 1011 B10R1.17 CCSCc1ccncc1 62a_100000210202_100015193705 [0,1,0,0,0,1|2,0,0]=4 1012 B10R1.17 CCSCc1ccncc1 62a_100015193705_100000210202 [0,1,0,0,0,1|2,0,0]=4 1013 B10R1.17 CCSCc1cnccn1 62a_100000210202_100016995436 [0,1,0,0,0,1|2,0,0]=4 1014 B10R1.17 CCSCc1cnccn1 62a_100016995436_100000210202 [0,1,0,0,0,1|2,0,0]=4 1015 B10R1.17 CCSCc1cncnc1 62a_100000210202_100015196519 [0,1,0,0,0,1|2,0,0]=4 1016 B10R1.17 CCSCc1cncnc1 62a_100015196519_100000210202 [0,1,0,0,0,1|2,0,0]=4 1017 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [0,1,0,0,0,1|1,0,0]=3 1018 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [0,1,0,0,0,1|1,0,0]=3 1019 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [0,1,0,0,0,1|1,0,0]=3 1020 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [0,1,0,0,0,1|1,0,0]=3 1021 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [0,1,0,0,0,1|1,0,0]=3 1022 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [0,1,0,0,0,1|1,0,0]=3 1023 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [0,1,0,0,0,1|1,0,0]=3 1024 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [0,1,0,0,0,1|1,0,0]=3 1025 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [0,1,0,0,0,1|1,0,0]=3 1026 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [0,1,0,0,0,1|1,0,0]=3 1027 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [0,1,0,0,0,1|1,0,0]=3 1028 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [0,1,0,0,0,1|1,0,0]=3 1029 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [0,1,0,0,0,1|2,0,0]=4 1030 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [0,1,0,0,0,1|2,0,0]=4 1031 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [0,1,0,0,0,1|2,0,0]=4 1032 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [0,1,0,0,0,1|2,0,0]=4 1033 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [0,1,0,0,0,1|2,0,0]=4 1034 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [0,1,0,0,0,1|2,0,0]=4 1035 B10R1.17 COCCc1ccncc1 34a_100011216225_200000210301 [0,1,0,0,0,1|2,0,0]=4 1036 B10R1.17 COCCc1cnccn1 34a_100011349526_200000210301 [0,1,0,0,0,1|2,0,0]=4 1037 B10R1.17 COCCc1cncnc1 34a_100011709255_200000210301 [0,1,0,0,0,1|2,0,0]=4 1038 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [0,1,0,0,0,1|2,0,0]=4 1039 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [0,1,0,0,0,1|2,0,0]=4 1040 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [0,1,0,0,0,1|2,0,0]=4 1041 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [0,1,0,0,0,1|2,0,0]=4 1042 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [0,1,0,0,0,1|2,0,0]=4 1043 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [0,1,0,0,0,1|2,0,0]=4 1044 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [0,1,0,0,0,1|2,0,0]=4 1045 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [0,1,0,0,0,1|2,0,0]=4 1046 B10R1.17 FCCNc1ccccc1 34a_100000106764_100011217306 [0,1,0,0,0,1|2,0,0]=4 1047 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [0,1,0,0,0,1|2,0,0]=4 1048 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [0,1,0,0,0,1|2,0,0]=4 1049 B10R1.17 FCCOc1cccnc1 34a_100000210849_100011217306 [0,1,0,0,0,1|2,0,0]=4 1050 B10R1.17 FCCOc1cccnc1 7a_100000210849_100011217306 [0,1,0,0,0,1|2,0,0]=4 1051 B10R1.17 FCCOc1ccncc1 34a_100000212176_100011217306 [0,1,0,0,0,1|2,0,0]=4 1052 B10R1.17 FCCOc1ccnnc1 34a_100015204005_100011217306 [0,1,0,0,0,1|2,0,0]=4 1053 B10R1.17 FCCOc1cncnc1 7a_100000754086_100011217306 [0,1,0,0,0,1|2,0,0]=4 1054 B10R1.17 FCCSc1ccccc1 62a_100000719477_100011217306 [0,1,0,0,0,1|2,0,0]=4 1055 B10R1.17 FCCSc1ccccc1 62a_100011217306_100000041952 [0,1,0,0,0,1|2,0,0]=4 1056 B10R1.17 FCCSc1ccccn1 62a_100011216584_100011217306 [0,1,0,0,0,1|2,0,0]=4 1057 B10R1.17 FCCSc1ccccn1 62a_100011217306_100011216584 [0,1,0,0,0,1|2,0,0]=4 1058 B10R1.17 FCCSc1cccnc1 62a_100000210063_100011217306 [0,1,0,0,0,1|2,0,0]=4 1059 B10R1.17 FCCSc1cccnc1 62a_100011217306_100000210063 [0,1,0,0,0,1|2,0,0]=4 1060 B10R1.17 FCCSc1ccncc1 62a_100000728582_100011217306 [0,1,0,0,0,1|2,0,0]=4 1061 B10R1.17 FCCSc1ccncc1 62a_100011217306_100000728582 [0,1,0,0,0,1|2,0,0]=4 1062 B10R1.17 FCCSc1ccncn1 62a_100000703185_100011217306 [0,1,0,0,0,1|2,0,0]=4 1063 B10R1.17 FCCSc1ccncn1 62a_100011217306_100000703185 [0,1,0,0,0,1|2,0,0]=4 1064 B10R1.17 FCCSc1ccnnc1 62a_100000732662_100011217306 [0,1,0,0,0,1|2,0,0]=4 1065 B10R1.17 FCCSc1ccnnc1 62a_100011217306_100000732662 [0,1,0,0,0,1|2,0,0]=4 1066 B10R1.17 FCCSc1cnccn1 62a_100000211759_100011217306 [0,1,0,0,0,1|2,0,0]=4 1067 B10R1.17 FCCSc1cnccn1 62a_100011217306_100000211759 [0,1,0,0,0,1|2,0,0]=4 1068 B10R1.17 FCCSc1cncnc1 62a_100011206942_100011217306 [0,1,0,0,0,1|2,0,0]=4 1069 B10R1.17 FCCSc1cncnc1 62a_100011217306_100011206942 [0,1,0,0,0,1|2,0,0]=4 1070 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [0,1,0,0,0,1|2,0,0]=4 1071 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [0,1,0,0,0,1|2,0,0]=4 1072 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [0,1,0,0,0,1|2,0,0]=4 1073 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [0,1,0,0,0,1|2,0,0]=4 1074 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [0,1,0,0,0,1|2,0,0]=4 1075 B10R1.17 FCSCc1ccccn1 62a_100000721315_100015361967 [0,1,0,0,0,1|2,0,0]=4 1076 B10R1.17 FCSCc1ccccn1 62a_100015361967_100000721315 [0,1,0,0,0,1|2,0,0]=4 1077 B10R1.17 FCSCc1cccnc1 62a_100000741622_100015361967 [0,1,0,0,0,1|2,0,0]=4 1078 B10R1.17 FCSCc1cccnc1 62a_100015361967_100000741622 [0,1,0,0,0,1|2,0,0]=4 1079 B10R1.17 FCSCc1ccncc1 62a_100015193705_100015361967 [0,1,0,0,0,1|2,0,0]=4 1080 B10R1.17 FCSCc1ccncc1 62a_100015361967_100015193705 [0,1,0,0,0,1|2,0,0]=4 1081 B10R1.17 FCSCc1cnccn1 62a_100015361967_100016995436 [0,1,0,0,0,1|2,0,0]=4 1082 B10R1.17 FCSCc1cnccn1 62a_100016995436_100015361967 [0,1,0,0,0,1|2,0,0]=4 1083 B10R1.17 FCSCc1cncnc1 62a_100015196519_100015361967 [0,1,0,0,0,1|2,0,0]=4 1084 B10R1.17 FCSCc1cncnc1 62a_100015361967_100015196519 [0,1,0,0,0,1|2,0,0]=4 1085 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [0,1,0,0,0,1|2,0,0]=4 1086 B10R1.17 OCCNc1ccncn1 27a_100000210304_100000703185 [0,1,0,0,0,1|2,0,0]=4 1087 B10R1.17 OCCNc1cnccn1 27a_100000210304_100000211759 [0,1,0,0,0,1|2,0,0]=4 1088 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [0,1,0,0,0,1|2,0,0]=4 1089 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [0,1,0,0,0,1|2,0,0]=4 1090 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [0,1,0,0,0,1|2,0,0]=4 1091 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [0,1,0,0,0,1|2,0,0]=4 1092 B10R1.17 OCCOc1ccncc1 34a_100000212176_100000211926 [0,1,0,0,0,1|2,0,0]=4 1093 B10R1.17 OCCOc1ccnnc1 34a_100015204005_100000211926 [0,1,0,0,0,1|2,0,0]=4 1094 B10R1.17 OCCOc1cncnc1 7a_100000754086_100000211926 [0,1,0,0,0,1|2,0,0]=4 1095 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [0,1,0,0,0,1|2,0,0]=4 1096 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [0,1,0,0,0,1|2,0,0]=4 1097 B10R1.17 OCCSc1ccccn1 62a_100000211926_100011216584 [0,1,0,0,0,1|2,0,0]=4 1098 B10R1.17 OCCSc1ccccn1 62a_100011216584_100000211926 [0,1,0,0,0,1|2,0,0]=4 1099 B10R1.17 OCCSc1cccnc1 62a_100000210063_100000211926 [0,1,0,0,0,1|2,0,0]=4 1100 B10R1.17 OCCSc1cccnc1 62a_100000211926_100000210063 [0,1,0,0,0,1|2,0,0]=4 1101 B10R1.17 OCCSc1ccncc1 62a_100000211926_100000728582 [0,1,0,0,0,1|2,0,0]=4 1102 B10R1.17 OCCSc1ccncc1 62a_100000728582_100000211926 [0,1,0,0,0,1|2,0,0]=4 1103 B10R1.17 OCCSc1ccncn1 62a_100000211926_100000703185 [0,1,0,0,0,1|2,0,0]=4 1104 B10R1.17 OCCSc1ccncn1 62a_100000703185_100000211926 [0,1,0,0,0,1|2,0,0]=4 1105 B10R1.17 OCCSc1ccnnc1 62a_100000211926_100000732662 [0,1,0,0,0,1|2,0,0]=4 1106 B10R1.17 OCCSc1ccnnc1 62a_100000732662_100000211926 [0,1,0,0,0,1|2,0,0]=4 1107 B10R1.17 OCCSc1cnccn1 62a_100000211759_100000211926 [0,1,0,0,0,1|2,0,0]=4 1108 B10R1.17 OCCSc1cnccn1 62a_100000211926_100000211759 [0,1,0,0,0,1|2,0,0]=4 1109 B10R1.17 OCCSc1cncnc1 62a_100000211926_100011206942 [0,1,0,0,0,1|2,0,0]=4 1110 B10R1.17 OCCSc1cncnc1 62a_100011206942_100000211926 [0,1,0,0,0,1|2,0,0]=4 1111 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [0,1,0,0,0,1|1,0,0]=3 1112 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [0,1,0,0,0,1|1,0,0]=3 1113 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [0,1,0,0,0,1|1,0,0]=3 1114 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [0,1,0,0,0,1|2,0,0]=4 1115 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [0,1,0,0,0,1|2,0,0]=4 1116 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [0,1,0,0,0,1|2,0,0]=4 1117 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [0,1,0,0,0,1|2,0,0]=4 1118 B10R1.17 [13CH3]OCCc1ccncc1 34a_100011216225_200025704644 [0,1,0,0,0,1|2,0,0]=4 1119 B10R1.17 [13CH3]OCCc1cnccn1 34a_100011349526_200025704644 [0,1,0,0,0,1|2,0,0]=4 1120 B10R1.17 [13CH3]OCCc1cncnc1 34a_100011709255_200025704644 [0,1,0,0,0,1|2,0,0]=4 1121 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [0,1,0,0,0,1|2,0,0]=4 1122 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [0,1,0,0,0,1|2,0,0]=4 1123 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [0,1,0,0,0,1|2,0,0]=4 1124 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [0,1,0,0,0,1|2,0,0]=4 1125 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [0,1,0,0,0,1|2,0,0]=4 1126 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [0,1,0,0,0,1|2,0,0]=4 1127 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [0,1,0,0,0,1|2,0,0]=4 1128 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [0,1,0,0,0,1|2,0,0]=4 1129 B10R1.14 CNC(C)c1csc(c1)Br 269862a_106832991636_200012344231 [0,2,0,0,0,0|2,0,0]=4 1130 B10R1.14 CNC(C)c1csc(c1)Cl 269862a_106832991636_100000074698 [0,2,0,0,0,0|2,0,0]=4 1131 B10R1.16 C#CCSc1csc(c1)C 62a_100000038162_100000759034 [0,2,0,0,0,0|1,0,1]=4 1132 B10R1.16 C=CCSc1csc(c1)C 62a_100000210623_100000759034 [0,2,0,0,0,0|1,0,1]=4 1133 B10R1.16 C=CCSc1csc(c1)C 62a_100000759034_100000210623 [0,2,0,0,0,0|1,0,1]=4 1134 B10R1.16 CCCCc1csc(c1)C 271570a_100020621405_100000759034 [0,2,0,0,0,0|1,0,0]=3 1135 B10R1.16 CCCCc1csc(n1)C 271570a_100020621405_100011934587 [0,2,0,0,0,0|2,0,0]=4 1136 B10R1.16 CCCCc1csc(n1)N 271570a_100020621405_100011998049 [0,2,0,0,0,0|2,0,0]=4 1137 B10R1.16 CCCSc1csc(c1)C 62a_100000210303_100000759034 [0,2,0,0,0,0|1,0,0]=3 1138 B10R1.16 CCCSc1csc(c1)C 62a_100000759034_100000210303 [0,2,0,0,0,0|1,0,0]=3 1139 B10R1.16 CCCSc1csc(n1)C 62a_100000210303_100011934587 [0,2,0,0,0,0|2,0,0]=4 1140 B10R1.16 CCCSc1csc(n1)C 62a_100011934587_100000210303 [0,2,0,0,0,0|2,0,0]=4 1141 B10R1.16 CCCSc1csc(n1)N 62a_100000210303_100011998049 [0,2,0,0,0,0|2,0,0]=4 1142 B10R1.16 CCCSc1csc(n1)N 62a_100011998049_100000210303 [0,2,0,0,0,0|2,0,0]=4 1143 B10R1.16 CCNCc1cc(sn1)C 207a_100015525214_200000100279 [0,2,0,0,0,0|2,0,0]=4 1144 B10R1.16 CCNCc1cc(sn1)C 270004a_100015525214_200000100279 [0,2,0,0,0,0|2,0,0]=4 1145 B10R1.16 CCNCc1csc(c1)Br 207a_100015525214_100000737087 [0,2,0,0,0,0|1,0,0]=3 1146 B10R1.16 CCNCc1csc(c1)Br 270004a_100015525214_100000737087 [0,2,0,0,0,0|1,0,0]=3 1147 B10R1.16 CCNCc1csc(c1)C 207a_100015525214_100011998532 [0,2,0,0,0,0|1,0,0]=3 1148 B10R1.16 CCNCc1csc(c1)C 270004a_100015525214_100011998532 [0,2,0,0,0,0|1,0,0]=3 1149 B10R1.16 CCNCc1csc(c1)Cl 207a_100015525214_100009844934 [0,2,0,0,0,0|1,0,0]=3 1150 B10R1.16 CCNCc1csc(c1)Cl 270004a_100015525214_100009844934 [0,2,0,0,0,0|1,0,0]=3 1151 B10R1.16 CCNCc1csc(n1)Br 270004a_100015525214_100009816748 [0,2,0,0,0,0|2,0,0]=4 1152 B10R1.16 CCNCc1csc(n1)C 207a_100015525214_100000203724 [0,2,0,0,0,0|2,0,0]=4 1153 B10R1.16 CCNCc1csc(n1)C 2230a_100015525214_100015186478 [0,2,0,0,0,0|2,0,0]=4 1154 B10R1.16 CCNCc1csc(n1)C 270004a_100015525214_100000203724 [0,2,0,0,0,0|2,0,0]=4 1155 B10R1.16 CCNCc1csc(n1)C 34a_100000707933_100000210202 [0,2,0,0,0,0|2,0,0]=4 1156 B10R1.16 CCNCc1csc(n1)Cl 2230a_100015525214_100000024076 [0,2,0,0,0,0|2,0,0]=4 1157 B10R1.16 CCNCc1csc(n1)Cl 270004a_100015525214_100011935135 [0,2,0,0,0,0|2,0,0]=4 1158 B10R1.16 CCOCc1csc(c1)Cl 34a_100009863405_100000210202 [0,2,0,0,0,0|1,0,0]=3 1159 B10R1.16 CCOCc1csc(c1)Cl 7a_100009863405_100000210202 [0,2,0,0,0,0|1,0,0]=3 1160 B10R1.16 CCOCc1csc(n1)C 34a_100000735831_100000210202 [0,2,0,0,0,0|2,0,0]=4 1161 B10R1.16 CCOCc1csc(n1)C 34a_100121572206_100015186478 [0,2,0,0,0,0|2,0,0]=4 1162 B10R1.16 CCOCc1csc(n1)Cl 34a_100121572206_100000024076 [0,2,0,0,0,0|2,0,0]=4 1163 B10R1.16 CCSCc1csc(n1)C 62a_100000210202_100015186478 [0,2,0,0,0,0|2,0,0]=4 1164 B10R1.16 CCSCc1csc(n1)C 62a_100015186478_100000210202 [0,2,0,0,0,0|2,0,0]=4 1165 B10R1.16 CCSCc1csc(n1)Cl 62a_100000024076_100000210202 [0,2,0,0,0,0|2,0,0]=4 1166 B10R1.16 CCSCc1csc(n1)Cl 62a_100000210202_100000024076 [0,2,0,0,0,0|2,0,0]=4 1167 B10R1.16 CNCCc1ccc(o1)C 2230a_100000739271_200000210301 [0,2,0,0,0,0|2,0,0]=4 1168 B10R1.16 CNCCc1ccc(o1)C 34a_100000739271_200000210301 [0,2,0,0,0,0|2,0,0]=4 1169 B10R1.16 CNCCc1ccc(s1)Br 2230a_100000217605_200000210301 [0,2,0,0,0,0|2,0,0]=4 1170 B10R1.16 CNCCc1csc(n1)C 2230a_102495365028_200000210301 [0,2,0,0,0,0|1,0,0]=3 1171 B10R1.16 CNCCc1csc(n1)C 2230a_106832991635_100000695623 [0,2,0,0,0,0|1,0,0]=3 1172 B10R1.16 CNCCc1csc(n1)C 34a_100102657272_100000695623 [0,2,0,0,0,0|1,0,0]=3 1173 B10R1.16 CNCCc1csc(n1)C 34a_102495365028_200000210301 [0,2,0,0,0,0|1,0,0]=3 1174 B10R1.16 CNCCc1csc(n1)C 7a_106832991635_100000695623 [0,2,0,0,0,0|1,0,0]=3 1175 B10R1.16 COCCc1csc(n1)C 34a_100011934828_200000210301 [0,2,0,0,0,0|2,0,0]=4 1176 B10R1.16 COCCc1csc(n1)C 34a_100138415774_100000695623 [0,2,0,0,0,0|2,0,0]=4 1177 B10R1.16 COCSc1csc(c1)C 62a_100000759034_100000766300 [0,2,0,0,0,0|2,0,0]=4 1178 B10R1.16 COCSc1csc(c1)C 62a_100000766300_100000759034 [0,2,0,0,0,0|2,0,0]=4 1179 B10R1.16 CSCCc1csc(n1)C 62a_100000695623_200000210301 [0,2,0,0,0,0|2,0,0]=4 1180 B10R1.16 CSCCc1csc(n1)C 62a_200000210301_100000695623 [0,2,0,0,0,0|2,0,0]=4 1181 B10R1.16 CSCSc1csc(c1)C 62a_100000759034_100011218213 [0,2,0,0,0,0|2,0,0]=4 1182 B10R1.16 CSCSc1csc(c1)C 62a_100011218213_100000759034 [0,2,0,0,0,0|2,0,0]=4 1183 B10R1.16 Cc1cc(cs1)SCC#N 62a_100000759034_100011215382 [0,2,0,0,0,0|0,0,2]=4 1184 B10R1.16 Cc1cc(cs1)SCC#N 62a_100011215382_100000759034 [0,2,0,0,0,0|0,0,2]=4 1185 B10R1.16 Cc1cc(cs1)SCC=O 62a_100000759034_200015260668 [0,2,0,0,0,0|1,0,1]=4 1186 B10R1.16 Cc1cc(cs1)SCC=O 62a_200015260668_100000759034 [0,2,0,0,0,0|1,0,1]=4 1187 B10R1.16 Cc1cc(cs1)SCCF 62a_100000759034_100011217306 [0,2,0,0,0,0|1,0,0]=3 1188 B10R1.16 Cc1cc(cs1)SCCF 62a_100011217306_100000759034 [0,2,0,0,0,0|1,0,0]=3 1189 B10R1.16 Cc1cc(cs1)SCCO 62a_100000211926_100000759034 [0,2,0,0,0,0|1,0,0]=3 1190 B10R1.16 Cc1cc(cs1)SCCO 62a_100000759034_100000211926 [0,2,0,0,0,0|1,0,0]=3 1191 B10R1.16 Cc1ccc(o1)CCN[13CH3] 2230a_100000739271_200025704644 [0,2,0,0,0,0|2,0,0]=4 1192 B10R1.16 Cc1ccc(o1)CCN[13CH3] 34a_100000739271_200025704644 [0,2,0,0,0,0|2,0,0]=4 1193 B10R1.16 Cc1nc(cs1)CCN[13CH3] 2230a_102495365028_200025704644 [0,2,0,0,0,0|1,0,0]=3 1194 B10R1.16 Cc1nc(cs1)CCN[13CH3] 34a_102495365028_200025704644 [0,2,0,0,0,0|1,0,0]=3 1195 B10R1.16 Cc1nc(cs1)CCO[13CH3] 34a_100011934828_200025704644 [0,2,0,0,0,0|2,0,0]=4 1196 B10R1.16 Cc1nc(cs1)CCS[13CH3] 62a_100000695623_200025704644 [0,2,0,0,0,0|2,0,0]=4 1197 B10R1.16 Cc1nc(cs1)CCS[13CH3] 62a_200025704644_100000695623 [0,2,0,0,0,0|2,0,0]=4 1198 B10R1.16 Cc1nc(cs1)CNCF 34a_100000707933_100015361967 [0,2,0,0,0,0|2,0,0]=4 1199 B10R1.16 Cc1nc(cs1)COCF 34a_100000735831_100015361967 [0,2,0,0,0,0|2,0,0]=4 1200 B10R1.16 Cc1nc(cs1)CSCF 62a_100015186478_100015361967 [0,2,0,0,0,0|2,0,0]=4 1201 B10R1.16 Cc1nc(cs1)CSCF 62a_100015361967_100015186478 [0,2,0,0,0,0|2,0,0]=4 1202 B10R1.16 Cc1nc(cs1)SCCF 62a_100011217306_100011934587 [0,2,0,0,0,0|2,0,0]=4 1203 B10R1.16 Cc1nc(cs1)SCCF 62a_100011934587_100011217306 [0,2,0,0,0,0|2,0,0]=4 1204 B10R1.16 Cc1nc(cs1)SCCO 62a_100000211926_100011934587 [0,2,0,0,0,0|2,0,0]=4 1205 B10R1.16 Cc1nc(cs1)SCCO 62a_100011934587_100000211926 [0,2,0,0,0,0|2,0,0]=4 1206 B10R1.16 FCOCc1csc(c1)Cl 34a_100009863405_100015361967 [0,2,0,0,0,0|1,0,0]=3 1207 B10R1.16 FCOCc1csc(c1)Cl 7a_100009863405_100015361967 [0,2,0,0,0,0|1,0,0]=3 1208 B10R1.16 FCSCc1csc(n1)Cl 62a_100000024076_100015361967 [0,2,0,0,0,0|2,0,0]=4 1209 B10R1.16 FCSCc1csc(n1)Cl 62a_100015361967_100000024076 [0,2,0,0,0,0|2,0,0]=4 1210 B10R1.16 Nc1nc(cs1)SCCF 62a_100011217306_100011998049 [0,2,0,0,0,0|2,0,0]=4 1211 B10R1.16 Nc1nc(cs1)SCCF 62a_100011998049_100011217306 [0,2,0,0,0,0|2,0,0]=4 1212 B10R1.16 Nc1nc(cs1)SCCO 62a_100000211926_100011998049 [0,2,0,0,0,0|2,0,0]=4 1213 B10R1.16 Nc1nc(cs1)SCCO 62a_100011998049_100000211926 [0,2,0,0,0,0|2,0,0]=4 1214 B10R1.16 [13CH3]NCCc1ccc(s1)Br 2230a_100000217605_200025704644 [0,2,0,0,0,0|2,0,0]=4 1215 B10R1.54 CN(C)Cc1csc(c1)Br 270004a_100102631434_100000737087 [0,2,0,0,0,0|2,0,0]=4 1216 B10R1.54 CN(C)Cc1csc(c1)Cl 270004a_100102631434_100009844934 [0,2,0,0,0,0|2,0,0]=4 1217 B10R1.54 Cc1cc(cs1)CN(C)C 270004a_100102631434_100011998532 [0,2,0,0,0,0|2,0,0]=4 1218 B10R1.54 Cc1cc(cs1)SC(C)C 62a_100000210206_100000759034 [0,2,0,0,0,0|2,0,0]=4 1219 B10R1.54 Cc1cc(cs1)SC(C)C 62a_100000759034_100000210206 [0,2,0,0,0,0|2,0,0]=4 1220 B10R1.94 CCSc1csc(c1C)C 62a_100000210202_100009820295 [0,2,0,0,0,0|2,0,0]=4 1221 B10R1.94 CCSc1csc(c1C)C 62a_100009820295_100000210202 [0,2,0,0,0,0|2,0,0]=4 1222 B10R1.94 Cc1scc(c1C)SCF 62a_100009820295_100015361967 [0,2,0,0,0,0|2,0,0]=4 1223 B10R1.94 Cc1scc(c1C)SCF 62a_100015361967_100009820295 [0,2,0,0,0,0|2,0,0]=4 1224 B10R1.96 CCSc1csc(c1)C#N 62a_100000210202_100000742465 [0,2,0,0,0,0|2,0,0]=4 1225 B10R1.96 CCSc1csc(c1)C=O 62a_100000210202_100000211722 [0,2,0,0,0,0|2,0,0]=4 1226 B10R1.96 CCSc1csc(c1)C=O 62a_100000211722_100000210202 [0,2,0,0,0,0|2,0,0]=4 1227 B10R1.96 CCSc1csc(c1)CC 62a_100000210202_100009846239 [0,2,0,0,0,0|2,0,0]=4 1228 B10R1.96 CCSc1csc(c1)CC 62a_100009846239_100000210202 [0,2,0,0,0,0|2,0,0]=4 1229 B10R1.96 CCSc1csc(c1)CN 62a_100000210202_100000741024 [0,2,0,0,0,0|2,0,0]=4 1230 B10R1.96 CCSc1csc(c1)CN 62a_100000741024_100000210202 [0,2,0,0,0,0|2,0,0]=4 1231 B10R1.96 CCSc1csc(c1)CO 62a_100000210202_100000238369 [0,2,0,0,0,0|2,0,0]=4 1232 B10R1.96 CCSc1csc(c1)CO 62a_100000238369_100000210202 [0,2,0,0,0,0|2,0,0]=4 1233 B10R1.96 CCSc1csc(c1)SC 62a_100000210202_200010256830 [0,2,0,0,0,0|2,0,0]=4 1234 B10R1.96 CCSc1csc(c1)SC 62a_200010256830_100000210202 [0,2,0,0,0,0|2,0,0]=4 1235 B10R1.96 CCc1cc(cs1)SCF 62a_100009846239_100015361967 [0,2,0,0,0,0|2,0,0]=4 1236 B10R1.96 CCc1cc(cs1)SCF 62a_100015361967_100009846239 [0,2,0,0,0,0|2,0,0]=4 1237 B10R1.96 CNCc1csc(c1)C=O 2230a_106832991635_100000070824 [0,2,0,0,0,0|2,0,0]=4 1238 B10R1.96 CNCc1csc(c1)C=O 34a_100102657272_100000070824 [0,2,0,0,0,0|2,0,0]=4 1239 B10R1.96 CNCc1csc(c1)C=O 7a_106832991635_100000070824 [0,2,0,0,0,0|2,0,0]=4 1240 B10R1.96 COCc1csc(c1)C=O 34a_100138415774_100000070824 [0,2,0,0,0,0|2,0,0]=4 1241 B10R1.96 CSCc1csc(c1)C=O 62a_100000070824_200000210301 [0,2,0,0,0,0|2,0,0]=4 1242 B10R1.96 CSCc1csc(c1)C=O 62a_200000210301_100000070824 [0,2,0,0,0,0|2,0,0]=4 1243 B10R1.96 CSc1cc(cs1)SCF 62a_100015361967_200010256830 [0,2,0,0,0,0|2,0,0]=4 1244 B10R1.96 CSc1cc(cs1)SCF 62a_200010256830_100015361967 [0,2,0,0,0,0|2,0,0]=4 1245 B10R1.96 CSc1ccc(s1)CCN 62a_100000217605_200000210301 [0,2,0,0,0,0|2,0,0]=4 1246 B10R1.96 CSc1ccc(s1)CCN 62a_200000210301_100000217605 [0,2,0,0,0,0|2,0,0]=4 1247 B10R1.96 N#Cc1cc(cs1)SCF 62a_100015361967_100000742465 [0,2,0,0,0,0|2,0,0]=4 1248 B10R1.96 NCc1cc(cs1)SCF 62a_100000741024_100015361967 [0,2,0,0,0,0|2,0,0]=4 1249 B10R1.96 NCc1cc(cs1)SCF 62a_100015361967_100000741024 [0,2,0,0,0,0|2,0,0]=4 1250 B10R1.96 O=Cc1cc(cs1)SCF 62a_100000211722_100015361967 [0,2,0,0,0,0|2,0,0]=4 1251 B10R1.96 O=Cc1cc(cs1)SCF 62a_100015361967_100000211722 [0,2,0,0,0,0|2,0,0]=4 1252 B10R1.96 OCc1cc(cs1)SCF 62a_100000238369_100015361967 [0,2,0,0,0,0|2,0,0]=4 1253 B10R1.96 OCc1cc(cs1)SCF 62a_100015361967_100000238369 [0,2,0,0,0,0|2,0,0]=4 1254 B10R1.96 [13CH3]SCc1csc(c1)C=O 62a_100000070824_200025704644 [0,2,0,0,0,0|2,0,0]=4 1255 B10R1.96 [13CH3]SCc1csc(c1)C=O 62a_200025704644_100000070824 [0,2,0,0,0,0|2,0,0]=4 1256 B10R1.96 [13CH3]Sc1ccc(s1)CCN 62a_100000217605_200025704644 [0,2,0,0,0,0|2,0,0]=4 1257 B10R1.96 [13CH3]Sc1ccc(s1)CCN 62a_200025704644_100000217605 [0,2,0,0,0,0|2,0,0]=4 1258 B10R1.130 CCSc1cc(sc1C)C 62a_100000210202_100000688054 [0,2,0,0,0,0|2,0,0]=4 1259 B10R1.130 CCSc1cc(sc1C)C 62a_100000688054_100000210202 [0,2,0,0,0,0|2,0,0]=4 1260 B10R1.130 CCSc1cc(sc1Cl)Cl 62a_100000210202_100010244177 [0,2,0,0,0,0|2,0,0]=4 1261 B10R1.130 CNCc1cc(sc1Br)Br 207a_100102657272_100011982627 [0,2,0,0,0,0|2,0,0]=4 1262 B10R1.130 CNCc1cc(sc1Br)Br 270004a_106832991635_100011982627 [0,2,0,0,0,0|2,0,0]=4 1263 B10R1.130 CNCc1cc(sc1C)C 207a_100102657272_100000745318 [0,2,0,0,0,0|2,0,0]=4 1264 B10R1.130 CNCc1cc(sc1C)C 270004a_106832991635_100000745318 [0,2,0,0,0,0|2,0,0]=4 1265 B10R1.130 CNCc1cc(sc1Cl)Cl 207a_100102657272_100011218220 [0,2,0,0,0,0|2,0,0]=4 1266 B10R1.130 CNCc1cc(sc1Cl)Cl 270004a_106832991635_100011218220 [0,2,0,0,0,0|2,0,0]=4 1267 B10R1.130 Cc1cc(c(s1)C)SCF 62a_100000688054_100015361967 [0,2,0,0,0,0|2,0,0]=4 1268 B10R1.130 Cc1cc(c(s1)C)SCF 62a_100015361967_100000688054 [0,2,0,0,0,0|2,0,0]=4 1269 B10R1.130 Cc1sc(nc1CCO)O 271570a_203496583355_100010201174 [0,2,0,0,0,0|2,0,0]=4 1270 B10R1.130 FCSc1cc(sc1Cl)Cl 62a_100015361967_100010244177 [0,2,0,0,0,0|2,0,0]=4 1271 B10R1.9 COC(CN)c1ccco1 34a_100000738650_200000210301 [0,2,0,0,0,0|2,0,0]=4 1272 B10R1.9 COC(CN)c1ccsc1 34a_100000758718_200000210301 [0,2,0,0,0,0|0,0,0]=2 1273 B10R1.9 [13CH3]OC(CN)c1ccco1 34a_100000738650_200025704644 [0,2,0,0,0,0|2,0,0]=4 1274 B10R1.9 [13CH3]OC(CN)c1ccsc1 34a_100000758718_200025704644 [0,2,0,0,0,0|0,0,0]=2 1275 B10R1.11 CC(OCF)c1ccsc1 34a_100011350980_100015361967 [0,2,0,0,0,0|1,0,0]=3 1276 B10R1.11 CC(OCF)c1ccsc1 7a_100011350980_100015361967 [0,2,0,0,0,0|1,0,0]=3 1277 B10R1.11 CCNC(C)c1cc[nH]c1 269862a_100015525214_100000753940 [0,2,0,0,0,0|2,0,0]=4 1278 B10R1.11 CCNC(C)c1ccoc1 2230a_100000690049_100000210202 [0,2,0,0,0,0|1,1,0]=4 1279 B10R1.11 CCNC(C)c1ccsc1 2230a_100000748604_100000210202 [0,2,0,0,0,0|1,0,0]=3 1280 B10R1.11 CCNC(C)c1ccsc1 269862a_100015525214_100000747891 [0,2,0,0,0,0|1,0,0]=3 1281 B10R1.11 CCNC(C)c1cscn1 269862a_100015525214_100000693406 [0,2,0,0,0,0|2,0,0]=4 1282 B10R1.11 CCOC(C)c1ccsc1 34a_100011350980_100000210202 [0,2,0,0,0,0|1,0,0]=3 1283 B10R1.11 CCOC(C)c1ccsc1 7a_100011350980_100000210202 [0,2,0,0,0,0|1,0,0]=3 1284 B10R1.11 CNCC(=O)c1ccsc1 2230a_106832991635_100011219462 [0,2,0,0,0,0|0,0,1]=3 1285 B10R1.11 CNCC(=O)c1ccsc1 34a_100102657272_100011219462 [0,2,0,0,0,0|0,0,1]=3 1286 B10R1.11 CNCC(=O)c1ccsc1 7a_106832991635_100011219462 [0,2,0,0,0,0|0,0,1]=3 1287 B10R1.11 CNCC(O)c1ccco1 2230a_100000738650_200000210301 [0,2,0,0,0,0|2,0,0]=4 1288 B10R1.11 CNCC(O)c1ccsc1 2230a_100000758718_200000210301 [0,2,0,0,0,0|0,0,0]=2 1289 B10R1.11 CNCC(O)c1ccsc1 34a_100000758718_200000210301 [0,2,0,0,0,0|0,0,0]=2 1290 B10R1.11 COCC(=O)c1ccsc1 34a_100138415774_100011219462 [0,2,0,0,0,0|1,0,1]=4 1291 B10R1.11 CSCC(=O)c1ccsc1 62a_100011219462_200000210301 [0,2,0,0,0,0|1,0,1]=4 1292 B10R1.11 CSCC(=O)c1ccsc1 62a_200000210301_100011219462 [0,2,0,0,0,0|1,0,1]=4 1293 B10R1.11 [13CH3]NCC(O)c1ccco1 2230a_100000738650_200025704644 [0,2,0,0,0,0|2,0,0]=4 1294 B10R1.11 [13CH3]NCC(O)c1ccsc1 2230a_100000758718_200025704644 [0,2,0,0,0,0|0,0,0]=2 1295 B10R1.11 [13CH3]NCC(O)c1ccsc1 34a_100000758718_200025704644 [0,2,0,0,0,0|0,0,0]=2 1296 B10R1.11 [13CH3]SCC(=O)c1ccsc1 62a_100011219462_200025704644 [0,2,0,0,0,0|1,0,1]=4 1297 B10R1.11 [13CH3]SCC(=O)c1ccsc1 62a_200025704644_100011219462 [0,2,0,0,0,0|1,0,1]=4 1298 B10R1.21 BrCCOCc1ccsc1 34a_100000211926_100011261437 [0,2,0,0,0,0|1,0,0]=3 1299 B10R1.21 BrCCOCc1cscn1 34a_100000211926_100000205941 [0,2,0,0,0,0|2,0,0]=4 1300 B10R1.21 C#CCCOc1ccsc1 34a_100000106738_100000688953 [0,2,0,0,0,0|1,0,0]=3 1301 B10R1.21 C#CCCOc1ccsc1 7a_100000106738_100000688953 [0,2,0,0,0,0|1,0,0]=3 1302 B10R1.21 C#CCCSc1ccoc1 62a_100000688953_100011215275 [0,2,0,0,0,0|1,1,0]=4 1303 B10R1.21 C#CCCSc1ccoc1 62a_100011215275_100000688953 [0,2,0,0,0,0|1,1,0]=4 1304 B10R1.21 C#CCCSc1ccsc1 62a_100000688953_100000738268 [0,2,0,0,0,0|1,0,0]=3 1305 B10R1.21 C#CCCSc1ccsc1 62a_100000738268_100000688953 [0,2,0,0,0,0|1,0,0]=3 1306 B10R1.21 C#CCCSc1ccsn1 62a_100000688953_100009818082 [0,2,0,0,0,0|2,0,0]=4 1307 B10R1.21 C#CCCSc1ccsn1 62a_100009818082_100000688953 [0,2,0,0,0,0|2,0,0]=4 1308 B10R1.21 C#CCCSc1cnsc1 62a_100000688953_100009815736 [0,2,0,0,0,0|2,0,0]=4 1309 B10R1.21 C#CCCSc1cnsc1 62a_100009815736_100000688953 [0,2,0,0,0,0|2,0,0]=4 1310 B10R1.21 C#CCCSc1cscn1 62a_100000688953_100000751502 [0,2,0,0,0,0|2,0,0]=4 1311 B10R1.21 C#CCCSc1cscn1 62a_100000751502_100000688953 [0,2,0,0,0,0|2,0,0]=4 1312 B10R1.21 C#CCNCc1ccoc1 2230a_100015206860_100000038162 [0,2,0,0,0,0|1,1,0]=4 1313 B10R1.21 C#CCNCc1ccoc1 34a_100015206860_100000184674 [0,2,0,0,0,0|1,1,0]=4 1314 B10R1.21 C#CCNCc1ccsc1 2230a_100000186416_100000038162 [0,2,0,0,0,0|1,0,0]=3 1315 B10R1.21 C#CCNCc1ccsc1 34a_100000186416_100000184674 [0,2,0,0,0,0|1,0,0]=3 1316 B10R1.21 C#CCNCc1ccsc1 34a_100000212058_100011261437 [0,2,0,0,0,0|1,0,0]=3 1317 B10R1.21 C#CCNCc1cscn1 2230a_100015185402_100000038162 [0,2,0,0,0,0|2,0,0]=4 1318 B10R1.21 C#CCNCc1cscn1 34a_100000212058_100000205941 [0,2,0,0,0,0|2,0,0]=4 1319 B10R1.21 C#CCOCc1ccoc1 34a_100011215357_100000184674 [0,2,0,0,0,0|1,1,0]=4 1320 B10R1.21 C#CCOCc1ccsc1 34a_100000210247_100011261437 [0,2,0,0,0,0|1,0,0]=3 1321 B10R1.21 C#CCOCc1ccsc1 34a_100011215551_100000184674 [0,2,0,0,0,0|1,0,0]=3 1322 B10R1.21 C#CCOCc1cscn1 34a_100000210247_100000205941 [0,2,0,0,0,0|2,0,0]=4 1323 B10R1.21 C#CCSCc1ccsc1 62a_100000038162_100011233845 [0,2,0,0,0,0|1,0,0]=3 1324 B10R1.21 C#CCSCc1cscn1 62a_100000038162_100000205941 [0,2,0,0,0,0|2,0,0]=4 1325 B10R1.21 C/C=C/COc1ccsc1 34a_100000106738_100102629194 [0,2,0,0,0,0|1,0,1]=4 1326 B10R1.21 C/C=C/COc1ccsc1 7a_100000106738_100102629194 [0,2,0,0,0,0|1,0,1]=4 1327 B10R1.21 C/C=C/CSc1ccsc1 62a_100000738268_100102629194 [0,2,0,0,0,0|1,0,1]=4 1328 B10R1.21 C/C=C/CSc1ccsc1 62a_100102629194_100000738268 [0,2,0,0,0,0|1,0,1]=4 1329 B10R1.21 C=CCCOc1ccsc1 34a_100000106738_100000754431 [0,2,0,0,0,0|1,0,0]=3 1330 B10R1.21 C=CCCOc1ccsc1 7a_100000106738_100000754431 [0,2,0,0,0,0|1,0,0]=3 1331 B10R1.21 C=CCCSc1ccoc1 62a_100000754431_100011215275 [0,2,0,0,0,0|1,1,0]=4 1332 B10R1.21 C=CCCSc1ccoc1 62a_100011215275_100000754431 [0,2,0,0,0,0|1,1,0]=4 1333 B10R1.21 C=CCCSc1ccsc1 62a_100000738268_100000754431 [0,2,0,0,0,0|1,0,0]=3 1334 B10R1.21 C=CCCSc1ccsc1 62a_100000754431_100000738268 [0,2,0,0,0,0|1,0,0]=3 1335 B10R1.21 C=CCCSc1ccsn1 62a_100000754431_100009818082 [0,2,0,0,0,0|2,0,0]=4 1336 B10R1.21 C=CCCSc1ccsn1 62a_100009818082_100000754431 [0,2,0,0,0,0|2,0,0]=4 1337 B10R1.21 C=CCCSc1cnsc1 62a_100000754431_100009815736 [0,2,0,0,0,0|2,0,0]=4 1338 B10R1.21 C=CCCSc1cnsc1 62a_100009815736_100000754431 [0,2,0,0,0,0|2,0,0]=4 1339 B10R1.21 C=CCCSc1cscn1 62a_100000751502_100000754431 [0,2,0,0,0,0|2,0,0]=4 1340 B10R1.21 C=CCCSc1cscn1 62a_100000754431_100000751502 [0,2,0,0,0,0|2,0,0]=4 1341 B10R1.21 C=CCNCc1ccoc1 2230a_100015206860_100000210623 [0,2,0,0,0,0|1,1,0]=4 1342 B10R1.21 C=CCNCc1ccoc1 270004a_100020586998_100011215517 [0,2,0,0,0,0|1,1,0]=4 1343 B10R1.21 C=CCNCc1ccoc1 34a_100015206860_100015514636 [0,2,0,0,0,0|1,1,0]=4 1344 B10R1.21 C=CCNCc1ccsc1 2230a_100000186416_100000210623 [0,2,0,0,0,0|1,0,0]=3 1345 B10R1.21 C=CCNCc1ccsc1 2230a_100020586998_100011261437 [0,2,0,0,0,0|1,0,0]=3 1346 B10R1.21 C=CCNCc1ccsc1 270004a_100020586998_100000188534 [0,2,0,0,0,0|1,0,0]=3 1347 B10R1.21 C=CCNCc1ccsc1 34a_100000186416_100015514636 [0,2,0,0,0,0|1,0,0]=3 1348 B10R1.21 C=CCNCc1cscn1 2230a_100015185402_100000210623 [0,2,0,0,0,0|2,0,0]=4 1349 B10R1.21 C=CCNCc1cscn1 2230a_100020586998_100000205941 [0,2,0,0,0,0|2,0,0]=4 1350 B10R1.21 C=CCNCc1cscn1 270004a_100020586998_100000743575 [0,2,0,0,0,0|2,0,0]=4 1351 B10R1.21 C=CCOCc1ccoc1 34a_100011215357_100015514636 [0,2,0,0,0,0|1,1,0]=4 1352 B10R1.21 C=CCOCc1ccsc1 34a_100011215551_100015514636 [0,2,0,0,0,0|1,0,0]=3 1353 B10R1.21 C=CCOCc1ccsc1 34a_200000210373_100011261437 [0,2,0,0,0,0|1,0,0]=3 1354 B10R1.21 C=CCOCc1cscn1 34a_200000210373_100000205941 [0,2,0,0,0,0|2,0,0]=4 1355 B10R1.21 C=CCSCc1ccsc1 62a_100000210623_100011233845 [0,2,0,0,0,0|1,0,0]=3 1356 B10R1.21 C=CCSCc1ccsc1 62a_100011261437_100000210623 [0,2,0,0,0,0|1,0,0]=3 1357 B10R1.21 C=CCSCc1cscn1 62a_100000205941_100000210623 [0,2,0,0,0,0|2,0,0]=4 1358 B10R1.21 C=CCSCc1cscn1 62a_100000210623_100000205941 [0,2,0,0,0,0|2,0,0]=4 1359 B10R1.21 CC#CCOc1ccsc1 34a_100000106738_100000748600 [0,2,0,0,0,0|1,0,1]=4 1360 B10R1.21 CC#CCOc1ccsc1 7a_100000106738_100000748600 [0,2,0,0,0,0|1,0,1]=4 1361 B10R1.21 CC#CCSc1ccsc1 62a_100000738268_100000748600 [0,2,0,0,0,0|1,0,1]=4 1362 B10R1.21 CC#CCSc1ccsc1 62a_100000748600_100000738268 [0,2,0,0,0,0|1,0,1]=4 1363 B10R1.21 CC=CCOc1ccsc1 34a_100000106738_100000070051 [0,2,0,0,0,0|1,0,1]=4 1364 B10R1.21 CC=CCOc1ccsc1 7a_100000106738_100000070051 [0,2,0,0,0,0|1,0,1]=4 1365 B10R1.21 CC=CCSc1ccsc1 62a_100000070051_100000738268 [0,2,0,0,0,0|1,0,1]=4 1366 B10R1.21 CC=CCSc1ccsc1 62a_100000738268_100000070051 [0,2,0,0,0,0|1,0,1]=4 1367 B10R1.21 CCCC=Cc1ccoc1 271570a_100016258520_100011215275 [0,2,0,0,0,0|1,1,0]=4 1368 B10R1.21 CCCC=Cc1ccsc1 271570a_100016258520_100000738268 [0,2,0,0,0,0|1,0,0]=3 1369 B10R1.21 CCCC=Cc1ccsn1 271570a_100016258520_100009818082 [0,2,0,0,0,0|2,0,0]=4 1370 B10R1.21 CCCC=Cc1cnsc1 271570a_100016258520_100009815736 [0,2,0,0,0,0|2,0,0]=4 1371 B10R1.21 CCCC=Cc1cscn1 271570a_100016258520_100000751502 [0,2,0,0,0,0|2,0,0]=4 1372 B10R1.21 CCCCOc1ccsc1 34a_100000106738_100000210210 [0,2,0,0,0,0|1,0,0]=3 1373 B10R1.21 CCCCOc1ccsc1 7a_100000106738_100000210211 [0,2,0,0,0,0|1,0,0]=3 1374 B10R1.21 CCCCSc1ccoc1 62a_100000210211_100011215275 [0,2,0,0,0,0|1,1,0]=4 1375 B10R1.21 CCCCSc1ccoc1 62a_100011215275_100000210210 [0,2,0,0,0,0|1,1,0]=4 1376 B10R1.21 CCCCSc1ccsc1 62a_100000210211_100000738268 [0,2,0,0,0,0|1,0,0]=3 1377 B10R1.21 CCCCSc1ccsc1 62a_100000738268_100000210210 [0,2,0,0,0,0|1,0,0]=3 1378 B10R1.21 CCCCSc1ccsn1 62a_100000210211_100009818082 [0,2,0,0,0,0|2,0,0]=4 1379 B10R1.21 CCCCSc1ccsn1 62a_100009818082_100000210210 [0,2,0,0,0,0|2,0,0]=4 1380 B10R1.21 CCCCSc1cnsc1 62a_100000210211_100009815736 [0,2,0,0,0,0|2,0,0]=4 1381 B10R1.21 CCCCSc1cnsc1 62a_100009815736_100000210210 [0,2,0,0,0,0|2,0,0]=4 1382 B10R1.21 CCCCSc1cscn1 62a_100000210211_100000751502 [0,2,0,0,0,0|2,0,0]=4 1383 B10R1.21 CCCCSc1cscn1 62a_100000751502_100000210210 [0,2,0,0,0,0|2,0,0]=4 1384 B10R1.21 CCCNCc1ccoc1 207a_100020643023_100011215517 [0,2,0,0,0,0|1,1,0]=4 1385 B10R1.21 CCCNCc1ccoc1 2230a_100015206860_100000210303 [0,2,0,0,0,0|1,1,0]=4 1386 B10R1.21 CCCNCc1ccoc1 270004a_100020643023_100011215517 [0,2,0,0,0,0|1,1,0]=4 1387 B10R1.21 CCCNCc1ccoc1 34a_100015206860_100000210303 [0,2,0,0,0,0|1,1,0]=4 1388 B10R1.21 CCCNCc1ccsc1 207a_100020643023_100000188534 [0,2,0,0,0,0|1,0,0]=3 1389 B10R1.21 CCCNCc1ccsc1 2230a_100000186416_100000210303 [0,2,0,0,0,0|1,0,0]=3 1390 B10R1.21 CCCNCc1ccsc1 270004a_100020643023_100000188534 [0,2,0,0,0,0|1,0,0]=3 1391 B10R1.21 CCCNCc1ccsc1 34a_100000186416_100000210303 [0,2,0,0,0,0|1,0,0]=3 1392 B10R1.21 CCCNCc1cscn1 207a_100020643023_100000743575 [0,2,0,0,0,0|2,0,0]=4 1393 B10R1.21 CCCNCc1cscn1 2230a_100015185402_100000210303 [0,2,0,0,0,0|2,0,0]=4 1394 B10R1.21 CCCNCc1cscn1 270004a_100020643023_100000743575 [0,2,0,0,0,0|2,0,0]=4 1395 B10R1.21 CCCOCc1ccoc1 34a_100011215357_100000210303 [0,2,0,0,0,0|1,1,0]=4 1396 B10R1.21 CCCOCc1ccsc1 34a_100000210258_100011261437 [0,2,0,0,0,0|1,0,0]=3 1397 B10R1.21 CCCOCc1ccsc1 34a_100011215551_100000210303 [0,2,0,0,0,0|1,0,0]=3 1398 B10R1.21 CCCOCc1cscn1 34a_100000210258_100000205941 [0,2,0,0,0,0|2,0,0]=4 1399 B10R1.21 CCCSCc1ccsc1 62a_100000210303_100011233845 [0,2,0,0,0,0|1,0,0]=3 1400 B10R1.21 CCCSCc1ccsc1 62a_100011261437_100000210303 [0,2,0,0,0,0|1,0,0]=3 1401 B10R1.21 CCCSCc1cscn1 62a_100000205941_100000210303 [0,2,0,0,0,0|2,0,0]=4 1402 B10R1.21 CCCSCc1cscn1 62a_100000210303_100000205941 [0,2,0,0,0,0|2,0,0]=4 1403 B10R1.21 CCNCCc1c[nH]cn1 2230a_100015525214_100020628418 [0,2,0,0,0,0|2,0,0]=4 1404 B10R1.21 CCNCCc1ccco1 2230a_100000694680_100000210202 [0,2,0,0,0,0|2,0,0]=4 1405 B10R1.21 CCNCCc1ccco1 34a_100000694680_100000210202 [0,2,0,0,0,0|2,0,0]=4 1406 B10R1.21 CCNCCc1cccs1 2230a_100000203755_100000210202 [0,2,0,0,0,0|2,0,0]=4 1407 B10R1.21 CCNCCc1cccs1 2230a_100015525214_100000748579 [0,2,0,0,0,0|2,0,0]=4 1408 B10R1.21 CCNCCc1cccs1 34a_100000203755_100000210202 [0,2,0,0,0,0|2,0,0]=4 1409 B10R1.21 CCNCCc1ccsc1 2230a_100000692642_100000210202 [0,2,0,0,0,0|0,0,0]=2 1410 B10R1.21 CCNCCc1ccsc1 34a_100000692642_100000210202 [0,2,0,0,0,0|0,0,0]=2 1411 B10R1.21 CCNCCc1cn[nH]c1 2230a_100000732747_100000210202 [0,2,0,0,0,0|2,0,0]=4 1412 B10R1.21 CCNCCc1cn[nH]c1 2230a_100015525214_100000743252 [0,2,0,0,0,0|2,0,0]=4 1413 B10R1.21 CCNCCc1cncs1 2230a_100016991637_100000210202 [0,2,0,0,0,0|2,0,0]=4 1414 B10R1.21 CCNCCn1cccc1 2230a_100015525214_200009811947 [0,2,0,0,0,0|2,0,0]=4 1415 B10R1.21 CCNCCn1cccc1 34a_100011368172_100000210202 [0,2,0,0,0,0|2,0,0]=4 1416 B10R1.21 CCNN=Cc1ccsc1 4a_100000756455_100000188534 [0,2,0,0,0,0|1,0,1]=4 1417 B10R1.21 CCOC=Cc1ccsc1 271570a_100016256518_100000738268 [0,2,0,0,0,0|1,0,1]=4 1418 B10R1.21 CCOCC[n+]1ccsc1 34a_200000100414_100000210202 [0,2,0,0,0,0|2,0,0]=4 1419 B10R1.21 CCOCCc1ccsc1 34a_100000748821_100000210202 [0,2,0,0,0,0|1,0,0]=3 1420 B10R1.21 CCOCSc1ccoc1 62a_100000739092_100011215275 [0,2,0,0,0,0|1,1,0]=4 1421 B10R1.21 CCOCSc1ccoc1 62a_100011215275_100000739092 [0,2,0,0,0,0|1,1,0]=4 1422 B10R1.21 CCOCSc1ccsc1 62a_100000738268_100000739092 [0,2,0,0,0,0|1,0,0]=3 1423 B10R1.21 CCOCSc1ccsc1 62a_100000739092_100000738268 [0,2,0,0,0,0|1,0,0]=3 1424 B10R1.21 CCOCSc1ccsn1 62a_100000739092_100009818082 [0,2,0,0,0,0|2,0,0]=4 1425 B10R1.21 CCOCSc1ccsn1 62a_100009818082_100000739092 [0,2,0,0,0,0|2,0,0]=4 1426 B10R1.21 CCOCSc1cnsc1 62a_100000739092_100009815736 [0,2,0,0,0,0|2,0,0]=4 1427 B10R1.21 CCOCSc1cnsc1 62a_100009815736_100000739092 [0,2,0,0,0,0|2,0,0]=4 1428 B10R1.21 CCOCSc1cscn1 62a_100000739092_100000751502 [0,2,0,0,0,0|2,0,0]=4 1429 B10R1.21 CCOCSc1cscn1 62a_100000751502_100000739092 [0,2,0,0,0,0|2,0,0]=4 1430 B10R1.21 CNCCCc1cccs1 2230a_106832991635_100010992444 [0,2,0,0,0,0|2,0,0]=4 1431 B10R1.21 CNCCCc1cccs1 34a_100102657272_100010992444 [0,2,0,0,0,0|2,0,0]=4 1432 B10R1.21 CNCCCc1cccs1 7a_106832991635_100010992444 [0,2,0,0,0,0|2,0,0]=4 1433 B10R1.21 CNCCCn1cccc1 2230a_106832991635_200009814367 [0,2,0,0,0,0|2,0,0]=4 1434 B10R1.21 CNCCCn1cccc1 34a_100102657272_200009814367 [0,2,0,0,0,0|2,0,0]=4 1435 B10R1.21 CNCCCn1cccc1 7a_106832991635_200009814367 [0,2,0,0,0,0|2,0,0]=4 1436 B10R1.21 CNCCCn1ccnc1 2230a_106832991635_100000756272 [0,2,0,0,0,0|2,0,0]=4 1437 B10R1.21 CNCCCn1ccnc1 34a_100102657272_100000756272 [0,2,0,0,0,0|2,0,0]=4 1438 B10R1.21 CNCCCn1ccnc1 7a_106832991635_100000756272 [0,2,0,0,0,0|2,0,0]=4 1439 B10R1.21 COCC=Cc1ccsc1 271570a_100016286323_100000738268 [0,2,0,0,0,0|1,0,1]=4 1440 B10R1.21 COCCCc1ccsc1 34a_200000699776_200000210301 [0,2,0,0,0,0|1,0,0]=3 1441 B10R1.21 COCCCc1ccsc1 7a_200000699776_200000210301 [0,2,0,0,0,0|1,0,0]=3 1442 B10R1.21 COCCOc1ccsc1 34a_100000106738_100011201679 [0,2,0,0,0,0|1,0,0]=3 1443 B10R1.21 COCCOc1ccsc1 7a_100000106738_100000233755 [0,2,0,0,0,0|1,0,0]=3 1444 B10R1.21 COCCSc1ccoc1 62a_100000233755_100011215275 [0,2,0,0,0,0|1,1,0]=4 1445 B10R1.21 COCCSc1ccoc1 62a_100011215275_100000233755 [0,2,0,0,0,0|1,1,0]=4 1446 B10R1.21 COCCSc1ccsc1 62a_100000233755_100000738268 [0,2,0,0,0,0|1,0,0]=3 1447 B10R1.21 COCCSc1ccsc1 62a_100000738268_100000233755 [0,2,0,0,0,0|1,0,0]=3 1448 B10R1.21 COCCSc1ccsn1 62a_100000233755_100009818082 [0,2,0,0,0,0|2,0,0]=4 1449 B10R1.21 COCCSc1ccsn1 62a_100009818082_100000233755 [0,2,0,0,0,0|2,0,0]=4 1450 B10R1.21 COCCSc1cnsc1 62a_100000233755_100009815736 [0,2,0,0,0,0|2,0,0]=4 1451 B10R1.21 COCCSc1cnsc1 62a_100009815736_100000233755 [0,2,0,0,0,0|2,0,0]=4 1452 B10R1.21 COCCSc1cscn1 62a_100000233755_100000751502 [0,2,0,0,0,0|2,0,0]=4 1453 B10R1.21 COCCSc1cscn1 62a_100000751502_100000233755 [0,2,0,0,0,0|2,0,0]=4 1454 B10R1.21 COCNCc1ccoc1 2230a_100015206860_100000766300 [0,2,0,0,0,0|1,1,0]=4 1455 B10R1.21 COCNCc1ccsc1 2230a_100000186416_100000766300 [0,2,0,0,0,0|1,0,0]=3 1456 B10R1.21 COCNCc1cscn1 2230a_100015185402_100000766300 [0,2,0,0,0,0|2,0,0]=4 1457 B10R1.21 COCSCc1ccsc1 62a_100000766300_100011233845 [0,2,0,0,0,0|1,0,0]=3 1458 B10R1.21 COCSCc1ccsc1 62a_100011261437_100000766300 [0,2,0,0,0,0|1,0,0]=3 1459 B10R1.21 COCSCc1cscn1 62a_100000205941_100000766300 [0,2,0,0,0,0|2,0,0]=4 1460 B10R1.21 COCSCc1cscn1 62a_100000766300_100000205941 [0,2,0,0,0,0|2,0,0]=4 1461 B10R1.21 CSCCOc1ccsc1 34a_100000106738_100000212216 [0,2,0,0,0,0|1,0,0]=3 1462 B10R1.21 CSCCOc1ccsc1 7a_100000106738_100000212216 [0,2,0,0,0,0|1,0,0]=3 1463 B10R1.21 CSCCSc1ccoc1 62a_100000212216_100011215275 [0,2,0,0,0,0|1,1,0]=4 1464 B10R1.21 CSCCSc1ccoc1 62a_100011215275_100000751147 [0,2,0,0,0,0|1,1,0]=4 1465 B10R1.21 CSCCSc1ccsc1 62a_100000212216_100000738268 [0,2,0,0,0,0|1,0,0]=3 1466 B10R1.21 CSCCSc1ccsc1 62a_100000738268_100000751147 [0,2,0,0,0,0|1,0,0]=3 1467 B10R1.21 CSCCSc1ccsn1 62a_100000212216_100009818082 [0,2,0,0,0,0|2,0,0]=4 1468 B10R1.21 CSCCSc1ccsn1 62a_100009818082_100000751147 [0,2,0,0,0,0|2,0,0]=4 1469 B10R1.21 CSCCSc1cnsc1 62a_100000212216_100009815736 [0,2,0,0,0,0|2,0,0]=4 1470 B10R1.21 CSCCSc1cnsc1 62a_100009815736_100000751147 [0,2,0,0,0,0|2,0,0]=4 1471 B10R1.21 CSCCSc1cscn1 62a_100000212216_100000751502 [0,2,0,0,0,0|2,0,0]=4 1472 B10R1.21 CSCCSc1cscn1 62a_100000751502_100000751147 [0,2,0,0,0,0|2,0,0]=4 1473 B10R1.21 CSCNCc1ccoc1 2230a_100015206860_100011218213 [0,2,0,0,0,0|1,1,0]=4 1474 B10R1.21 CSCNCc1ccoc1 34a_100015206860_100011218213 [0,2,0,0,0,0|1,1,0]=4 1475 B10R1.21 CSCNCc1ccsc1 2230a_100000186416_100011218213 [0,2,0,0,0,0|1,0,0]=3 1476 B10R1.21 CSCNCc1ccsc1 34a_100000186416_100011218213 [0,2,0,0,0,0|1,0,0]=3 1477 B10R1.21 CSCNCc1cscn1 2230a_100015185402_100011218213 [0,2,0,0,0,0|2,0,0]=4 1478 B10R1.21 CSCOCc1ccoc1 34a_100011215357_100011218213 [0,2,0,0,0,0|1,1,0]=4 1479 B10R1.21 CSCOCc1ccsc1 34a_100011215551_100011218213 [0,2,0,0,0,0|1,0,0]=3 1480 B10R1.21 CSCSCc1ccsc1 62a_100011218213_100011233845 [0,2,0,0,0,0|1,0,0]=3 1481 B10R1.21 CSCSCc1ccsc1 62a_100011261437_100011218213 [0,2,0,0,0,0|1,0,0]=3 1482 B10R1.21 CSCSCc1cscn1 62a_100000205941_100011218213 [0,2,0,0,0,0|2,0,0]=4 1483 B10R1.21 CSCSCc1cscn1 62a_100011218213_100000205941 [0,2,0,0,0,0|2,0,0]=4 1484 B10R1.21 FCCCOc1ccsc1 34a_100000106738_100011934791 [0,2,0,0,0,0|1,0,0]=3 1485 B10R1.21 FCCCOc1ccsc1 7a_100000106738_100011934791 [0,2,0,0,0,0|1,0,0]=3 1486 B10R1.21 FCCCSc1ccoc1 62a_100011215275_100011934791 [0,2,0,0,0,0|1,1,0]=4 1487 B10R1.21 FCCCSc1ccoc1 62a_100011934791_100011215275 [0,2,0,0,0,0|1,1,0]=4 1488 B10R1.21 FCCCSc1ccsc1 62a_100000738268_100011934791 [0,2,0,0,0,0|1,0,0]=3 1489 B10R1.21 FCCCSc1ccsc1 62a_100011934791_100000738268 [0,2,0,0,0,0|1,0,0]=3 1490 B10R1.21 FCCCSc1ccsn1 62a_100009818082_100011934791 [0,2,0,0,0,0|2,0,0]=4 1491 B10R1.21 FCCCSc1ccsn1 62a_100011934791_100009818082 [0,2,0,0,0,0|2,0,0]=4 1492 B10R1.21 FCCCSc1cnsc1 62a_100009815736_100011934791 [0,2,0,0,0,0|2,0,0]=4 1493 B10R1.21 FCCCSc1cnsc1 62a_100011934791_100009815736 [0,2,0,0,0,0|2,0,0]=4 1494 B10R1.21 FCCCSc1cscn1 62a_100000751502_100011934791 [0,2,0,0,0,0|2,0,0]=4 1495 B10R1.21 FCCCSc1cscn1 62a_100011934791_100000751502 [0,2,0,0,0,0|2,0,0]=4 1496 B10R1.21 FCCNCc1ccoc1 2230a_100015206860_100011217306 [0,2,0,0,0,0|1,1,0]=4 1497 B10R1.21 FCCNCc1ccoc1 34a_100015206860_100011217306 [0,2,0,0,0,0|1,1,0]=4 1498 B10R1.21 FCCNCc1ccsc1 2230a_100000186416_100011217306 [0,2,0,0,0,0|1,0,0]=3 1499 B10R1.21 FCCNCc1ccsc1 34a_100000186416_100011217306 [0,2,0,0,0,0|1,0,0]=3 1500 B10R1.21 FCCNCc1ccsc1 34a_100000724931_100011261437 [0,2,0,0,0,0|1,0,0]=3 1501 B10R1.21 FCCNCc1cscn1 2230a_100015185402_100011217306 [0,2,0,0,0,0|2,0,0]=4 1502 B10R1.21 FCCNCc1cscn1 34a_100000724931_100000205941 [0,2,0,0,0,0|2,0,0]=4 1503 B10R1.21 FCCOCc1ccoc1 34a_100011215357_100011217306 [0,2,0,0,0,0|1,1,0]=4 1504 B10R1.21 FCCOCc1ccsc1 34a_100011215551_100011217306 [0,2,0,0,0,0|1,0,0]=3 1505 B10R1.21 FCCSCc1ccsc1 62a_100011217306_100011233845 [0,2,0,0,0,0|1,0,0]=3 1506 B10R1.21 FCCSCc1ccsc1 62a_100011261437_100011217306 [0,2,0,0,0,0|1,0,0]=3 1507 B10R1.21 FCCSCc1cscn1 62a_100000205941_100011217306 [0,2,0,0,0,0|2,0,0]=4 1508 B10R1.21 FCCSCc1cscn1 62a_100011217306_100000205941 [0,2,0,0,0,0|2,0,0]=4 1509 B10R1.21 FCNCCc1ccco1 34a_100000694680_100015361967 [0,2,0,0,0,0|2,0,0]=4 1510 B10R1.21 FCNCCc1cccs1 34a_100000203755_100015361967 [0,2,0,0,0,0|2,0,0]=4 1511 B10R1.21 FCNCCc1ccsc1 34a_100000692642_100015361967 [0,2,0,0,0,0|0,0,0]=2 1512 B10R1.21 FCNCCn1cccc1 34a_100011368172_100015361967 [0,2,0,0,0,0|2,0,0]=4 1513 B10R1.21 FCOCC[n+]1ccsc1 34a_200000100414_100015361967 [0,2,0,0,0,0|2,0,0]=4 1514 B10R1.21 FCOCCc1ccsc1 34a_100000748821_100015361967 [0,2,0,0,0,0|1,0,0]=3 1515 B10R1.21 N#CCCOc1ccsc1 7a_100000106738_100000184422 [0,2,0,0,0,0|0,0,1]=3 1516 B10R1.21 N#CCCSc1ccoc1 62a_100011215226_100011215275 [0,2,0,0,0,0|0,1,1]=4 1517 B10R1.21 N#CCCSc1ccoc1 62a_100011215275_100011215226 [0,2,0,0,0,0|0,1,1]=4 1518 B10R1.21 N#CCCSc1ccsc1 62a_100000738268_100011215226 [0,2,0,0,0,0|0,0,1]=3 1519 B10R1.21 N#CCCSc1ccsc1 62a_100011215226_100000738268 [0,2,0,0,0,0|0,0,1]=3 1520 B10R1.21 N#CCCSc1ccsn1 62a_100009818082_100011215226 [0,2,0,0,0,0|1,0,1]=4 1521 B10R1.21 N#CCCSc1ccsn1 62a_100011215226_100009818082 [0,2,0,0,0,0|1,0,1]=4 1522 B10R1.21 N#CCCSc1cnsc1 62a_100009815736_100011215226 [0,2,0,0,0,0|1,0,1]=4 1523 B10R1.21 N#CCCSc1cnsc1 62a_100011215226_100009815736 [0,2,0,0,0,0|1,0,1]=4 1524 B10R1.21 N#CCCSc1cscn1 62a_100000751502_100011215226 [0,2,0,0,0,0|1,0,1]=4 1525 B10R1.21 N#CCCSc1cscn1 62a_100011215226_100000751502 [0,2,0,0,0,0|1,0,1]=4 1526 B10R1.21 N#CCNCc1ccoc1 2230a_100015206860_100011215382 [0,2,0,0,0,0|0,1,1]=4 1527 B10R1.21 N#CCNCc1ccsc1 2230a_100000186416_100011215382 [0,2,0,0,0,0|0,0,1]=3 1528 B10R1.21 N#CCNCc1cscn1 2230a_100015185402_100011215382 [0,2,0,0,0,0|1,0,1]=4 1529 B10R1.21 N#CCSCc1ccsc1 62a_100011215382_100011233845 [0,2,0,0,0,0|0,0,1]=3 1530 B10R1.21 N#CCSCc1ccsc1 62a_100011261437_100011215382 [0,2,0,0,0,0|0,0,1]=3 1531 B10R1.21 N#CCSCc1cscn1 62a_100000205941_100011215382 [0,2,0,0,0,0|1,0,1]=4 1532 B10R1.21 N#CCSCc1cscn1 62a_100011215382_100000205941 [0,2,0,0,0,0|1,0,1]=4 1533 B10R1.21 N#CSCSc1ccsc1 62a_100000211825_100000738268 [0,2,0,0,0,0|0,0,2]=4 1534 B10R1.21 N#CSCSc1ccsc1 62a_100000738268_100000211825 [0,2,0,0,0,0|0,0,2]=4 1535 B10R1.21 NCCOCc1c[nH]cn1 34a_100000210304_100000707719 [0,2,0,0,0,0|2,0,0]=4 1536 B10R1.21 NCCOCc1ccn[nH]1 34a_100000210304_100000728653 [0,2,0,0,0,0|2,0,0]=4 1537 B10R1.21 NCCOCc1ccon1 34a_100000210304_100000234950 [0,2,0,0,0,0|1,1,0]=4 1538 B10R1.21 NCCOCc1ccsc1 34a_100000210304_100011261437 [0,2,0,0,0,0|0,0,0]=2 1539 B10R1.21 NCCOCc1cncs1 34a_100000210304_100015185245 [0,2,0,0,0,0|2,0,0]=4 1540 B10R1.21 NCCOCc1cscn1 34a_100000210304_100000205941 [0,2,0,0,0,0|1,0,0]=3 1541 B10R1.21 O=CCNCc1ccoc1 2230a_100015206860_200015260668 [0,2,0,0,0,0|1,1,0]=4 1542 B10R1.21 O=CCNCc1ccoc1 34a_100015206860_200009817547 [0,2,0,0,0,0|1,1,0]=4 1543 B10R1.21 O=CCNCc1ccsc1 2230a_100000186416_200015260668 [0,2,0,0,0,0|1,0,0]=3 1544 B10R1.21 O=CCNCc1ccsc1 34a_100000186416_200009817547 [0,2,0,0,0,0|1,0,0]=3 1545 B10R1.21 O=CCNCc1cscn1 2230a_100015185402_200015260668 [0,2,0,0,0,0|2,0,0]=4 1546 B10R1.21 O=CCOCc1ccoc1 34a_100011215357_200009817547 [0,2,0,0,0,0|1,1,0]=4 1547 B10R1.21 O=CCOCc1ccsc1 34a_100011215551_200009817547 [0,2,0,0,0,0|1,0,0]=3 1548 B10R1.21 O=CCSCc1ccsc1 62a_100011261437_200015260668 [0,2,0,0,0,0|1,0,0]=3 1549 B10R1.21 O=CCSCc1ccsc1 62a_200015260668_100011233845 [0,2,0,0,0,0|1,0,0]=3 1550 B10R1.21 O=CCSCc1cscn1 62a_100000205941_200015260668 [0,2,0,0,0,0|2,0,0]=4 1551 B10R1.21 O=CCSCc1cscn1 62a_200015260668_100000205941 [0,2,0,0,0,0|2,0,0]=4 1552 B10R1.21 OCCCOc1ccsc1 34a_100000106738_100000230001 [0,2,0,0,0,0|1,0,0]=3 1553 B10R1.21 OCCCOc1ccsc1 7a_100000106738_100011215043 [0,2,0,0,0,0|1,0,0]=3 1554 B10R1.21 OCCCSc1ccoc1 62a_100011215043_100011215275 [0,2,0,0,0,0|1,1,0]=4 1555 B10R1.21 OCCCSc1ccoc1 62a_100011215275_100011215043 [0,2,0,0,0,0|1,1,0]=4 1556 B10R1.21 OCCCSc1ccsc1 62a_100000738268_100011215043 [0,2,0,0,0,0|1,0,0]=3 1557 B10R1.21 OCCCSc1ccsc1 62a_100011215043_100000738268 [0,2,0,0,0,0|1,0,0]=3 1558 B10R1.21 OCCCSc1ccsn1 62a_100009818082_100011215043 [0,2,0,0,0,0|2,0,0]=4 1559 B10R1.21 OCCCSc1ccsn1 62a_100011215043_100009818082 [0,2,0,0,0,0|2,0,0]=4 1560 B10R1.21 OCCCSc1cnsc1 62a_100009815736_100011215043 [0,2,0,0,0,0|2,0,0]=4 1561 B10R1.21 OCCCSc1cnsc1 62a_100011215043_100009815736 [0,2,0,0,0,0|2,0,0]=4 1562 B10R1.21 OCCCSc1cscn1 62a_100000751502_100011215043 [0,2,0,0,0,0|2,0,0]=4 1563 B10R1.21 OCCCSc1cscn1 62a_100011215043_100000751502 [0,2,0,0,0,0|2,0,0]=4 1564 B10R1.21 OCCNCc1ccoc1 207a_100000210304_100011215517 [0,2,0,0,0,0|1,1,0]=4 1565 B10R1.21 OCCNCc1ccoc1 2230a_100015206860_100000211926 [0,2,0,0,0,0|1,1,0]=4 1566 B10R1.21 OCCNCc1ccoc1 270004a_100000210304_100011215517 [0,2,0,0,0,0|1,1,0]=4 1567 B10R1.21 OCCNCc1ccoc1 34a_100015206860_100000211926 [0,2,0,0,0,0|1,1,0]=4 1568 B10R1.21 OCCNCc1ccsc1 207a_100000210304_100000188534 [0,2,0,0,0,0|1,0,0]=3 1569 B10R1.21 OCCNCc1ccsc1 2230a_100000186416_100000211926 [0,2,0,0,0,0|1,0,0]=3 1570 B10R1.21 OCCNCc1ccsc1 2230a_100016997473_100011261437 [0,2,0,0,0,0|1,0,0]=3 1571 B10R1.21 OCCNCc1ccsc1 270004a_100000210304_100000188534 [0,2,0,0,0,0|1,0,0]=3 1572 B10R1.21 OCCNCc1ccsc1 34a_100000186416_100000211926 [0,2,0,0,0,0|1,0,0]=3 1573 B10R1.21 OCCNCc1ccsc1 34a_100016990907_100011261437 [0,2,0,0,0,0|1,0,0]=3 1574 B10R1.21 OCCNCc1cscn1 207a_100000210304_100000743575 [0,2,0,0,0,0|2,0,0]=4 1575 B10R1.21 OCCNCc1cscn1 2230a_100015185402_100000211926 [0,2,0,0,0,0|2,0,0]=4 1576 B10R1.21 OCCNCc1cscn1 2230a_100016997473_100000205941 [0,2,0,0,0,0|2,0,0]=4 1577 B10R1.21 OCCNCc1cscn1 270004a_100000210304_100000743575 [0,2,0,0,0,0|2,0,0]=4 1578 B10R1.21 OCCNCc1cscn1 34a_100016990907_100000205941 [0,2,0,0,0,0|2,0,0]=4 1579 B10R1.21 OCCOCc1ccoc1 34a_100011215357_100000211926 [0,2,0,0,0,0|1,1,0]=4 1580 B10R1.21 OCCOCc1ccsc1 34a_100011215551_100000211926 [0,2,0,0,0,0|1,0,0]=3 1581 B10R1.21 OCCSCc1ccsc1 62a_100000211926_100011233845 [0,2,0,0,0,0|1,0,0]=3 1582 B10R1.21 OCCSCc1ccsc1 62a_100011261437_100000211926 [0,2,0,0,0,0|1,0,0]=3 1583 B10R1.21 OCCSCc1cscn1 62a_100000205941_100000211926 [0,2,0,0,0,0|2,0,0]=4 1584 B10R1.21 OCCSCc1cscn1 62a_100000211926_100000205941 [0,2,0,0,0,0|2,0,0]=4 1585 B10R1.21 [13CH3]OCCCc1ccsc1 34a_200000699776_200025704644 [0,2,0,0,0,0|1,0,0]=3 1586 B10R1.21 [13CH3]OCCCc1ccsc1 7a_200000699776_200025704644 [0,2,0,0,0,0|1,0,0]=3 1587 B10R1.27 C#CC(=O)Cc1ccsc1 1458a_100000211873_100011233845 [0,2,0,0,0,0|1,0,1]=4 1588 B10R1.27 C#CC(C)Oc1ccsc1 34a_100000106738_200000035995 [0,2,0,0,0,0|1,0,1]=4 1589 B10R1.27 C#CC(C)Sc1ccsc1 62a_200000035995_100000738268 [0,2,0,0,0,0|1,0,1]=4 1590 B10R1.27 C=CC(=O)Cc1ccsc1 1458a_100000185746_100011233845 [0,2,0,0,0,0|1,0,1]=4 1591 B10R1.27 C=CC(C)Sc1ccsc1 62a_100011215867_100000738268 [0,2,0,0,0,0|1,0,1]=4 1592 B10R1.27 CC(C#N)Oc1ccsc1 7a_100000106738_100000703298 [0,2,0,0,0,0|0,0,2]=4 1593 B10R1.27 CC(C#N)Sc1ccsc1 62a_100000703298_100000738268 [0,2,0,0,0,0|0,0,2]=4 1594 B10R1.27 CC(C#N)Sc1ccsc1 62a_100000738268_100000703298 [0,2,0,0,0,0|0,0,2]=4 1595 B10R1.27 CC(CO)Oc1ccsc1 34a_100000106738_100012180447 [0,2,0,0,0,0|1,0,0]=3 1596 B10R1.27 CC(CO)Oc1ccsc1 7a_100000106738_100012180447 [0,2,0,0,0,0|1,0,0]=3 1597 B10R1.27 CC(CO)Sc1ccoc1 62a_100012180447_100011215275 [0,2,0,0,0,0|1,1,0]=4 1598 B10R1.27 CC(CO)Sc1ccsc1 62a_100012180447_100000738268 [0,2,0,0,0,0|1,0,0]=3 1599 B10R1.27 CC(CO)Sc1ccsn1 62a_100012180447_100009818082 [0,2,0,0,0,0|2,0,0]=4 1600 B10R1.27 CC(CO)Sc1cnsc1 62a_100012180447_100009815736 [0,2,0,0,0,0|2,0,0]=4 1601 B10R1.27 CC(CO)Sc1cscn1 62a_100012180447_100000751502 [0,2,0,0,0,0|2,0,0]=4 1602 B10R1.27 CC(Cc1cccs1)N[13CH3] 2230a_100000751415_200025704644 [0,2,0,0,0,0|2,0,0]=4 1603 B10R1.27 CC(Cc1ccsc1)N[13CH3] 2230a_100000743546_200025704644 [0,2,0,0,0,0|0,0,0]=2 1604 B10R1.27 CC(Cc1ccsc1)N[13CH3] 34a_100000743546_200025704644 [0,2,0,0,0,0|0,0,0]=2 1605 B10R1.27 CCC(=O)Cc1ccoc1 1458a_100000684892_100000210202 [0,2,0,0,0,0|1,1,0]=4 1606 B10R1.27 CCC(=O)Cc1ccsc1 1458a_100000184062_100000210202 [0,2,0,0,0,0|1,0,0]=3 1607 B10R1.27 CCC(=O)Cc1ccsc1 1458a_100000210414_100011233845 [0,2,0,0,0,0|1,0,0]=3 1608 B10R1.27 CCC(=O)Cc1cscn1 1458a_100000210414_100000205941 [0,2,0,0,0,0|2,0,0]=4 1609 B10R1.27 CCC(=O)Cc1cscn1 1458a_100011438297_100000210202 [0,2,0,0,0,0|2,0,0]=4 1610 B10R1.27 CCC(C)Oc1ccsc1 34a_100000106738_100011215416 [0,2,0,0,0,0|1,0,0]=3 1611 B10R1.27 CCC(C)Oc1ccsc1 7a_100000106738_100000758301 [0,2,0,0,0,0|1,0,0]=3 1612 B10R1.27 CCC(C)Sc1ccoc1 62a_100000758301_100011215275 [0,2,0,0,0,0|1,1,0]=4 1613 B10R1.27 CCC(C)Sc1ccoc1 62a_100011215275_100000758301 [0,2,0,0,0,0|1,1,0]=4 1614 B10R1.27 CCC(C)Sc1ccsc1 62a_100000738268_100000758301 [0,2,0,0,0,0|1,0,0]=3 1615 B10R1.27 CCC(C)Sc1ccsc1 62a_100000758301_100000738268 [0,2,0,0,0,0|1,0,0]=3 1616 B10R1.27 CCC(C)Sc1ccsn1 62a_100000758301_100009818082 [0,2,0,0,0,0|2,0,0]=4 1617 B10R1.27 CCC(C)Sc1ccsn1 62a_100009818082_100000758301 [0,2,0,0,0,0|2,0,0]=4 1618 B10R1.27 CCC(C)Sc1cnsc1 62a_100000758301_100009815736 [0,2,0,0,0,0|2,0,0]=4 1619 B10R1.27 CCC(C)Sc1cnsc1 62a_100009815736_100000758301 [0,2,0,0,0,0|2,0,0]=4 1620 B10R1.27 CCC(C)Sc1cscn1 62a_100000751502_100000758301 [0,2,0,0,0,0|2,0,0]=4 1621 B10R1.27 CCC(C)Sc1cscn1 62a_100000758301_100000751502 [0,2,0,0,0,0|2,0,0]=4 1622 B10R1.27 CCN(C)Cc1ccsc1 2230a_100000225621_100011261437 [0,2,0,0,0,0|1,0,0]=3 1623 B10R1.27 CCN(C)Cc1ccsc1 2230a_100020654213_100000210202 [0,2,0,0,0,0|1,0,0]=3 1624 B10R1.27 CCN(C)Cc1ccsc1 269982a_100000225621_100011233845 [0,2,0,0,0,0|1,0,0]=3 1625 B10R1.27 CCN(C)Cc1ccsc1 269982a_100020654213_100000204670 [0,2,0,0,0,0|1,0,0]=3 1626 B10R1.27 CCN(C)Cc1cscn1 2230a_100000225621_100000205941 [0,2,0,0,0,0|2,0,0]=4 1627 B10R1.27 CCN(C)Cc1cscn1 2230a_100000225794_100000210202 [0,2,0,0,0,0|2,0,0]=4 1628 B10R1.27 CCN(C)Cc1cscn1 269982a_100000225621_100000205941 [0,2,0,0,0,0|2,0,0]=4 1629 B10R1.27 CCN(C)Cc1cscn1 269982a_100000225794_100000204670 [0,2,0,0,0,0|2,0,0]=4 1630 B10R1.27 CN(CF)Cc1ccsc1 269982a_100020654213_100015361967 [0,2,0,0,0,0|1,0,0]=3 1631 B10R1.27 CN(CF)Cc1cscn1 269982a_100000225794_100015361967 [0,2,0,0,0,0|2,0,0]=4 1632 B10R1.27 CNC(=O)Cc1ccoc1 11a_106832991635_100000684892 [0,2,0,0,0,0|0,1,1]=4 1633 B10R1.27 CNC(=O)Cc1ccoc1 1626a_100102657272_100000684892 [0,2,0,0,0,0|0,1,1]=4 1634 B10R1.27 CNC(=O)Cc1ccoc1 240690a_100102657272_100000684892 [0,2,0,0,0,0|0,1,1]=4 1635 B10R1.27 CNC(=O)Cc1ccoc1 527a_100102657272_100000684892 [0,2,0,0,0,0|0,1,1]=4 1636 B10R1.27 CNC(=O)Cc1ccsc1 11a_106832991635_100000184062 [0,2,0,0,0,0|0,0,1]=3 1637 B10R1.27 CNC(=O)Cc1ccsc1 1626a_100102657272_100000184062 [0,2,0,0,0,0|0,0,1]=3 1638 B10R1.27 CNC(=O)Cc1ccsc1 240690a_100102657272_100000184062 [0,2,0,0,0,0|0,0,1]=3 1639 B10R1.27 CNC(=O)Cc1ccsc1 527a_100102657272_100000184062 [0,2,0,0,0,0|0,0,1]=3 1640 B10R1.27 CNC(=O)Cc1cscn1 11a_106832991635_100011438297 [0,2,0,0,0,0|1,0,1]=4 1641 B10R1.27 CNC(=O)Cc1cscn1 1626a_100102657272_100011438297 [0,2,0,0,0,0|1,0,1]=4 1642 B10R1.27 CNC(=O)Cc1cscn1 240690a_100102657272_100011438297 [0,2,0,0,0,0|1,0,1]=4 1643 B10R1.27 CNC(=O)Cc1cscn1 527a_100102657272_100011438297 [0,2,0,0,0,0|1,0,1]=4 1644 B10R1.27 CNC(C)Cc1ccco1 270004a_106832991635_100011216958 [0,2,0,0,0,0|2,0,0]=4 1645 B10R1.27 CNC(C)Cc1cccs1 2230a_100000751415_200000210301 [0,2,0,0,0,0|2,0,0]=4 1646 B10R1.27 CNC(C)Cc1ccsc1 2230a_100000743546_200000210301 [0,2,0,0,0,0|0,0,0]=2 1647 B10R1.27 CNC(C)Cc1ccsc1 34a_100000743546_200000210301 [0,2,0,0,0,0|0,0,0]=2 1648 B10R1.27 COC(C)Sc1ccsc1 62a_100000738268_100009879195 [0,2,0,0,0,0|2,0,0]=4 1649 B10R1.27 COC(C)Sc1ccsc1 62a_100009879195_100000738268 [0,2,0,0,0,0|2,0,0]=4 1650 B10R1.27 C[C@H](CO)Sc1ccoc1 62a_100011215275_100016084084 [0,2,0,0,0,0|1,1,0]=4 1651 B10R1.27 C[C@H](CO)Sc1ccoc1 62a_100016084084_100011215275 [0,2,0,0,0,0|1,1,0]=4 1652 B10R1.27 C[C@H](CO)Sc1ccsc1 62a_100000738268_100016084084 [0,2,0,0,0,0|1,0,0]=3 1653 B10R1.27 C[C@H](CO)Sc1ccsc1 62a_100016084084_100000738268 [0,2,0,0,0,0|1,0,0]=3 1654 B10R1.27 C[C@H](CO)Sc1ccsn1 62a_100009818082_100016084084 [0,2,0,0,0,0|2,0,0]=4 1655 B10R1.27 C[C@H](CO)Sc1ccsn1 62a_100016084084_100009818082 [0,2,0,0,0,0|2,0,0]=4 1656 B10R1.27 C[C@H](CO)Sc1cnsc1 62a_100009815736_100016084084 [0,2,0,0,0,0|2,0,0]=4 1657 B10R1.27 C[C@H](CO)Sc1cnsc1 62a_100016084084_100009815736 [0,2,0,0,0,0|2,0,0]=4 1658 B10R1.27 C[C@H](CO)Sc1cscn1 62a_100000751502_100016084084 [0,2,0,0,0,0|2,0,0]=4 1659 B10R1.27 C[C@H](CO)Sc1cscn1 62a_100016084084_100000751502 [0,2,0,0,0,0|2,0,0]=4 1660 B10R1.27 N#CC(F)Sc1ccsc1 62a_100000738268_200000117898 [0,2,0,0,0,0|0,0,2]=4 1661 B10R1.27 N#CC(F)Sc1ccsc1 62a_200000117898_100000738268 [0,2,0,0,0,0|0,0,2]=4 1662 B10R1.27 O=C(CF)Cc1ccoc1 1458a_100000684892_100015361967 [0,2,0,0,0,0|1,1,0]=4 1663 B10R1.27 O=C(CF)Cc1ccsc1 1458a_100000184062_100015361967 [0,2,0,0,0,0|1,0,0]=3 1664 B10R1.27 O=C(CF)Cc1cscn1 1458a_100011438297_100015361967 [0,2,0,0,0,0|2,0,0]=4 1665 B10R1.27 O=C(CO)Cc1ccsc1 1458a_100000210174_100011233845 [0,2,0,0,0,0|1,0,0]=3 1666 B10R1.27 O=C(CO)Cc1cscn1 1458a_100000210174_100000205941 [0,2,0,0,0,0|2,0,0]=4 1667 B10R1.29 C#CCSc1ccsc1C 62a_100000038162_100000684487 [0,2,0,0,0,0|1,0,1]=4 1668 B10R1.29 C#CCSc1cscc1Br 62a_100000038162_100010143727 [0,2,0,0,0,0|1,0,1]=4 1669 B10R1.29 C#CCSc1cscc1C 62a_100000038162_100000759966 [0,2,0,0,0,0|1,0,1]=4 1670 B10R1.29 C=CCSc1ccsc1C 62a_100000210623_100000684487 [0,2,0,0,0,0|1,0,1]=4 1671 B10R1.29 C=CCSc1ccsc1C 62a_100000684487_100000210623 [0,2,0,0,0,0|1,0,1]=4 1672 B10R1.29 C=CCSc1cscc1Br 62a_100000210623_100010143727 [0,2,0,0,0,0|1,0,1]=4 1673 B10R1.29 C=CCSc1cscc1Br 62a_100010143727_100000210623 [0,2,0,0,0,0|1,0,1]=4 1674 B10R1.29 C=CCSc1cscc1C 62a_100000210623_100000759966 [0,2,0,0,0,0|1,0,1]=4 1675 B10R1.29 C=CCSc1cscc1C 62a_100000759966_100000210623 [0,2,0,0,0,0|1,0,1]=4 1676 B10R1.29 CCCCc1ccsc1C 271570a_100020621405_100000684487 [0,2,0,0,0,0|1,0,0]=3 1677 B10R1.29 CCCCc1ccsc1O 271570a_203496583355_100010071534 [0,2,0,0,0,0|1,0,0]=3 1678 B10R1.29 CCCCc1cscc1Br 271570a_100020621405_100010143727 [0,2,0,0,0,0|1,0,0]=3 1679 B10R1.29 CCCCc1cscc1C 271570a_100020621405_100000759966 [0,2,0,0,0,0|1,0,0]=3 1680 B10R1.29 CCCCc1ncsc1C 271570a_100020621405_100000732656 [0,2,0,0,0,0|2,0,0]=4 1681 B10R1.29 CCCSc1ccsc1C 62a_100000210303_100000684487 [0,2,0,0,0,0|1,0,0]=3 1682 B10R1.29 CCCSc1ccsc1C 62a_100000684487_100000210303 [0,2,0,0,0,0|1,0,0]=3 1683 B10R1.29 CCCSc1cscc1Br 62a_100000210303_100010143727 [0,2,0,0,0,0|1,0,0]=3 1684 B10R1.29 CCCSc1cscc1Br 62a_100010143727_100000210303 [0,2,0,0,0,0|1,0,0]=3 1685 B10R1.29 CCCSc1cscc1C 62a_100000210303_100000759966 [0,2,0,0,0,0|1,0,0]=3 1686 B10R1.29 CCCSc1cscc1C 62a_100000759966_100000210303 [0,2,0,0,0,0|1,0,0]=3 1687 B10R1.29 CCCSc1ncsc1C 62a_100000210303_100000732656 [0,2,0,0,0,0|2,0,0]=4 1688 B10R1.29 CCCSc1ncsc1C 62a_100000732656_100000210303 [0,2,0,0,0,0|2,0,0]=4 1689 B10R1.29 CCNCc1ccsc1Br 207a_100015525214_100009816921 [0,2,0,0,0,0|1,0,0]=3 1690 B10R1.29 CCNCc1ccsc1Br 2230a_100000727803_100000210202 [0,2,0,0,0,0|1,0,0]=3 1691 B10R1.29 CCNCc1ccsc1Br 2230a_100015525214_100009814289 [0,2,0,0,0,0|1,0,0]=3 1692 B10R1.29 CCNCc1ccsc1Br 270004a_100015525214_100009816921 [0,2,0,0,0,0|1,0,0]=3 1693 B10R1.29 CCNCc1ccsc1Br 34a_100000727803_100000210202 [0,2,0,0,0,0|1,0,0]=3 1694 B10R1.29 CCNCc1ccsc1Cl 207a_100015525214_100000089901 [0,2,0,0,0,0|1,0,0]=3 1695 B10R1.29 CCNCc1ccsc1Cl 2230a_100015525214_100010167017 [0,2,0,0,0,0|1,0,0]=3 1696 B10R1.29 CCNCc1ccsc1Cl 270004a_100015525214_100000089901 [0,2,0,0,0,0|1,0,0]=3 1697 B10R1.29 CCNCc1cscc1Br 207a_100015525214_100000685484 [0,2,0,0,0,0|1,0,0]=3 1698 B10R1.29 CCNCc1cscc1Br 270004a_100015525214_100000685484 [0,2,0,0,0,0|1,0,0]=3 1699 B10R1.29 CCOCc1ccoc1C 34a_100011219433_100000210202 [0,2,0,0,0,0|1,1,0]=4 1700 B10R1.29 CCOCc1ccoc1C 7a_100011219433_100000210202 [0,2,0,0,0,0|1,1,0]=4 1701 B10R1.29 CCOCc1ccsc1Br 34a_100009816922_100000210202 [0,2,0,0,0,0|1,0,0]=3 1702 B10R1.29 CCOCc1ccsc1Br 34a_100121572206_100009814289 [0,2,0,0,0,0|1,0,0]=3 1703 B10R1.29 CCOCc1ccsc1Br 7a_100009816922_100000210202 [0,2,0,0,0,0|1,0,0]=3 1704 B10R1.29 CCOCc1ccsc1Cl 34a_100121572206_100010167017 [0,2,0,0,0,0|1,0,0]=3 1705 B10R1.29 CCOCc1cscc1Br 34a_100000724555_100000210202 [0,2,0,0,0,0|1,0,0]=3 1706 B10R1.29 CCSCc1ccsc1Br 62a_100000210202_100009814289 [0,2,0,0,0,0|1,0,0]=3 1707 B10R1.29 CCSCc1ccsc1Br 62a_100009814289_100000210202 [0,2,0,0,0,0|1,0,0]=3 1708 B10R1.29 CCSCc1ccsc1Cl 62a_100000210202_100010167017 [0,2,0,0,0,0|1,0,0]=3 1709 B10R1.29 CCSCc1ccsc1Cl 62a_100010167017_100000210202 [0,2,0,0,0,0|1,0,0]=3 1710 B10R1.29 CNCCc1cccn1C 2230a_100011251756_200000210301 [0,2,0,0,0,0|2,0,0]=4 1711 B10R1.29 CNCCc1cccn1C 34a_100011251756_200000210301 [0,2,0,0,0,0|2,0,0]=4 1712 B10R1.29 CNCCc1scnc1C 2230a_100000238517_200000210301 [0,2,0,0,0,0|2,0,0]=4 1713 B10R1.29 CNCCc1scnc1C 2230a_106832991635_100000057103 [0,2,0,0,0,0|2,0,0]=4 1714 B10R1.29 CNCCc1scnc1C 34a_100000238517_200000210301 [0,2,0,0,0,0|2,0,0]=4 1715 B10R1.29 CNCCc1scnc1C 34a_100102657272_100000057103 [0,2,0,0,0,0|2,0,0]=4 1716 B10R1.29 CNCCc1scnc1C 7a_106832991635_100000057103 [0,2,0,0,0,0|2,0,0]=4 1717 B10R1.29 CNCCn1ccnc1C 2230a_106832991635_100000742477 [0,2,0,0,0,0|2,0,0]=4 1718 B10R1.29 CNCCn1ccnc1C 34a_100015184736_200000210301 [0,2,0,0,0,0|2,0,0]=4 1719 B10R1.29 CNCCn1ccnc1C 7a_106832991635_100000742477 [0,2,0,0,0,0|2,0,0]=4 1720 B10R1.29 COCSc1ccsc1C 62a_100000684487_100000766300 [0,2,0,0,0,0|2,0,0]=4 1721 B10R1.29 COCSc1ccsc1C 62a_100000766300_100000684487 [0,2,0,0,0,0|2,0,0]=4 1722 B10R1.29 COCSc1cscc1Br 62a_100000766300_100010143727 [0,2,0,0,0,0|2,0,0]=4 1723 B10R1.29 COCSc1cscc1Br 62a_100010143727_100000766300 [0,2,0,0,0,0|2,0,0]=4 1724 B10R1.29 COCSc1cscc1C 62a_100000759966_100000766300 [0,2,0,0,0,0|2,0,0]=4 1725 B10R1.29 COCSc1cscc1C 62a_100000766300_100000759966 [0,2,0,0,0,0|2,0,0]=4 1726 B10R1.29 CSCSc1ccsc1C 62a_100000684487_100011218213 [0,2,0,0,0,0|2,0,0]=4 1727 B10R1.29 CSCSc1ccsc1C 62a_100011218213_100000684487 [0,2,0,0,0,0|2,0,0]=4 1728 B10R1.29 CSCSc1cscc1Br 62a_100010143727_100011218213 [0,2,0,0,0,0|2,0,0]=4 1729 B10R1.29 CSCSc1cscc1Br 62a_100011218213_100010143727 [0,2,0,0,0,0|2,0,0]=4 1730 B10R1.29 CSCSc1cscc1C 62a_100000759966_100011218213 [0,2,0,0,0,0|2,0,0]=4 1731 B10R1.29 CSCSc1cscc1C 62a_100011218213_100000759966 [0,2,0,0,0,0|2,0,0]=4 1732 B10R1.29 Cc1cscc1SCC#N 62a_100000759966_100011215382 [0,2,0,0,0,0|0,0,2]=4 1733 B10R1.29 Cc1cscc1SCC#N 62a_100011215382_100000759966 [0,2,0,0,0,0|0,0,2]=4 1734 B10R1.29 Cc1cscc1SCC=O 62a_100000759966_200015260668 [0,2,0,0,0,0|1,0,1]=4 1735 B10R1.29 Cc1cscc1SCC=O 62a_200015260668_100000759966 [0,2,0,0,0,0|1,0,1]=4 1736 B10R1.29 Cc1cscc1SCCF 62a_100000759966_100011217306 [0,2,0,0,0,0|1,0,0]=3 1737 B10R1.29 Cc1cscc1SCCF 62a_100011217306_100000759966 [0,2,0,0,0,0|1,0,0]=3 1738 B10R1.29 Cc1cscc1SCCO 62a_100000211926_100000759966 [0,2,0,0,0,0|1,0,0]=3 1739 B10R1.29 Cc1cscc1SCCO 62a_100000759966_100000211926 [0,2,0,0,0,0|1,0,0]=3 1740 B10R1.29 Cc1nccn1CCN[13CH3] 34a_100015184736_200025704644 [0,2,0,0,0,0|2,0,0]=4 1741 B10R1.29 Cc1ncsc1CCN[13CH3] 2230a_100000238517_200025704644 [0,2,0,0,0,0|2,0,0]=4 1742 B10R1.29 Cc1ncsc1CCN[13CH3] 34a_100000238517_200025704644 [0,2,0,0,0,0|2,0,0]=4 1743 B10R1.29 Cc1occc1COCF 34a_100011219433_100015361967 [0,2,0,0,0,0|1,1,0]=4 1744 B10R1.29 Cc1occc1COCF 7a_100011219433_100015361967 [0,2,0,0,0,0|1,1,0]=4 1745 B10R1.29 Cc1sccc1SCC#N 62a_100000684487_100011215382 [0,2,0,0,0,0|0,0,2]=4 1746 B10R1.29 Cc1sccc1SCC#N 62a_100011215382_100000684487 [0,2,0,0,0,0|0,0,2]=4 1747 B10R1.29 Cc1sccc1SCC=O 62a_100000684487_200015260668 [0,2,0,0,0,0|1,0,1]=4 1748 B10R1.29 Cc1sccc1SCC=O 62a_200015260668_100000684487 [0,2,0,0,0,0|1,0,1]=4 1749 B10R1.29 Cc1sccc1SCCF 62a_100000684487_100011217306 [0,2,0,0,0,0|1,0,0]=3 1750 B10R1.29 Cc1sccc1SCCF 62a_100011217306_100000684487 [0,2,0,0,0,0|1,0,0]=3 1751 B10R1.29 Cc1sccc1SCCO 62a_100000211926_100000684487 [0,2,0,0,0,0|1,0,0]=3 1752 B10R1.29 Cc1sccc1SCCO 62a_100000684487_100000211926 [0,2,0,0,0,0|1,0,0]=3 1753 B10R1.29 Cc1scnc1SCCF 62a_100000732656_100011217306 [0,2,0,0,0,0|2,0,0]=4 1754 B10R1.29 Cc1scnc1SCCF 62a_100011217306_100000732656 [0,2,0,0,0,0|2,0,0]=4 1755 B10R1.29 Cc1scnc1SCCO 62a_100000211926_100000732656 [0,2,0,0,0,0|2,0,0]=4 1756 B10R1.29 Cc1scnc1SCCO 62a_100000732656_100000211926 [0,2,0,0,0,0|2,0,0]=4 1757 B10R1.29 Cn1cccc1CCN[13CH3] 2230a_100011251756_200025704644 [0,2,0,0,0,0|2,0,0]=4 1758 B10R1.29 Cn1cccc1CCN[13CH3] 34a_100011251756_200025704644 [0,2,0,0,0,0|2,0,0]=4 1759 B10R1.29 FCCSc1cscc1Br 62a_100010143727_100011217306 [0,2,0,0,0,0|1,0,0]=3 1760 B10R1.29 FCCSc1cscc1Br 62a_100011217306_100010143727 [0,2,0,0,0,0|1,0,0]=3 1761 B10R1.29 FCNCc1ccsc1Br 34a_100000727803_100015361967 [0,2,0,0,0,0|1,0,0]=3 1762 B10R1.29 FCOCc1ccsc1Br 34a_100009816922_100015361967 [0,2,0,0,0,0|1,0,0]=3 1763 B10R1.29 FCOCc1ccsc1Br 7a_100009816922_100015361967 [0,2,0,0,0,0|1,0,0]=3 1764 B10R1.29 FCOCc1cscc1Br 34a_100000724555_100015361967 [0,2,0,0,0,0|1,0,0]=3 1765 B10R1.29 FCSCc1ccsc1Br 62a_100009814289_100015361967 [0,2,0,0,0,0|1,0,0]=3 1766 B10R1.29 FCSCc1ccsc1Br 62a_100015361967_100009814289 [0,2,0,0,0,0|1,0,0]=3 1767 B10R1.29 FCSCc1ccsc1Cl 62a_100010167017_100015361967 [0,2,0,0,0,0|1,0,0]=3 1768 B10R1.29 FCSCc1ccsc1Cl 62a_100015361967_100010167017 [0,2,0,0,0,0|1,0,0]=3 1769 B10R1.29 N#CCSc1cscc1Br 62a_100010143727_100011215382 [0,2,0,0,0,0|0,0,2]=4 1770 B10R1.29 N#CCSc1cscc1Br 62a_100011215382_100010143727 [0,2,0,0,0,0|0,0,2]=4 1771 B10R1.29 O=CCSc1cscc1Br 62a_100010143727_200015260668 [0,2,0,0,0,0|1,0,1]=4 1772 B10R1.29 O=CCSc1cscc1Br 62a_200015260668_100010143727 [0,2,0,0,0,0|1,0,1]=4 1773 B10R1.29 OCCSc1cscc1Br 62a_100000211926_100010143727 [0,2,0,0,0,0|1,0,0]=3 1774 B10R1.29 OCCSc1cscc1Br 62a_100010143727_100000211926 [0,2,0,0,0,0|1,0,0]=3 1775 B10R1.66 C=C(C)COc1ccsc1 34a_100000106738_100000748629 [0,2,0,0,0,0|1,0,1]=4 1776 B10R1.66 C=C(C)COc1ccsc1 7a_100000106738_100000748629 [0,2,0,0,0,0|1,0,1]=4 1777 B10R1.66 C=C(C)CSc1ccsc1 62a_100000738268_100000211660 [0,2,0,0,0,0|1,0,1]=4 1778 B10R1.66 C=C(C)CSc1ccsc1 62a_100000748629_100000738268 [0,2,0,0,0,0|1,0,1]=4 1779 B10R1.66 C=C(F)COc1ccsc1 34a_100000106738_100009893438 [0,2,0,0,0,0|1,0,1]=4 1780 B10R1.66 C=C(F)COc1ccsc1 7a_100000106738_100000042424 [0,2,0,0,0,0|1,0,1]=4 1781 B10R1.66 C=C(F)CSc1ccsc1 62a_100000042424_100000738268 [0,2,0,0,0,0|1,0,1]=4 1782 B10R1.66 C=C(F)CSc1ccsc1 62a_100000738268_100000042424 [0,2,0,0,0,0|1,0,1]=4 1783 B10R1.66 CC(=O)CCc1cc[nH]c1 1458a_200000093579_200000210301 [0,2,0,0,0,0|2,0,0]=4 1784 B10R1.66 CC(=O)CCc1ccsc1 1458a_100000195497_200000210301 [0,2,0,0,0,0|1,0,0]=3 1785 B10R1.66 CC(=O)NCc1ccsc1 11a_100000186416_100015343762 [0,2,0,0,0,0|1,0,1]=4 1786 B10R1.66 CC(=O)NCc1ccsc1 1626a_100000186416_100015343762 [0,2,0,0,0,0|1,0,1]=4 1787 B10R1.66 CC(=O)NCc1ccsc1 240690a_100000186416_100015343762 [0,2,0,0,0,0|1,0,1]=4 1788 B10R1.66 CC(=O)NCc1ccsc1 527a_100000186416_100103153847 [0,2,0,0,0,0|1,0,1]=4 1789 B10R1.66 CC(C)C=Cc1ccsc1 271570a_100016257149_100000738268 [0,2,0,0,0,0|1,0,1]=4 1790 B10R1.66 CC(C)COc1ccsc1 34a_100000106738_100000210624 [0,2,0,0,0,0|1,0,0]=3 1791 B10R1.66 CC(C)COc1ccsc1 7a_100000106738_100000210760 [0,2,0,0,0,0|1,0,0]=3 1792 B10R1.66 CC(C)CSc1ccoc1 62a_100000210624_100011215275 [0,2,0,0,0,0|1,1,0]=4 1793 B10R1.66 CC(C)CSc1ccoc1 62a_100011215275_100000210760 [0,2,0,0,0,0|1,1,0]=4 1794 B10R1.66 CC(C)CSc1ccsc1 62a_100000210624_100000738268 [0,2,0,0,0,0|1,0,0]=3 1795 B10R1.66 CC(C)CSc1ccsc1 62a_100000738268_100000210760 [0,2,0,0,0,0|1,0,0]=3 1796 B10R1.66 CC(C)CSc1ccsn1 62a_100000210624_100009818082 [0,2,0,0,0,0|2,0,0]=4 1797 B10R1.66 CC(C)CSc1ccsn1 62a_100009818082_100000210760 [0,2,0,0,0,0|2,0,0]=4 1798 B10R1.66 CC(C)CSc1cnsc1 62a_100000210624_100009815736 [0,2,0,0,0,0|2,0,0]=4 1799 B10R1.66 CC(C)CSc1cnsc1 62a_100009815736_100000210760 [0,2,0,0,0,0|2,0,0]=4 1800 B10R1.66 CC(C)CSc1cscn1 62a_100000210624_100000751502 [0,2,0,0,0,0|2,0,0]=4 1801 B10R1.66 CC(C)CSc1cscn1 62a_100000751502_100000210760 [0,2,0,0,0,0|2,0,0]=4 1802 B10R1.66 CC(C)NCc1ccoc1 207a_100138425928_100011215517 [0,2,0,0,0,0|1,1,0]=4 1803 B10R1.66 CC(C)NCc1ccoc1 2230a_100015206860_100000210206 [0,2,0,0,0,0|1,1,0]=4 1804 B10R1.66 CC(C)NCc1ccoc1 34a_100015206860_100000210206 [0,2,0,0,0,0|1,1,0]=4 1805 B10R1.66 CC(C)NCc1ccsc1 207a_100138425928_100000188534 [0,2,0,0,0,0|1,0,0]=3 1806 B10R1.66 CC(C)NCc1ccsc1 2230a_100000186416_100000210206 [0,2,0,0,0,0|1,0,0]=3 1807 B10R1.66 CC(C)NCc1ccsc1 2230a_100138425928_100011261437 [0,2,0,0,0,0|1,0,0]=3 1808 B10R1.66 CC(C)NCc1ccsc1 34a_100000186416_100000210206 [0,2,0,0,0,0|1,0,0]=3 1809 B10R1.66 CC(C)NCc1ccsc1 34a_100138425928_100011261437 [0,2,0,0,0,0|1,0,0]=3 1810 B10R1.66 CC(C)NCc1cscn1 207a_100138425928_100000743575 [0,2,0,0,0,0|2,0,0]=4 1811 B10R1.66 CC(C)NCc1cscn1 2230a_100015185402_100000210206 [0,2,0,0,0,0|2,0,0]=4 1812 B10R1.66 CC(C)NCc1cscn1 2230a_100138425928_100000205941 [0,2,0,0,0,0|2,0,0]=4 1813 B10R1.66 CC(C)NCc1cscn1 34a_100138425928_100000205941 [0,2,0,0,0,0|2,0,0]=4 1814 B10R1.66 CC(C)OCc1ccoc1 34a_100011215357_100000210206 [0,2,0,0,0,0|1,1,0]=4 1815 B10R1.66 CC(C)OCc1ccsc1 34a_100000212225_100011261437 [0,2,0,0,0,0|1,0,0]=3 1816 B10R1.66 CC(C)OCc1ccsc1 34a_100011215551_100000210206 [0,2,0,0,0,0|1,0,0]=3 1817 B10R1.66 CC(C)OCc1cscn1 34a_100000212225_100000205941 [0,2,0,0,0,0|2,0,0]=4 1818 B10R1.66 CC(C)SCc1ccsc1 62a_100000210206_100011233845 [0,2,0,0,0,0|1,0,0]=3 1819 B10R1.66 CC(C)SCc1ccsc1 62a_100011261437_100000210206 [0,2,0,0,0,0|1,0,0]=3 1820 B10R1.66 CC(C)SCc1cscn1 62a_100000205941_100000210206 [0,2,0,0,0,0|2,0,0]=4 1821 B10R1.66 CC(C)SCc1cscn1 62a_100000210206_100000205941 [0,2,0,0,0,0|2,0,0]=4 1822 B10R1.66 CC(O)C=Cc1ccsc1 271570a_200011019289_100000738268 [0,2,0,0,0,0|1,0,1]=4 1823 B10R1.66 CC(O)COc1ccsc1 34a_100000106738_100011218427 [0,2,0,0,0,0|1,0,0]=3 1824 B10R1.66 CC(O)COc1ccsc1 7a_100000106738_100011218427 [0,2,0,0,0,0|1,0,0]=3 1825 B10R1.66 CC(O)CSc1ccoc1 62a_100011215275_100011218427 [0,2,0,0,0,0|1,1,0]=4 1826 B10R1.66 CC(O)CSc1ccoc1 62a_100011218427_100011215275 [0,2,0,0,0,0|1,1,0]=4 1827 B10R1.66 CC(O)CSc1ccsc1 62a_100000738268_100011218427 [0,2,0,0,0,0|1,0,0]=3 1828 B10R1.66 CC(O)CSc1ccsc1 62a_100011218427_100000738268 [0,2,0,0,0,0|1,0,0]=3 1829 B10R1.66 CC(O)CSc1ccsn1 62a_100009818082_100011218427 [0,2,0,0,0,0|2,0,0]=4 1830 B10R1.66 CC(O)CSc1ccsn1 62a_100011218427_100009818082 [0,2,0,0,0,0|2,0,0]=4 1831 B10R1.66 CC(O)CSc1cnsc1 62a_100009815736_100011218427 [0,2,0,0,0,0|2,0,0]=4 1832 B10R1.66 CC(O)CSc1cnsc1 62a_100011218427_100009815736 [0,2,0,0,0,0|2,0,0]=4 1833 B10R1.66 CC(O)CSc1cscn1 62a_100000751502_100011218427 [0,2,0,0,0,0|2,0,0]=4 1834 B10R1.66 CC(O)CSc1cscn1 62a_100011218427_100000751502 [0,2,0,0,0,0|2,0,0]=4 1835 B10R1.66 CN(C)CCc1c[nH]cn1 2230a_100102631434_100020628418 [0,2,0,0,0,0|2,0,0]=4 1836 B10R1.66 CN(C)CCc1c[nH]cn1 269982a_100102631434_100020628418 [0,2,0,0,0,0|2,0,0]=4 1837 B10R1.66 CN(C)CCc1cccs1 2230a_100102631434_100000748579 [0,2,0,0,0,0|2,0,0]=4 1838 B10R1.66 CN(C)CCc1cccs1 269982a_100102631434_100000748579 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.66 CN(C)CCc1cn[nH]c1 2230a_100102631434_100000743252 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.66 CN(C)CCc1cn[nH]c1 269982a_100102631434_100000743252 [0,2,0,0,0,0|2,0,0]=4 1841 B10R1.66 CN(C)CCn1cccc1 2230a_100102631434_200009811947 [0,2,0,0,0,0|2,0,0]=4 1842 B10R1.66 CN(C)CCn1cccc1 269982a_100102631434_200000035178 [0,2,0,0,0,0|2,0,0]=4 1843 B10R1.66 CN(C)CCn1ccnc1 269982a_100102631434_100000702546 [0,2,0,0,0,0|2,0,0]=4 1844 B10R1.66 C[C@@H](O)COc1ccsc1 34a_100000106738_100009817552 [0,2,0,0,0,0|1,0,0]=3 1845 B10R1.66 C[C@@H](O)COc1ccsc1 7a_100000106738_100009817552 [0,2,0,0,0,0|1,0,0]=3 1846 B10R1.66 C[C@@H](O)CSc1ccoc1 62a_100009817552_100011215275 [0,2,0,0,0,0|1,1,0]=4 1847 B10R1.66 C[C@@H](O)CSc1ccoc1 62a_100011215275_100009817552 [0,2,0,0,0,0|1,1,0]=4 1848 B10R1.66 C[C@@H](O)CSc1ccsc1 62a_100000738268_100009817552 [0,2,0,0,0,0|1,0,0]=3 1849 B10R1.66 C[C@@H](O)CSc1ccsc1 62a_100009817552_100000738268 [0,2,0,0,0,0|1,0,0]=3 1850 B10R1.66 C[C@@H](O)CSc1ccsn1 62a_100009817552_100009818082 [0,2,0,0,0,0|2,0,0]=4 1851 B10R1.66 C[C@@H](O)CSc1ccsn1 62a_100009818082_100009817552 [0,2,0,0,0,0|2,0,0]=4 1852 B10R1.66 C[C@@H](O)CSc1cnsc1 62a_100009815736_100009817552 [0,2,0,0,0,0|2,0,0]=4 1853 B10R1.66 C[C@@H](O)CSc1cnsc1 62a_100009817552_100009815736 [0,2,0,0,0,0|2,0,0]=4 1854 B10R1.66 C[C@@H](O)CSc1cscn1 62a_100000751502_100009817552 [0,2,0,0,0,0|2,0,0]=4 1855 B10R1.66 C[C@@H](O)CSc1cscn1 62a_100009817552_100000751502 [0,2,0,0,0,0|2,0,0]=4 1856 B10R1.66 FC(F)COc1ccsc1 34a_100000106738_100011934356 [0,2,0,0,0,0|1,0,0]=3 1857 B10R1.66 FC(F)COc1ccsc1 7a_100000106738_100011934356 [0,2,0,0,0,0|1,0,0]=3 1858 B10R1.66 FC(F)CSc1ccoc1 62a_100011215275_100011934356 [0,2,0,0,0,0|1,1,0]=4 1859 B10R1.66 FC(F)CSc1ccoc1 62a_100011934356_100011215275 [0,2,0,0,0,0|1,1,0]=4 1860 B10R1.66 FC(F)CSc1ccsc1 62a_100000738268_100011934356 [0,2,0,0,0,0|1,0,0]=3 1861 B10R1.66 FC(F)CSc1ccsc1 62a_100011934356_100000738268 [0,2,0,0,0,0|1,0,0]=3 1862 B10R1.66 FC(F)CSc1ccsn1 62a_100009818082_100011934356 [0,2,0,0,0,0|2,0,0]=4 1863 B10R1.66 FC(F)CSc1ccsn1 62a_100011934356_100009818082 [0,2,0,0,0,0|2,0,0]=4 1864 B10R1.66 FC(F)CSc1cnsc1 62a_100009815736_100011934356 [0,2,0,0,0,0|2,0,0]=4 1865 B10R1.66 FC(F)CSc1cnsc1 62a_100011934356_100009815736 [0,2,0,0,0,0|2,0,0]=4 1866 B10R1.66 FC(F)CSc1cscn1 62a_100000751502_100011934356 [0,2,0,0,0,0|2,0,0]=4 1867 B10R1.66 FC(F)CSc1cscn1 62a_100011934356_100000751502 [0,2,0,0,0,0|2,0,0]=4 1868 B10R1.66 NC(=O)COc1ccsc1 34a_100000106738_100000187820 [0,2,0,0,0,0|0,0,1]=3 1869 B10R1.66 NC(=O)COc1ccsc1 7a_100000106738_100000187820 [0,2,0,0,0,0|0,0,1]=3 1870 B10R1.66 NC(=O)CSc1ccoc1 62a_100000747473_100011215275 [0,2,0,0,0,0|0,1,1]=4 1871 B10R1.66 NC(=O)CSc1ccoc1 62a_100011215275_100000747473 [0,2,0,0,0,0|0,1,1]=4 1872 B10R1.66 NC(=O)CSc1ccsc1 62a_100000738268_100000747473 [0,2,0,0,0,0|0,0,1]=3 1873 B10R1.66 NC(=O)CSc1ccsc1 62a_100000747473_100000738268 [0,2,0,0,0,0|0,0,1]=3 1874 B10R1.66 NC(=O)CSc1ccsn1 62a_100000747473_100009818082 [0,2,0,0,0,0|1,0,1]=4 1875 B10R1.66 NC(=O)CSc1ccsn1 62a_100009818082_100000747473 [0,2,0,0,0,0|1,0,1]=4 1876 B10R1.66 NC(=O)CSc1cnsc1 62a_100000747473_100009815736 [0,2,0,0,0,0|1,0,1]=4 1877 B10R1.66 NC(=O)CSc1cnsc1 62a_100009815736_100000747473 [0,2,0,0,0,0|1,0,1]=4 1878 B10R1.66 NC(=O)CSc1cscn1 62a_100000747473_100000751502 [0,2,0,0,0,0|1,0,1]=4 1879 B10R1.66 NC(=O)CSc1cscn1 62a_100000751502_100000747473 [0,2,0,0,0,0|1,0,1]=4 1880 B10R1.66 O=C([O-])COc1ccsc1 34a_100000106738_100020667443 [0,2,0,0,0,0|1,0,1]=4 1881 B10R1.66 O=C([O-])CSc1ccsc1 62a_100000738268_100020667443 [0,2,0,0,0,0|1,0,1]=4 1882 B10R1.66 O=C([O-])CSc1ccsc1 62a_100020667443_100000738268 [0,2,0,0,0,0|1,0,1]=4 1883 B10R1.66 O=[N+]([O-])COc1ccsc1 34a_100000106738_100000761209 [0,2,0,0,0,0|1,0,1]=4 1884 B10R1.66 O=[N+]([O-])CSc1ccsc1 62a_100000738268_100000761209 [0,2,0,0,0,0|1,0,1]=4 1885 B10R1.66 [13CH3]C(=O)CCc1cc[nH]c1 1458a_200000093579_200025704644 [0,2,0,0,0,0|2,0,0]=4 1886 B10R1.66 [13CH3]C(=O)CCc1ccsc1 1458a_100000195497_200025704644 [0,2,0,0,0,0|1,0,0]=3 1887 B10R1.64 CC(=O)Cc1ccsc1Br 1458a_100000070787_100009814289 [0,2,0,0,0,0|1,0,1]=4 1888 B10R1.64 CC(=O)Cc1ccsc1Cl 1458a_100000070787_100010167017 [0,2,0,0,0,0|1,0,1]=4 1889 B10R1.64 CC(C)Sc1cscc1Br 62a_100000210206_100010143727 [0,2,0,0,0,0|2,0,0]=4 1890 B10R1.64 CC(C)Sc1cscc1Br 62a_100010143727_100000210206 [0,2,0,0,0,0|2,0,0]=4 1891 B10R1.64 CN(C)Cc1ccsc1Br 2230a_100009817074_200000210301 [0,2,0,0,0,0|2,0,0]=4 1892 B10R1.64 CN(C)Cc1ccsc1Br 2230a_100102631434_100009814289 [0,2,0,0,0,0|2,0,0]=4 1893 B10R1.64 CN(C)Cc1ccsc1Br 269982a_100009817074_200000210301 [0,2,0,0,0,0|2,0,0]=4 1894 B10R1.64 CN(C)Cc1ccsc1Br 269982a_100102631434_100009814289 [0,2,0,0,0,0|2,0,0]=4 1895 B10R1.64 CN(C)Cc1ccsc1Br 270004a_100102631434_100009816921 [0,2,0,0,0,0|2,0,0]=4 1896 B10R1.64 CN(C)Cc1ccsc1Cl 2230a_100102631434_100010167017 [0,2,0,0,0,0|2,0,0]=4 1897 B10R1.64 CN(C)Cc1ccsc1Cl 269982a_100102631434_100010167017 [0,2,0,0,0,0|2,0,0]=4 1898 B10R1.64 CN(C)Cc1ccsc1Cl 270004a_100102631434_100000089901 [0,2,0,0,0,0|2,0,0]=4 1899 B10R1.64 CN(C)Cc1cscc1Br 2230a_100011935083_200000210301 [0,2,0,0,0,0|2,0,0]=4 1900 B10R1.64 CN(C)Cc1cscc1Br 269982a_100011935083_200000210301 [0,2,0,0,0,0|2,0,0]=4 1901 B10R1.64 CN(C)Cc1cscc1Br 270004a_100102631434_100000685484 [0,2,0,0,0,0|2,0,0]=4 1902 B10R1.64 CN([13CH3])Cc1ccsc1Br 2230a_100009817074_200025704644 [0,2,0,0,0,0|2,0,0]=4 1903 B10R1.64 CN([13CH3])Cc1ccsc1Br 269982a_100009817074_200025704644 [0,2,0,0,0,0|2,0,0]=4 1904 B10R1.64 CN([13CH3])Cc1cscc1Br 2230a_100011935083_200025704644 [0,2,0,0,0,0|2,0,0]=4 1905 B10R1.64 CN([13CH3])Cc1cscc1Br 269982a_100011935083_200025704644 [0,2,0,0,0,0|2,0,0]=4 1906 B10R1.64 Cc1cscc1SC(C)C 62a_100000210206_100000759966 [0,2,0,0,0,0|2,0,0]=4 1907 B10R1.64 Cc1cscc1SC(C)C 62a_100000759966_100000210206 [0,2,0,0,0,0|2,0,0]=4 1908 B10R1.64 Cc1sccc1SC(C)C 62a_100000210206_100000684487 [0,2,0,0,0,0|2,0,0]=4 1909 B10R1.64 Cc1sccc1SC(C)C 62a_100000684487_100000210206 [0,2,0,0,0,0|2,0,0]=4 1910 B10R1.281 CC(C)(C)Oc1ccsc1 34a_100000106738_100000210625 [0,2,0,0,0,0|2,0,0]=4 1911 B10R1.281 CC(C)(C)Sc1ccsc1 62a_100000211941_100000738268 [0,2,0,0,0,0|2,0,0]=4 1912 B10R1.281 CC(C)(C)Sc1ccsc1 62a_100000738268_100000211941 [0,2,0,0,0,0|2,0,0]=4 1913 B10R1.281 FC(F)(F)Oc1ccsc1 34a_100000106738_200103152311 [0,2,0,0,0,0|2,0,0]=4 1914 B10R1.281 FC(F)(F)Oc1ccsc1 7a_100000106738_200000243211 [0,2,0,0,0,0|2,0,0]=4 1915 B10R1.281 FC(F)(F)Sc1ccsc1 62a_100000738268_200103152311 [0,2,0,0,0,0|2,0,0]=4 1916 B10R1.281 FC(F)(F)Sc1ccsc1 62a_200000243211_100000738268 [0,2,0,0,0,0|2,0,0]=4 1917 B10R1.5 C=Cc1cscc1CNC 271570a_100011290941_100011935083 [0,2,0,0,0,0|2,0,0]=4 1918 B10R1.5 C=Cc1sccc1CNC 271570a_100011290941_100009817074 [0,2,0,0,0,0|2,0,0]=4 1919 B10R1.5 CCSc1ccsc1C#N 62a_100000210202_100011215142 [0,2,0,0,0,0|2,0,0]=4 1920 B10R1.5 CCSc1ccsc1C=O 62a_100000210202_100000766043 [0,2,0,0,0,0|2,0,0]=4 1921 B10R1.5 CCSc1ccsc1C=O 62a_100000766043_100000210202 [0,2,0,0,0,0|2,0,0]=4 1922 B10R1.5 CCSc1ccsc1CO 62a_100000210202_100000702026 [0,2,0,0,0,0|2,0,0]=4 1923 B10R1.5 CCSc1ccsc1CO 62a_100000702026_100000210202 [0,2,0,0,0,0|2,0,0]=4 1924 B10R1.5 CCSc1ccsc1SC 62a_100000210202_200010341309 [0,2,0,0,0,0|2,0,0]=4 1925 B10R1.5 CCSc1ccsc1SC 62a_200010341309_100000210202 [0,2,0,0,0,0|2,0,0]=4 1926 B10R1.5 CCSc1cscc1C#N 62a_100000210202_100011934119 [0,2,0,0,0,0|2,0,0]=4 1927 B10R1.5 CCSc1cscc1C=O 62a_100000210202_100000685484 [0,2,0,0,0,0|2,0,0]=4 1928 B10R1.5 CCSc1cscc1C=O 62a_100000685484_100000210202 [0,2,0,0,0,0|2,0,0]=4 1929 B10R1.5 CCSc1cscc1CC 62a_100000210202_100011068457 [0,2,0,0,0,0|2,0,0]=4 1930 B10R1.5 CCSc1cscc1CC 62a_100011068457_100000210202 [0,2,0,0,0,0|2,0,0]=4 1931 B10R1.5 CCSc1cscc1CO 62a_100000210202_100000724555 [0,2,0,0,0,0|2,0,0]=4 1932 B10R1.5 CCSc1cscc1CO 62a_100000724555_100000210202 [0,2,0,0,0,0|2,0,0]=4 1933 B10R1.5 CCc1cscc1SCF 62a_100011068457_100015361967 [0,2,0,0,0,0|2,0,0]=4 1934 B10R1.5 CCc1cscc1SCF 62a_100015361967_100011068457 [0,2,0,0,0,0|2,0,0]=4 1935 B10R1.5 CNCc1ccsc1SC 62a_100009817074_200000210301 [0,2,0,0,0,0|2,0,0]=4 1936 B10R1.5 CNCc1ccsc1SC 62a_200000210301_100009817074 [0,2,0,0,0,0|2,0,0]=4 1937 B10R1.5 CNCc1ccsc1S[13CH3] 62a_100009817074_200025704644 [0,2,0,0,0,0|2,0,0]=4 1938 B10R1.5 CNCc1ccsc1S[13CH3] 62a_200025704644_100009817074 [0,2,0,0,0,0|2,0,0]=4 1939 B10R1.5 CNCc1cscc1SC 62a_100011935083_200000210301 [0,2,0,0,0,0|2,0,0]=4 1940 B10R1.5 CNCc1cscc1SC 62a_200000210301_100011935083 [0,2,0,0,0,0|2,0,0]=4 1941 B10R1.5 CNCc1cscc1S[13CH3] 62a_100011935083_200025704644 [0,2,0,0,0,0|2,0,0]=4 1942 B10R1.5 CNCc1cscc1S[13CH3] 62a_200025704644_100011935083 [0,2,0,0,0,0|2,0,0]=4 1943 B10R1.5 CSc1sccc1SCF 62a_100015361967_200010341309 [0,2,0,0,0,0|2,0,0]=4 1944 B10R1.5 CSc1sccc1SCF 62a_200010341309_100015361967 [0,2,0,0,0,0|2,0,0]=4 1945 B10R1.5 N#Cc1cscc1SCF 62a_100015361967_100011934119 [0,2,0,0,0,0|2,0,0]=4 1946 B10R1.5 N#Cc1sccc1SCF 62a_100015361967_100011215142 [0,2,0,0,0,0|2,0,0]=4 1947 B10R1.5 O=Cc1cscc1SCF 62a_100000685484_100015361967 [0,2,0,0,0,0|2,0,0]=4 1948 B10R1.5 O=Cc1cscc1SCF 62a_100015361967_100000685484 [0,2,0,0,0,0|2,0,0]=4 1949 B10R1.5 O=Cc1sccc1SCF 62a_100000766043_100015361967 [0,2,0,0,0,0|2,0,0]=4 1950 B10R1.5 O=Cc1sccc1SCF 62a_100015361967_100000766043 [0,2,0,0,0,0|2,0,0]=4 1951 B10R1.5 OCc1cscc1SCF 62a_100000724555_100015361967 [0,2,0,0,0,0|2,0,0]=4 1952 B10R1.5 OCc1cscc1SCF 62a_100015361967_100000724555 [0,2,0,0,0,0|2,0,0]=4 1953 B10R1.5 OCc1sccc1SCF 62a_100000702026_100015361967 [0,2,0,0,0,0|2,0,0]=4 1954 B10R1.5 OCc1sccc1SCF 62a_100015361967_100000702026 [0,2,0,0,0,0|2,0,0]=4 1955 B10R2.6 c1cc(ccn1)C2CC2 271570a_100011220607_100000035832 [0,0,0,1,0,1|2,0,0]=4 1956 B10R2.6 c1cc(cnn1)C2CC2 271570a_100011220607_100000732662 [0,0,0,1,0,1|2,0,0]=4 1957 B10R2.6 c1cc(ncn1)C2CC2 271570a_100011220607_100000703185 [0,0,0,1,0,1|2,0,0]=4 1958 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [0,0,0,1,0,1|2,0,0]=4 1959 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [0,0,0,1,0,1|2,0,0]=4 1960 B10R2.6 c1cnc(cn1)C2CC2 271570a_100011220607_100000758340 [0,0,0,1,0,1|2,0,0]=4 1961 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [0,0,0,1,0,1|2,0,0]=4 1962 B10R2.6 c1ncc(cn1)C2CC2 271570a_100011220607_100011206942 [0,0,0,1,0,1|2,0,0]=4 1963 B10R2.14 Cc1cc(cs1)C2CC2 271570a_100011220607_100000759034 [0,1,0,1,0,0|1,0,0]=3 1964 B10R2.14 Cc1nc(cs1)C2CC2 271570a_100011220607_100011934587 [0,1,0,1,0,0|2,0,0]=4 1965 B10R2.14 Nc1nc(cs1)C2CC2 271570a_100011220607_100011998049 [0,1,0,1,0,0|2,0,0]=4 1966 B10R2.193 c1cc(co1)SC2CC2 62a_100011215275_100000211595 [0,1,0,1,0,0|1,1,0]=4 1967 B10R2.193 c1cc(cs1)OC2CC2 34a_100000106738_100000211595 [0,1,0,1,0,0|1,0,0]=3 1968 B10R2.193 c1cc(cs1)SC2CC2 62a_100000738268_100000211595 [0,1,0,1,0,0|1,0,0]=3 1969 B10R2.193 c1cc(ns1)SC2CC2 62a_100009818082_100000211595 [0,1,0,1,0,0|2,0,0]=4 1970 B10R2.193 c1nc(cs1)SC2CC2 62a_100000751502_100000211595 [0,1,0,1,0,0|2,0,0]=4 1971 B10R2.193 c1nscc1SC2CC2 62a_100009815736_100000211595 [0,1,0,1,0,0|2,0,0]=4 1972 B10R2.21 Brc1cscc1C2CC2 271570a_100011220607_100010143727 [0,1,0,1,0,0|1,0,0]=3 1973 B10R2.21 Cc1cscc1C2CC2 271570a_100011220607_100000759966 [0,1,0,1,0,0|1,0,0]=3 1974 B10R2.21 Cc1sccc1C2CC2 271570a_100011220607_100000684487 [0,1,0,1,0,0|1,0,0]=3 1975 B10R2.21 Cc1scnc1C2CC2 271570a_100011220607_100000732656 [0,1,0,1,0,0|2,0,0]=4 1976 B10R2.21 Oc1sccc1C2CC2 271570a_203496583355_100010071141 [0,1,0,1,0,0|1,0,0]=3