0 B8R1.8 C=C=Cc1cccs1 271570a_100015277604_100011215356 [0,0,0,0,0,0|2,0,2]=4 1 B8R1.8 C=C=Cc1ncc[nH]1 271570a_100015277604_100025796157 [0,0,0,0,0,0|2,0,2]=4 2 B8R1.8 C=C=Cc1ncco1 271570a_100015277604_100011787736 [0,0,0,0,0,0|1,1,2]=4 3 B8R1.8 C=C=Cc1nccs1 271570a_100015277604_100000211983 [0,0,0,0,0,0|1,0,2]=3 4 B8R1.8 C=C=Cc1ncns1 271570a_100015277604_100000693119 [0,0,0,0,0,0|2,0,2]=4 5 B8R1.8 C=C=Cc1nncs1 271570a_100015277604_100000739804 [0,0,0,0,0,0|2,0,2]=4 6 B8R1.8 CC=Cc1c[nH]cn1 271570a_100016259895_100000756875 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.8 CC=Cc1cc[nH]n1 271570a_100016259895_100000062575 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.8 CC=Cc1ccco1 271570a_100016259895_100009814098 [0,0,0,0,0,0|2,1,1]=4 9 B8R1.8 CC=Cc1cccs1 271570a_100016259895_100011215356 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.8 CC=Cc1ccsn1 271570a_100016259895_100009818082 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.8 CC=Cc1cncs1 271570a_100016259895_100011934649 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.8 CC=Cc1cscn1 271570a_100016259895_100000751502 [0,0,0,0,0,0|3,0,1]=4 13 B8R1.8 CC=Cc1nc[nH]n1 271570a_100016259895_100000761765 [0,0,0,0,0,0|3,0,1]=4 14 B8R1.8 CC=Cc1ncc[nH]1 271570a_100016259895_100025796157 [0,0,0,0,0,0|2,0,1]=3 15 B8R1.8 CC=Cc1ncco1 271570a_100016259895_100011787736 [0,0,0,0,0,0|1,1,1]=3 16 B8R1.8 CC=Cc1nccs1 271570a_100016259895_100000211983 [0,0,0,0,0,0|1,0,1]=2 17 B8R1.8 CC=Cc1ncns1 271570a_100016259895_100000693119 [0,0,0,0,0,0|2,0,1]=3 18 B8R1.8 CC=Cc1nncs1 271570a_100016259895_100000739804 [0,0,0,0,0,0|2,0,1]=3 19 B8R1.8 CCCN1CC=CC1 269982a_100015195280_100000210303 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.8 CCNC1CC=CC1 2230a_100015188752_100000210202 [0,0,0,0,0,0|3,0,1]=4 21 B8R1.8 CCNc1ncns1 27a_100015525214_100000693119 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.8 CCNc1nncs1 27a_100015525214_100000739804 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.8 CCOc1ccsc1 34a_100000106738_100000210202 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.8 CCOc1ccsc1 7a_100000106738_100000210202 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.8 CCSc1c[nH]cn1 62a_100000210202_100000756875 [0,0,0,0,0,0|2,1,0]=3 26 B8R1.8 CCSc1c[nH]cn1 62a_100000756875_100000210202 [0,0,0,0,0,0|2,1,0]=3 27 B8R1.8 CCSc1c[nH]nn1 62a_100000210202_100009819707 [0,0,0,0,0,0|3,1,0]=4 28 B8R1.8 CCSc1c[nH]nn1 62a_100009819707_100000210202 [0,0,0,0,0,0|3,1,0]=4 29 B8R1.8 CCSc1cc[nH]n1 62a_100000062575_100000210202 [0,0,0,0,0,0|2,1,0]=3 30 B8R1.8 CCSc1cc[nH]n1 62a_100000210202_100000062575 [0,0,0,0,0,0|2,1,0]=3 31 B8R1.8 CCSc1ccco1 62a_100000210202_100009814098 [0,0,0,0,0,0|1,2,0]=3 32 B8R1.8 CCSc1ccco1 62a_100009814098_100000210202 [0,0,0,0,0,0|1,2,0]=3 33 B8R1.8 CCSc1cccs1 62a_100000210202_100011215356 [0,0,0,0,0,0|1,1,0]=2 34 B8R1.8 CCSc1cccs1 62a_100011215356_100000210202 [0,0,0,0,0,0|1,1,0]=2 35 B8R1.8 CCSc1ccoc1 62a_100000210202_100011215275 [0,0,0,0,0,0|3,1,0]=4 36 B8R1.8 CCSc1ccoc1 62a_100011215275_100000210202 [0,0,0,0,0,0|3,1,0]=4 37 B8R1.8 CCSc1ccon1 62a_100000210202_100009818083 [0,0,0,0,0,0|2,1,0]=3 38 B8R1.8 CCSc1ccon1 62a_100009818083_100000210202 [0,0,0,0,0,0|2,1,0]=3 39 B8R1.8 CCSc1ccsc1 62a_100000210202_100000738268 [0,0,0,0,0,0|3,1,0]=4 40 B8R1.8 CCSc1ccsc1 62a_100000738268_100000210202 [0,0,0,0,0,0|3,1,0]=4 41 B8R1.8 CCSc1ccsn1 62a_100000210202_100009818082 [0,0,0,0,0,0|2,1,0]=3 42 B8R1.8 CCSc1ccsn1 62a_100009818082_100000210202 [0,0,0,0,0,0|2,1,0]=3 43 B8R1.8 CCSc1cnco1 62a_100000210202_100020591547 [0,0,0,0,0,0|2,2,0]=4 44 B8R1.8 CCSc1cnco1 62a_100020591547_100000210202 [0,0,0,0,0,0|2,2,0]=4 45 B8R1.8 CCSc1cncs1 62a_100000210202_100011934649 [0,0,0,0,0,0|2,1,0]=3 46 B8R1.8 CCSc1cncs1 62a_100011934649_100000210202 [0,0,0,0,0,0|2,1,0]=3 47 B8R1.8 CCSc1cscn1 62a_100000210202_100000751502 [0,0,0,0,0,0|2,1,0]=3 48 B8R1.8 CCSc1cscn1 62a_100000751502_100000210202 [0,0,0,0,0,0|2,1,0]=3 49 B8R1.8 CCSc1nc[nH]n1 62a_100000210202_100000761765 [0,0,0,0,0,0|2,1,0]=3 50 B8R1.8 CCSc1nc[nH]n1 62a_100000761765_100000210202 [0,0,0,0,0,0|2,1,0]=3 51 B8R1.8 CCSc1ncc[nH]1 62a_100000210202_100025796157 [0,0,0,0,0,0|1,1,0]=2 52 B8R1.8 CCSc1ncc[nH]1 62a_100025796157_100000210202 [0,0,0,0,0,0|1,1,0]=2 53 B8R1.8 CCSc1ncco1 62a_100000210202_100011787736 [0,0,0,0,0,0|0,2,0]=2 54 B8R1.8 CCSc1ncco1 62a_100011787736_100000210202 [0,0,0,0,0,0|0,2,0]=2 55 B8R1.8 CCSc1nccs1 62a_100000210202_100000211983 [0,0,0,0,0,0|0,1,0]=1 56 B8R1.8 CCSc1nccs1 62a_100000211983_100000210202 [0,0,0,0,0,0|0,1,0]=1 57 B8R1.8 CCSc1ncns1 62a_100000210202_100000693119 [0,0,0,0,0,0|1,1,0]=2 58 B8R1.8 CCSc1ncns1 62a_100000693119_100000210202 [0,0,0,0,0,0|1,1,0]=2 59 B8R1.8 CCSc1nncs1 62a_100000210202_100000739804 [0,0,0,0,0,0|1,1,0]=2 60 B8R1.8 CCSc1nncs1 62a_100000739804_100000210202 [0,0,0,0,0,0|1,1,0]=2 61 B8R1.8 CNCc1c[nH]cn1 2230a_106832991635_100000707719 [0,0,0,0,0,0|4,0,0]=4 62 B8R1.8 CNCc1c[nH]cn1 34a_100102657272_100000707719 [0,0,0,0,0,0|4,0,0]=4 63 B8R1.8 CNCc1cc[nH]n1 207a_100102657272_100000738523 [0,0,0,0,0,0|4,0,0]=4 64 B8R1.8 CNCc1cc[nH]n1 270004a_106832991635_100000738523 [0,0,0,0,0,0|4,0,0]=4 65 B8R1.8 CNCc1ccco1 207a_100102657272_100000186105 [0,0,0,0,0,0|3,1,0]=4 66 B8R1.8 CNCc1ccco1 2230a_100000185738_200000210301 [0,0,0,0,0,0|3,1,0]=4 67 B8R1.8 CNCc1ccco1 270004a_106832991635_100000186105 [0,0,0,0,0,0|3,1,0]=4 68 B8R1.8 CNCc1ccco1 34a_100000185738_200000210301 [0,0,0,0,0,0|3,1,0]=4 69 B8R1.8 CNCc1cccs1 207a_100102657272_100000209959 [0,0,0,0,0,0|3,0,0]=3 70 B8R1.8 CNCc1cccs1 2230a_100000211653_200000210301 [0,0,0,0,0,0|3,0,0]=3 71 B8R1.8 CNCc1cccs1 270004a_106832991635_100000209959 [0,0,0,0,0,0|3,0,0]=3 72 B8R1.8 CNCc1ccon1 2230a_106832991635_100000234950 [0,0,0,0,0,0|4,0,0]=4 73 B8R1.8 CNCc1ccon1 34a_100102657272_100000234950 [0,0,0,0,0,0|4,0,0]=4 74 B8R1.8 CNCc1ccon1 7a_106832991635_100000234950 [0,0,0,0,0,0|4,0,0]=4 75 B8R1.8 CNCc1cncs1 207a_100102657272_100000749870 [0,0,0,0,0,0|4,0,0]=4 76 B8R1.8 CNCc1cncs1 2230a_100016987365_200000210301 [0,0,0,0,0,0|4,0,0]=4 77 B8R1.8 CNCc1cncs1 2230a_106832991635_100015185245 [0,0,0,0,0,0|4,0,0]=4 78 B8R1.8 CNCc1cncs1 270004a_106832991635_100000749870 [0,0,0,0,0,0|4,0,0]=4 79 B8R1.8 CNCc1cncs1 34a_100102657272_100015185245 [0,0,0,0,0,0|4,0,0]=4 80 B8R1.8 CNCc1cncs1 7a_106832991635_100015185245 [0,0,0,0,0,0|4,0,0]=4 81 B8R1.8 CNCc1cocn1 270004a_106832991635_100000050382 [0,0,0,0,0,0|4,0,0]=4 82 B8R1.8 CNCc1cscn1 207a_100102657272_100000743575 [0,0,0,0,0,0|4,0,0]=4 83 B8R1.8 CNCc1cscn1 2230a_100015185402_200000210301 [0,0,0,0,0,0|4,0,0]=4 84 B8R1.8 CNCc1cscn1 2230a_106832991635_100000205941 [0,0,0,0,0,0|4,0,0]=4 85 B8R1.8 CNCc1cscn1 270004a_106832991635_100000743575 [0,0,0,0,0,0|4,0,0]=4 86 B8R1.8 CNCc1cscn1 34a_100102657272_100000205941 [0,0,0,0,0,0|4,0,0]=4 87 B8R1.8 CNCc1cscn1 7a_106832991635_100000205941 [0,0,0,0,0,0|4,0,0]=4 88 B8R1.8 CNCc1ncc[nH]1 207a_100102657272_100000743867 [0,0,0,0,0,0|3,0,0]=3 89 B8R1.8 CNCc1ncc[nH]1 2230a_106832991635_100016991755 [0,0,0,0,0,0|3,0,0]=3 90 B8R1.8 CNCc1ncc[nH]1 34a_100102657272_100016991755 [0,0,0,0,0,0|3,0,0]=3 91 B8R1.8 CNCc1ncc[nH]1 7a_106832991635_100000753453 [0,0,0,0,0,0|3,0,0]=3 92 B8R1.8 CNCc1ncco1 2230a_100016994969_200000210301 [0,0,0,0,0,0|2,1,0]=3 93 B8R1.8 CNCc1ncco1 2230a_106832991635_103436540062 [0,0,0,0,0,0|2,1,0]=3 94 B8R1.8 CNCc1ncco1 270004a_106832991635_100000064290 [0,0,0,0,0,0|2,1,0]=3 95 B8R1.8 CNCc1ncco1 34a_100102657272_103436540062 [0,0,0,0,0,0|2,1,0]=3 96 B8R1.8 CNCc1ncco1 7a_106832991635_103436540062 [0,0,0,0,0,0|2,1,0]=3 97 B8R1.8 CNCc1nccs1 207a_100102657272_100000750902 [0,0,0,0,0,0|2,0,0]=2 98 B8R1.8 CNCc1nccs1 2230a_100000740555_200000210301 [0,0,0,0,0,0|2,0,0]=2 99 B8R1.8 CNCc1nccs1 2230a_106832991635_100015184050 [0,0,0,0,0,0|2,0,0]=2 100 B8R1.8 CNCc1nccs1 270004a_106832991635_100000750902 [0,0,0,0,0,0|2,0,0]=2 101 B8R1.8 CNCc1nccs1 34a_100102657272_100015184050 [0,0,0,0,0,0|2,0,0]=2 102 B8R1.8 CNCc1nccs1 7a_106832991635_100015184050 [0,0,0,0,0,0|2,0,0]=2 103 B8R1.8 CNCc1ncon1 34a_100102657272_100000233494 [0,0,0,0,0,0|4,0,0]=4 104 B8R1.8 CNCc1nnc[nH]1 2230a_200015183720_200000210301 [0,0,0,0,0,0|4,0,0]=4 105 B8R1.8 COCc1c[nH]cn1 34a_100138415774_100000707719 [0,0,0,0,0,0|4,0,0]=4 106 B8R1.8 COCc1ccco1 34a_100000210059_200000210301 [0,0,0,0,0,0|3,1,0]=4 107 B8R1.8 COCc1cccs1 34a_100000211240_200000210301 [0,0,0,0,0,0|3,0,0]=3 108 B8R1.8 COCc1ccon1 34a_100138415774_100000234950 [0,0,0,0,0,0|4,0,0]=4 109 B8R1.8 COCc1cncs1 34a_100138415774_100015185245 [0,0,0,0,0,0|4,0,0]=4 110 B8R1.8 COCc1cscn1 34a_100138415774_100000205941 [0,0,0,0,0,0|4,0,0]=4 111 B8R1.8 COCc1ncc[nH]1 34a_100138415774_100016991755 [0,0,0,0,0,0|3,0,0]=3 112 B8R1.8 COCc1ncco1 34a_100000062594_200000210301 [0,0,0,0,0,0|2,1,0]=3 113 B8R1.8 COCc1ncco1 34a_100138415774_103436540062 [0,0,0,0,0,0|2,1,0]=3 114 B8R1.8 COCc1nccs1 34a_100138415774_100015184050 [0,0,0,0,0,0|2,0,0]=2 115 B8R1.8 COCc1ncon1 34a_100138415774_100000233494 [0,0,0,0,0,0|4,0,0]=4 116 B8R1.8 COCn1cccn1 34a_100000731028_200000210301 [0,0,0,0,0,0|4,0,0]=4 117 B8R1.8 CSCc1c[nH]cn1 62a_100000707719_200000210301 [0,0,0,0,0,0|4,0,0]=4 118 B8R1.8 CSCc1c[nH]cn1 62a_200000210301_100000707719 [0,0,0,0,0,0|4,0,0]=4 119 B8R1.8 CSCc1ccon1 62a_100000234950_200000210301 [0,0,0,0,0,0|4,0,0]=4 120 B8R1.8 CSCc1ccon1 62a_200000210301_100000234950 [0,0,0,0,0,0|4,0,0]=4 121 B8R1.8 CSCc1cncs1 62a_100015185245_200000210301 [0,0,0,0,0,0|4,0,0]=4 122 B8R1.8 CSCc1cncs1 62a_200000210301_100015185245 [0,0,0,0,0,0|4,0,0]=4 123 B8R1.8 CSCc1cscn1 62a_100000205941_200000210301 [0,0,0,0,0,0|4,0,0]=4 124 B8R1.8 CSCc1cscn1 62a_200000210301_100000205941 [0,0,0,0,0,0|4,0,0]=4 125 B8R1.8 CSCc1ncc[nH]1 62a_100016991755_200000210301 [0,0,0,0,0,0|3,0,0]=3 126 B8R1.8 CSCc1ncc[nH]1 62a_200000210301_100016991755 [0,0,0,0,0,0|3,0,0]=3 127 B8R1.8 CSCc1ncco1 62a_103436540062_200000210301 [0,0,0,0,0,0|2,1,0]=3 128 B8R1.8 CSCc1ncco1 62a_200000210301_103436540062 [0,0,0,0,0,0|2,1,0]=3 129 B8R1.8 CSCc1nccs1 62a_100015184050_200000210301 [0,0,0,0,0,0|2,0,0]=2 130 B8R1.8 CSCc1nccs1 62a_200000210301_100015184050 [0,0,0,0,0,0|2,0,0]=2 131 B8R1.8 CSCc1ncon1 62a_100000233494_200000210301 [0,0,0,0,0,0|4,0,0]=4 132 B8R1.8 CSCc1ncon1 62a_200000210301_100000233494 [0,0,0,0,0,0|4,0,0]=4 133 B8R1.8 FCOc1ccsc1 34a_100000106738_100015361967 [0,0,0,0,0,0|4,0,0]=4 134 B8R1.8 FCOc1ccsc1 7a_100000106738_100015361967 [0,0,0,0,0,0|4,0,0]=4 135 B8R1.8 FCSc1c[nH]cn1 62a_100000756875_100015361967 [0,0,0,0,0,0|3,1,0]=4 136 B8R1.8 FCSc1c[nH]cn1 62a_100015361967_100000756875 [0,0,0,0,0,0|3,1,0]=4 137 B8R1.8 FCSc1cc[nH]n1 62a_100000062575_100015361967 [0,0,0,0,0,0|3,1,0]=4 138 B8R1.8 FCSc1cc[nH]n1 62a_100015361967_100000062575 [0,0,0,0,0,0|3,1,0]=4 139 B8R1.8 FCSc1ccco1 62a_100009814098_100015361967 [0,0,0,0,0,0|2,2,0]=4 140 B8R1.8 FCSc1ccco1 62a_100015361967_100009814098 [0,0,0,0,0,0|2,2,0]=4 141 B8R1.8 FCSc1cccs1 62a_100011215356_100015361967 [0,0,0,0,0,0|2,1,0]=3 142 B8R1.8 FCSc1cccs1 62a_100015361967_100011215356 [0,0,0,0,0,0|2,1,0]=3 143 B8R1.8 FCSc1ccon1 62a_100009818083_100015361967 [0,0,0,0,0,0|3,1,0]=4 144 B8R1.8 FCSc1ccon1 62a_100015361967_100009818083 [0,0,0,0,0,0|3,1,0]=4 145 B8R1.8 FCSc1ccsn1 62a_100009818082_100015361967 [0,0,0,0,0,0|3,1,0]=4 146 B8R1.8 FCSc1ccsn1 62a_100015361967_100009818082 [0,0,0,0,0,0|3,1,0]=4 147 B8R1.8 FCSc1cncs1 62a_100011934649_100015361967 [0,0,0,0,0,0|3,1,0]=4 148 B8R1.8 FCSc1cncs1 62a_100015361967_100011934649 [0,0,0,0,0,0|3,1,0]=4 149 B8R1.8 FCSc1cscn1 62a_100000751502_100015361967 [0,0,0,0,0,0|3,1,0]=4 150 B8R1.8 FCSc1cscn1 62a_100015361967_100000751502 [0,0,0,0,0,0|3,1,0]=4 151 B8R1.8 FCSc1nc[nH]n1 62a_100000761765_100015361967 [0,0,0,0,0,0|3,1,0]=4 152 B8R1.8 FCSc1nc[nH]n1 62a_100015361967_100000761765 [0,0,0,0,0,0|3,1,0]=4 153 B8R1.8 FCSc1ncc[nH]1 62a_100015361967_100025796157 [0,0,0,0,0,0|2,1,0]=3 154 B8R1.8 FCSc1ncc[nH]1 62a_100025796157_100015361967 [0,0,0,0,0,0|2,1,0]=3 155 B8R1.8 FCSc1ncco1 62a_100011787736_100015361967 [0,0,0,0,0,0|1,2,0]=3 156 B8R1.8 FCSc1ncco1 62a_100015361967_100011787736 [0,0,0,0,0,0|1,2,0]=3 157 B8R1.8 FCSc1nccs1 62a_100000211983_100015361967 [0,0,0,0,0,0|1,1,0]=2 158 B8R1.8 FCSc1nccs1 62a_100015361967_100000211983 [0,0,0,0,0,0|1,1,0]=2 159 B8R1.8 FCSc1ncns1 62a_100000693119_100015361967 [0,0,0,0,0,0|2,1,0]=3 160 B8R1.8 FCSc1ncns1 62a_100015361967_100000693119 [0,0,0,0,0,0|2,1,0]=3 161 B8R1.8 FCSc1nncs1 62a_100000739804_100015361967 [0,0,0,0,0,0|2,1,0]=3 162 B8R1.8 FCSc1nncs1 62a_100015361967_100000739804 [0,0,0,0,0,0|2,1,0]=3 163 B8R1.8 [13CH3]NCc1ccco1 2230a_100000185738_200025704644 [0,0,0,0,0,0|3,1,0]=4 164 B8R1.8 [13CH3]NCc1ccco1 34a_100000185738_200025704644 [0,0,0,0,0,0|3,1,0]=4 165 B8R1.8 [13CH3]NCc1cccs1 2230a_100000211653_200025704644 [0,0,0,0,0,0|3,0,0]=3 166 B8R1.8 [13CH3]NCc1cncs1 2230a_100016987365_200025704644 [0,0,0,0,0,0|4,0,0]=4 167 B8R1.8 [13CH3]NCc1cscn1 2230a_100015185402_200025704644 [0,0,0,0,0,0|4,0,0]=4 168 B8R1.8 [13CH3]NCc1ncco1 2230a_100016994969_200025704644 [0,0,0,0,0,0|2,1,0]=3 169 B8R1.8 [13CH3]NCc1nccs1 2230a_100000740555_200025704644 [0,0,0,0,0,0|2,0,0]=2 170 B8R1.8 [13CH3]NCc1nnc[nH]1 2230a_200015183720_200025704644 [0,0,0,0,0,0|4,0,0]=4 171 B8R1.8 [13CH3]OCc1ccco1 34a_100000210059_200025704644 [0,0,0,0,0,0|3,1,0]=4 172 B8R1.8 [13CH3]OCc1cccs1 34a_100000211240_200025704644 [0,0,0,0,0,0|3,0,0]=3 173 B8R1.8 [13CH3]OCc1ncco1 34a_100000062594_200025704644 [0,0,0,0,0,0|2,1,0]=3 174 B8R1.8 [13CH3]OCn1cccn1 34a_100000731028_200025704644 [0,0,0,0,0,0|4,0,0]=4 175 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_100000707719_200025704644 [0,0,0,0,0,0|4,0,0]=4 176 B8R1.8 [13CH3]SCc1c[nH]cn1 62a_200025704644_100000707719 [0,0,0,0,0,0|4,0,0]=4 177 B8R1.8 [13CH3]SCc1ccon1 62a_100000234950_200025704644 [0,0,0,0,0,0|4,0,0]=4 178 B8R1.8 [13CH3]SCc1ccon1 62a_200025704644_100000234950 [0,0,0,0,0,0|4,0,0]=4 179 B8R1.8 [13CH3]SCc1cncs1 62a_100015185245_200025704644 [0,0,0,0,0,0|4,0,0]=4 180 B8R1.8 [13CH3]SCc1cncs1 62a_200025704644_100015185245 [0,0,0,0,0,0|4,0,0]=4 181 B8R1.8 [13CH3]SCc1cscn1 62a_100000205941_200025704644 [0,0,0,0,0,0|4,0,0]=4 182 B8R1.8 [13CH3]SCc1cscn1 62a_200025704644_100000205941 [0,0,0,0,0,0|4,0,0]=4 183 B8R1.8 [13CH3]SCc1ncc[nH]1 62a_100016991755_200025704644 [0,0,0,0,0,0|3,0,0]=3 184 B8R1.8 [13CH3]SCc1ncc[nH]1 62a_200025704644_100016991755 [0,0,0,0,0,0|3,0,0]=3 185 B8R1.8 [13CH3]SCc1ncco1 62a_103436540062_200025704644 [0,0,0,0,0,0|2,1,0]=3 186 B8R1.8 [13CH3]SCc1ncco1 62a_200025704644_103436540062 [0,0,0,0,0,0|2,1,0]=3 187 B8R1.8 [13CH3]SCc1nccs1 62a_100015184050_200025704644 [0,0,0,0,0,0|2,0,0]=2 188 B8R1.8 [13CH3]SCc1nccs1 62a_200025704644_100015184050 [0,0,0,0,0,0|2,0,0]=2 189 B8R1.8 [13CH3]SCc1ncon1 62a_100000233494_200025704644 [0,0,0,0,0,0|4,0,0]=4 190 B8R1.8 [13CH3]SCc1ncon1 62a_200025704644_100000233494 [0,0,0,0,0,0|4,0,0]=4 191 B7R1.1 C=Cc1cccs1 271570a_100011290941_100011215356 [1,0,0,0,0,0|1,0,2]=4 192 B7R1.1 C=Cc1ncc[nH]1 271570a_100011290941_100025796157 [1,0,0,0,0,0|1,0,2]=4 193 B7R1.1 C=Cc1ncco1 271570a_100011290941_100011787736 [1,0,0,0,0,0|0,1,2]=4 194 B7R1.1 C=Cc1nccs1 271570a_100011290941_100000211983 [1,0,0,0,0,0|0,0,2]=3 195 B7R1.1 C=Cc1ncns1 271570a_100011290941_100000693119 [1,0,0,0,0,0|1,0,2]=4 196 B7R1.1 C=Cc1nncs1 271570a_100011290941_100000739804 [1,0,0,0,0,0|1,0,2]=4 197 B7R1.1 CCN1CC=CC1 269982a_100015195280_100000204670 [1,0,0,0,0,0|3,0,0]=4 198 B7R1.1 CNc1ncns1 27a_100102657272_100000693119 [1,0,0,0,0,0|2,0,0]=3 199 B7R1.1 CNc1nncs1 27a_100102657272_100000739804 [1,0,0,0,0,0|2,0,0]=3 200 B7R1.1 COc1ccsc1 34a_100000106738_200000210301 [1,0,0,0,0,0|3,0,0]=4 201 B7R1.1 COc1ccsc1 7a_100000106738_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B7R1.1 CSc1c[nH]cn1 62a_100000756875_200000210301 [1,0,0,0,0,0|2,1,0]=4 203 B7R1.1 CSc1c[nH]cn1 62a_200000210301_100000756875 [1,0,0,0,0,0|2,1,0]=4 204 B7R1.1 CSc1cc[nH]n1 62a_100000062575_200000210301 [1,0,0,0,0,0|2,1,0]=4 205 B7R1.1 CSc1cc[nH]n1 62a_200000210301_100000062575 [1,0,0,0,0,0|2,1,0]=4 206 B7R1.1 CSc1ccco1 62a_100009814098_200000210301 [1,0,0,0,0,0|1,2,0]=4 207 B7R1.1 CSc1ccco1 62a_200000210301_100009814098 [1,0,0,0,0,0|1,2,0]=4 208 B7R1.1 CSc1cccs1 62a_100011215356_200000210301 [1,0,0,0,0,0|1,1,0]=3 209 B7R1.1 CSc1cccs1 62a_200000210301_100011215356 [1,0,0,0,0,0|1,1,0]=3 210 B7R1.1 CSc1ccon1 62a_100009818083_200000210301 [1,0,0,0,0,0|2,1,0]=4 211 B7R1.1 CSc1ccon1 62a_200000210301_100009818083 [1,0,0,0,0,0|2,1,0]=4 212 B7R1.1 CSc1ccsn1 62a_100009818082_200000210301 [1,0,0,0,0,0|2,1,0]=4 213 B7R1.1 CSc1ccsn1 62a_200000210301_100009818082 [1,0,0,0,0,0|2,1,0]=4 214 B7R1.1 CSc1cncs1 62a_100011934649_200000210301 [1,0,0,0,0,0|2,1,0]=4 215 B7R1.1 CSc1cncs1 62a_200000210301_100011934649 [1,0,0,0,0,0|2,1,0]=4 216 B7R1.1 CSc1cscn1 62a_100000751502_200000210301 [1,0,0,0,0,0|2,1,0]=4 217 B7R1.1 CSc1cscn1 62a_200000210301_100000751502 [1,0,0,0,0,0|2,1,0]=4 218 B7R1.1 CSc1nc[nH]n1 62a_100000761765_200000210301 [1,0,0,0,0,0|2,1,0]=4 219 B7R1.1 CSc1nc[nH]n1 62a_200000210301_100000761765 [1,0,0,0,0,0|2,1,0]=4 220 B7R1.1 CSc1ncc[nH]1 62a_100025796157_200000210301 [1,0,0,0,0,0|1,1,0]=3 221 B7R1.1 CSc1ncc[nH]1 62a_200000210301_100025796157 [1,0,0,0,0,0|1,1,0]=3 222 B7R1.1 CSc1ncco1 62a_100011787736_200000210301 [1,0,0,0,0,0|0,2,0]=3 223 B7R1.1 CSc1ncco1 62a_200000210301_100011787736 [1,0,0,0,0,0|0,2,0]=3 224 B7R1.1 CSc1nccs1 62a_100000211983_200000210301 [1,0,0,0,0,0|0,1,0]=2 225 B7R1.1 CSc1nccs1 62a_200000210301_100000211983 [1,0,0,0,0,0|0,1,0]=2 226 B7R1.1 CSc1ncns1 62a_100000693119_200000210301 [1,0,0,0,0,0|1,1,0]=3 227 B7R1.1 CSc1ncns1 62a_200000210301_100000693119 [1,0,0,0,0,0|1,1,0]=3 228 B7R1.1 CSc1nncs1 62a_100000739804_200000210301 [1,0,0,0,0,0|1,1,0]=3 229 B7R1.1 CSc1nncs1 62a_200000210301_100000739804 [1,0,0,0,0,0|1,1,0]=3 230 B7R1.1 [13CH3]Oc1ccsc1 34a_100000106738_200025704644 [1,0,0,0,0,0|3,0,0]=4 231 B7R1.1 [13CH3]Oc1ccsc1 7a_100000106738_200025704644 [1,0,0,0,0,0|3,0,0]=4 232 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_100000756875_200025704644 [1,0,0,0,0,0|2,1,0]=4 233 B7R1.1 [13CH3]Sc1c[nH]cn1 62a_200025704644_100000756875 [1,0,0,0,0,0|2,1,0]=4 234 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_100000062575_200025704644 [1,0,0,0,0,0|2,1,0]=4 235 B7R1.1 [13CH3]Sc1cc[nH]n1 62a_200025704644_100000062575 [1,0,0,0,0,0|2,1,0]=4 236 B7R1.1 [13CH3]Sc1ccco1 62a_100009814098_200025704644 [1,0,0,0,0,0|1,2,0]=4 237 B7R1.1 [13CH3]Sc1ccco1 62a_200025704644_100009814098 [1,0,0,0,0,0|1,2,0]=4 238 B7R1.1 [13CH3]Sc1cccs1 62a_100011215356_200025704644 [1,0,0,0,0,0|1,1,0]=3 239 B7R1.1 [13CH3]Sc1cccs1 62a_200025704644_100011215356 [1,0,0,0,0,0|1,1,0]=3 240 B7R1.1 [13CH3]Sc1ccon1 62a_100009818083_200025704644 [1,0,0,0,0,0|2,1,0]=4 241 B7R1.1 [13CH3]Sc1ccon1 62a_200025704644_100009818083 [1,0,0,0,0,0|2,1,0]=4 242 B7R1.1 [13CH3]Sc1ccsn1 62a_100009818082_200025704644 [1,0,0,0,0,0|2,1,0]=4 243 B7R1.1 [13CH3]Sc1ccsn1 62a_200025704644_100009818082 [1,0,0,0,0,0|2,1,0]=4 244 B7R1.1 [13CH3]Sc1cncs1 62a_100011934649_200025704644 [1,0,0,0,0,0|2,1,0]=4 245 B7R1.1 [13CH3]Sc1cncs1 62a_200025704644_100011934649 [1,0,0,0,0,0|2,1,0]=4 246 B7R1.1 [13CH3]Sc1cscn1 62a_100000751502_200025704644 [1,0,0,0,0,0|2,1,0]=4 247 B7R1.1 [13CH3]Sc1cscn1 62a_200025704644_100000751502 [1,0,0,0,0,0|2,1,0]=4 248 B7R1.1 [13CH3]Sc1nc[nH]n1 62a_100000761765_200025704644 [1,0,0,0,0,0|2,1,0]=4 249 B7R1.1 [13CH3]Sc1nc[nH]n1 62a_200025704644_100000761765 [1,0,0,0,0,0|2,1,0]=4 250 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_100025796157_200025704644 [1,0,0,0,0,0|1,1,0]=3 251 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_200025704644_100025796157 [1,0,0,0,0,0|1,1,0]=3 252 B7R1.1 [13CH3]Sc1ncco1 62a_100011787736_200025704644 [1,0,0,0,0,0|0,2,0]=3 253 B7R1.1 [13CH3]Sc1ncco1 62a_200025704644_100011787736 [1,0,0,0,0,0|0,2,0]=3 254 B7R1.1 [13CH3]Sc1nccs1 62a_100000211983_200025704644 [1,0,0,0,0,0|0,1,0]=2 255 B7R1.1 [13CH3]Sc1nccs1 62a_200025704644_100000211983 [1,0,0,0,0,0|0,1,0]=2 256 B7R1.1 [13CH3]Sc1ncns1 62a_100000693119_200025704644 [1,0,0,0,0,0|1,1,0]=3 257 B7R1.1 [13CH3]Sc1ncns1 62a_200025704644_100000693119 [1,0,0,0,0,0|1,1,0]=3 258 B7R1.1 [13CH3]Sc1nncs1 62a_100000739804_200025704644 [1,0,0,0,0,0|1,1,0]=3 259 B7R1.1 [13CH3]Sc1nncs1 62a_200025704644_100000739804 [1,0,0,0,0,0|1,1,0]=3 260 B9R1.7 C=C=Cc1nc(cs1)Br 271570a_100015277604_200016082925 [0,1,0,0,0,0|1,0,2]=4 261 B9R1.7 C=C=Cc1nc(cs1)C 271570a_100015277604_100011291629 [0,1,0,0,0,0|1,0,2]=4 262 B9R1.7 C=C=Cc1nc(cs1)N 271570a_100015277604_200015188442 [0,1,0,0,0,0|1,0,2]=4 263 B9R1.7 C=C=Cc1ncc(s1)C 271570a_100015277604_100000690809 [0,1,0,0,0,0|1,0,2]=4 264 B9R1.7 CC=Cc1cc(cs1)C 271570a_100016259895_100009876951 [0,1,0,0,0,0|2,0,1]=4 265 B9R1.7 CC=Cc1ccc(s1)Br 271570a_100016259895_100010197418 [0,1,0,0,0,0|2,0,1]=4 266 B9R1.7 CC=Cc1ccc(s1)C 271570a_100016259895_100000761539 [0,1,0,0,0,0|2,0,1]=4 267 B9R1.7 CC=Cc1nc(c[nH]1)C 271570a_100016259895_100161115468 [0,1,0,0,0,0|2,0,1]=4 268 B9R1.7 CC=Cc1nc(cs1)Br 271570a_100016259895_200016082925 [0,1,0,0,0,0|1,0,1]=3 269 B9R1.7 CC=Cc1nc(cs1)C 271570a_100016259895_100011291629 [0,1,0,0,0,0|1,0,1]=3 270 B9R1.7 CC=Cc1nc(cs1)N 271570a_100016259895_200015188442 [0,1,0,0,0,0|1,0,1]=3 271 B9R1.7 CC=Cc1nc(ns1)C 271570a_100016259895_100000709739 [0,1,0,0,0,0|2,0,1]=4 272 B9R1.7 CC=Cc1ncc(s1)C 271570a_100016259895_100000690809 [0,1,0,0,0,0|1,0,1]=3 273 B9R1.7 CC=Cc1nnc(s1)C 271570a_100016259895_100000686958 [0,1,0,0,0,0|2,0,1]=4 274 B9R1.7 CC=Cc1nnc(s1)N 271570a_100016259895_100000738278 [0,1,0,0,0,0|2,0,1]=4 275 B9R1.7 CCCc1ccc(s1)O 271570a_203496583355_100010157708 [0,1,0,0,0,0|2,0,0]=3 276 B9R1.7 CCCc1nc(no1)C 270196a_100000212224_100000211992 [0,1,0,0,0,0|2,1,0]=4 277 B9R1.7 CCCc1ncc([nH]1)O 271570a_203496583355_200009820212 [0,1,0,0,0,0|2,0,0]=3 278 B9R1.7 CCCc1noc(n1)C 270196a_100011193412_100000070787 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.7 CCCc1noc(n1)O 270196a_100011193412_100015183105 [0,1,0,0,0,0|3,0,0]=4 280 B9R1.7 CCCn1cc(cn1)O 271570a_203496583355_100011400188 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.7 CCCn1ccc(n1)O 271570a_203496583355_100012457951 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.7 CCNc1nc(ns1)C 27a_100015525214_100000709739 [0,1,0,0,0,0|2,0,0]=3 283 B9R1.7 CCNc1nnc(o1)C 27a_100015525214_100000708914 [0,1,0,0,0,0|2,1,0]=4 284 B9R1.7 CCNc1nnc(s1)C 27a_100015525214_100000686958 [0,1,0,0,0,0|2,0,0]=3 285 B9R1.7 CCNc1nnc(s1)N 27a_100015525214_100000738278 [0,1,0,0,0,0|2,0,0]=3 286 B9R1.7 CCNc1noc(n1)C 27a_100015525214_100012003639 [0,1,0,0,0,0|3,0,0]=4 287 B9R1.7 CCOc1ccn(n1)C 34a_100012642153_100000210202 [0,1,0,0,0,0|2,0,0]=3 288 B9R1.7 CCOc1cn(nn1)C 274090a_200000210301_100000036479 [0,1,0,0,0,0|3,0,0]=4 289 B9R1.7 CCOc1cn(nn1)[13CH3] 274090a_200025704644_100000036479 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.7 CCOc1nc(cs1)O 271570a_203496583355_100011934640 [0,1,0,0,0,0|0,0,0]=1 291 B9R1.7 CCSc1c[nH]c(n1)C 62a_100000210202_100009814057 [0,1,0,0,0,0|2,1,0]=4 292 B9R1.7 CCSc1c[nH]c(n1)C 62a_100009814057_100000210202 [0,1,0,0,0,0|2,1,0]=4 293 B9R1.7 CCSc1cc([nH]n1)C 62a_100000210202_100009819999 [0,1,0,0,0,0|2,1,0]=4 294 B9R1.7 CCSc1cc([nH]n1)C 62a_100009819999_100000210202 [0,1,0,0,0,0|2,1,0]=4 295 B9R1.7 CCSc1cc([nH]n1)N 62a_100000210202_100009822546 [0,1,0,0,0,0|2,1,0]=4 296 B9R1.7 CCSc1cc([nH]n1)N 62a_100009822546_100000210202 [0,1,0,0,0,0|2,1,0]=4 297 B9R1.7 CCSc1cc(cs1)C 62a_100000210202_100009876951 [0,1,0,0,0,0|1,1,0]=3 298 B9R1.7 CCSc1cc(cs1)C 62a_100009876951_100000210202 [0,1,0,0,0,0|1,1,0]=3 299 B9R1.7 CCSc1cc(ns1)C 62a_100000210202_100009815735 [0,1,0,0,0,0|2,1,0]=4 300 B9R1.7 CCSc1cc(ns1)C 62a_100009815735_100000210202 [0,1,0,0,0,0|2,1,0]=4 301 B9R1.7 CCSc1cc(on1)C 62a_100000210202_100000716708 [0,1,0,0,0,0|2,1,0]=4 302 B9R1.7 CCSc1cc(on1)C 62a_100000716708_100000210202 [0,1,0,0,0,0|2,1,0]=4 303 B9R1.7 CCSc1ccc(s1)Br 62a_100000210202_100010197418 [0,1,0,0,0,0|1,1,0]=3 304 B9R1.7 CCSc1ccc(s1)Br 62a_100010197418_100000210202 [0,1,0,0,0,0|1,1,0]=3 305 B9R1.7 CCSc1ccc(s1)C 62a_100000031368_100000210202 [0,1,0,0,0,0|1,1,0]=3 306 B9R1.7 CCSc1ccc(s1)C 62a_100000210202_100000031368 [0,1,0,0,0,0|1,1,0]=3 307 B9R1.7 CCSc1ccn(n1)C 62a_100000210202_100000752436 [0,1,0,0,0,0|2,1,0]=4 308 B9R1.7 CCSc1ccn(n1)C 62a_100000752436_100000210202 [0,1,0,0,0,0|2,1,0]=4 309 B9R1.7 CCSc1cn(cn1)C 62a_100000040308_100000210202 [0,1,0,0,0,0|2,1,0]=4 310 B9R1.7 CCSc1cn(cn1)C 62a_100000210202_100000040308 [0,1,0,0,0,0|2,1,0]=4 311 B9R1.7 CCSc1cnc(s1)Br 62a_100000210202_100012357534 [0,1,0,0,0,0|2,1,0]=4 312 B9R1.7 CCSc1cnc(s1)Br 62a_100012357534_100000210202 [0,1,0,0,0,0|2,1,0]=4 313 B9R1.7 CCSc1cnc(s1)C 62a_100000210202_100000764884 [0,1,0,0,0,0|2,1,0]=4 314 B9R1.7 CCSc1cnc(s1)C 62a_100000764884_100000210202 [0,1,0,0,0,0|2,1,0]=4 315 B9R1.7 CCSc1cnc(s1)N 62a_100000210202_100000718969 [0,1,0,0,0,0|2,1,0]=4 316 B9R1.7 CCSc1cnc(s1)N 62a_100000718969_100000210202 [0,1,0,0,0,0|2,1,0]=4 317 B9R1.7 CCSc1csc(n1)C 62a_100000210202_100011934587 [0,1,0,0,0,0|2,1,0]=4 318 B9R1.7 CCSc1csc(n1)C 62a_100011934587_100000210202 [0,1,0,0,0,0|2,1,0]=4 319 B9R1.7 CCSc1csc(n1)N 62a_100000210202_100011998049 [0,1,0,0,0,0|2,1,0]=4 320 B9R1.7 CCSc1csc(n1)N 62a_100011998049_100000210202 [0,1,0,0,0,0|2,1,0]=4 321 B9R1.7 CCSc1n[nH]c(n1)C 62a_100000210202_100000732540 [0,1,0,0,0,0|2,1,0]=4 322 B9R1.7 CCSc1n[nH]c(n1)C 62a_100000732540_100000210202 [0,1,0,0,0,0|2,1,0]=4 323 B9R1.7 CCSc1n[nH]c(n1)N 62a_100000210202_100015184587 [0,1,0,0,0,0|2,1,0]=4 324 B9R1.7 CCSc1n[nH]c(n1)N 62a_100015184587_100000210202 [0,1,0,0,0,0|2,1,0]=4 325 B9R1.7 CCSc1n[nH]c(n1)O 271570a_203496583355_100010173355 [0,1,0,0,0,0|2,1,0]=4 326 B9R1.7 CCSc1nc(c[nH]1)C 62a_100000210202_100161115468 [0,1,0,0,0,0|1,1,0]=3 327 B9R1.7 CCSc1nc(c[nH]1)C 62a_100161115468_100000210202 [0,1,0,0,0,0|1,1,0]=3 328 B9R1.7 CCSc1nc(cs1)Br 62a_100000210202_200016082925 [0,1,0,0,0,0|0,1,0]=2 329 B9R1.7 CCSc1nc(cs1)Br 62a_200016082925_100000210202 [0,1,0,0,0,0|0,1,0]=2 330 B9R1.7 CCSc1nc(cs1)C 62a_100000210202_100011291629 [0,1,0,0,0,0|0,1,0]=2 331 B9R1.7 CCSc1nc(cs1)C 62a_100011291629_100000210202 [0,1,0,0,0,0|0,1,0]=2 332 B9R1.7 CCSc1nc(cs1)N 62a_100000210202_200015188442 [0,1,0,0,0,0|0,1,0]=2 333 B9R1.7 CCSc1nc(cs1)N 62a_200015188442_100000210202 [0,1,0,0,0,0|0,1,0]=2 334 B9R1.7 CCSc1nc(ns1)C 62a_100000210202_100000709739 [0,1,0,0,0,0|1,1,0]=3 335 B9R1.7 CCSc1nc(ns1)C 62a_100000709739_100000210202 [0,1,0,0,0,0|1,1,0]=3 336 B9R1.7 CCSc1ncc(s1)C 62a_100000210202_100000690809 [0,1,0,0,0,0|0,1,0]=2 337 B9R1.7 CCSc1ncc(s1)C 62a_100000690809_100000210202 [0,1,0,0,0,0|0,1,0]=2 338 B9R1.7 CCSc1ncn(n1)C 62a_100000210202_100009819955 [0,1,0,0,0,0|2,1,0]=4 339 B9R1.7 CCSc1ncn(n1)C 62a_100009819955_100000210202 [0,1,0,0,0,0|2,1,0]=4 340 B9R1.7 CCSc1nnc(o1)C 62a_100000210202_100000708914 [0,1,0,0,0,0|1,2,0]=4 341 B9R1.7 CCSc1nnc(s1)C 62a_100000210202_100000686958 [0,1,0,0,0,0|1,1,0]=3 342 B9R1.7 CCSc1nnc(s1)C 62a_100000686958_100000210202 [0,1,0,0,0,0|1,1,0]=3 343 B9R1.7 CCSc1nnc(s1)N 62a_100000210202_100000738278 [0,1,0,0,0,0|1,1,0]=3 344 B9R1.7 CCSc1nnc(s1)N 62a_100000738278_100000210202 [0,1,0,0,0,0|1,1,0]=3 345 B9R1.7 CCSc1noc(n1)C 62a_100000210202_100012003639 [0,1,0,0,0,0|2,1,0]=4 346 B9R1.7 CCSc1noc(n1)C 62a_100012003639_100000210202 [0,1,0,0,0,0|2,1,0]=4 347 B9R1.7 CNCc1cc(cs1)Br 207a_100102657272_100000211722 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.7 CNCc1cc(cs1)Br 2230a_100000741024_200000210301 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.7 CNCc1cc(cs1)Br 2230a_106832991635_100000746031 [0,1,0,0,0,0|3,0,0]=4 350 B9R1.7 CNCc1cc(cs1)Br 270004a_106832991635_100000211722 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.7 CNCc1cc(cs1)Br 34a_100000741024_200000210301 [0,1,0,0,0,0|3,0,0]=4 352 B9R1.7 CNCc1cc(cs1)Br 34a_100102657272_100000746031 [0,1,0,0,0,0|3,0,0]=4 353 B9R1.7 CNCc1cc(cs1)Br 7a_106832991635_100000746031 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.7 CNCc1cc(cs1)C 207a_100102657272_100102525248 [0,1,0,0,0,0|3,0,0]=4 355 B9R1.7 CNCc1cc(cs1)C 2230a_100015204214_200000210301 [0,1,0,0,0,0|3,0,0]=4 356 B9R1.7 CNCc1cc(cs1)C 270004a_106832991635_100102525248 [0,1,0,0,0,0|3,0,0]=4 357 B9R1.7 CNCc1cc(cs1)C 34a_100015204214_200000210301 [0,1,0,0,0,0|3,0,0]=4 358 B9R1.7 CNCc1cc(cs1)Cl 207a_100102657272_100000102487 [0,1,0,0,0,0|3,0,0]=4 359 B9R1.7 CNCc1cc(cs1)Cl 270004a_106832991635_100000102487 [0,1,0,0,0,0|3,0,0]=4 360 B9R1.7 CNCc1cc(cs1)I 207a_100102657272_100010179861 [0,1,0,0,0,0|3,0,0]=4 361 B9R1.7 CNCc1cc(cs1)O 271570a_203496583355_100000207611 [0,1,0,0,0,0|3,0,0]=4 362 B9R1.7 CNCc1ccc(s1)Br 207a_100102657272_100000179771 [0,1,0,0,0,0|3,0,0]=4 363 B9R1.7 CNCc1ccc(s1)Br 2230a_106832991635_100000708592 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.7 CNCc1ccc(s1)Br 270004a_106832991635_100000179771 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.7 CNCc1ccc(s1)Br 34a_100102657272_100000708592 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.7 CNCc1ccc(s1)Br 7a_106832991635_100000708592 [0,1,0,0,0,0|3,0,0]=4 367 B9R1.7 CNCc1ccc(s1)C 207a_100102657272_100000211121 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.7 CNCc1ccc(s1)C 2230a_100000238518_200000210301 [0,1,0,0,0,0|3,0,0]=4 369 B9R1.7 CNCc1ccc(s1)C 270004a_106832991635_100000211121 [0,1,0,0,0,0|3,0,0]=4 370 B9R1.7 CNCc1ccc(s1)Cl 207a_100102657272_100000242774 [0,1,0,0,0,0|3,0,0]=4 371 B9R1.7 CNCc1ccc(s1)Cl 2230a_100000737310_200000210301 [0,1,0,0,0,0|3,0,0]=4 372 B9R1.7 CNCc1ccc(s1)Cl 2230a_106832991635_100000185097 [0,1,0,0,0,0|3,0,0]=4 373 B9R1.7 CNCc1ccc(s1)Cl 270004a_106832991635_100000242774 [0,1,0,0,0,0|3,0,0]=4 374 B9R1.7 CNCc1ccc(s1)Cl 34a_100102657272_100000185097 [0,1,0,0,0,0|3,0,0]=4 375 B9R1.7 CNCc1ccc(s1)Cl 7a_106832991635_100000185097 [0,1,0,0,0,0|3,0,0]=4 376 B9R1.7 CNCc1nc(c[nH]1)C 207a_100102657272_100000082322 [0,1,0,0,0,0|3,0,0]=4 377 B9R1.7 CNCc1nc(c[nH]1)C 270004a_106832991635_100000082322 [0,1,0,0,0,0|3,0,0]=4 378 B9R1.7 CNCc1nc(cs1)Br 270004a_106832991635_100009816814 [0,1,0,0,0,0|2,0,0]=3 379 B9R1.7 CNCc1nc(cs1)C 207a_100102657272_100000756994 [0,1,0,0,0,0|2,0,0]=3 380 B9R1.7 CNCc1nc(cs1)C 2230a_100015183719_200000210301 [0,1,0,0,0,0|2,0,0]=3 381 B9R1.7 CNCc1nc(cs1)C 270004a_106832991635_100000756994 [0,1,0,0,0,0|2,0,0]=3 382 B9R1.7 CNCc1ncc(o1)C 2230a_100138411809_200000210301 [0,1,0,0,0,0|2,1,0]=4 383 B9R1.7 CNCc1ncc(o1)C 34a_100138411809_200000210301 [0,1,0,0,0,0|2,1,0]=4 384 B9R1.7 CNCc1ncc(s1)Br 270004a_106832991635_100000699580 [0,1,0,0,0,0|2,0,0]=3 385 B9R1.7 CNCc1ncc(s1)C 207a_100102657272_100011361622 [0,1,0,0,0,0|2,0,0]=3 386 B9R1.7 CNCc1ncc(s1)C 270004a_106832991635_100011361622 [0,1,0,0,0,0|2,0,0]=3 387 B9R1.7 CNCc1ncc(s1)Cl 270004a_106832991635_100000699884 [0,1,0,0,0,0|2,0,0]=3 388 B9R1.7 CNCc1nnc(s1)C 2230a_106832991635_100000688753 [0,1,0,0,0,0|3,0,0]=4 389 B9R1.7 CNCc1nnc(s1)C 34a_100102657272_100000688753 [0,1,0,0,0,0|3,0,0]=4 390 B9R1.7 CNCc1nnc(s1)C 7a_106832991635_100000688753 [0,1,0,0,0,0|3,0,0]=4 391 B9R1.7 COCc1cc(cs1)Br 34a_100000238369_200000210301 [0,1,0,0,0,0|3,0,0]=4 392 B9R1.7 COCc1cc(cs1)Br 34a_100138415774_100000746031 [0,1,0,0,0,0|3,0,0]=4 393 B9R1.7 COCc1cc(cs1)Br 7a_100000238369_200000210301 [0,1,0,0,0,0|3,0,0]=4 394 B9R1.7 COCc1cc(cs1)C 34a_200000068372_200000210301 [0,1,0,0,0,0|3,0,0]=4 395 B9R1.7 COCc1cc(cs1)C 7a_200000068372_200000210301 [0,1,0,0,0,0|3,0,0]=4 396 B9R1.7 COCc1cc(cs1)O 271570a_203496583355_100011542528 [0,1,0,0,0,0|3,0,0]=4 397 B9R1.7 COCc1ccc(s1)Br 34a_100138415774_100000708592 [0,1,0,0,0,0|3,0,0]=4 398 B9R1.7 COCc1ccc(s1)C 34a_100000238367_200000210301 [0,1,0,0,0,0|3,0,0]=4 399 B9R1.7 COCc1ccc(s1)Cl 34a_100138415774_100000185097 [0,1,0,0,0,0|3,0,0]=4 400 B9R1.7 COCc1nc(cs1)Br 7a_100012000107_200000210301 [0,1,0,0,0,0|2,0,0]=3 401 B9R1.7 COCc1nnc(s1)C 34a_100138415774_100000688753 [0,1,0,0,0,0|3,0,0]=4 402 B9R1.7 COCc1nnc(s1)N 7a_100000691500_200000210301 [0,1,0,0,0,0|3,0,0]=4 403 B9R1.7 CSCc1cc(cs1)Br 62a_100000746031_200000210301 [0,1,0,0,0,0|3,0,0]=4 404 B9R1.7 CSCc1cc(cs1)Br 62a_200000210301_100000746031 [0,1,0,0,0,0|3,0,0]=4 405 B9R1.7 CSCc1ccc(s1)Br 62a_100000708592_200000210301 [0,1,0,0,0,0|3,0,0]=4 406 B9R1.7 CSCc1ccc(s1)Br 62a_200000210301_100000708592 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.7 CSCc1ccc(s1)Cl 62a_100000185097_200000210301 [0,1,0,0,0,0|3,0,0]=4 408 B9R1.7 CSCc1ccc(s1)Cl 62a_200000210301_100000185097 [0,1,0,0,0,0|3,0,0]=4 409 B9R1.7 CSCc1nnc(s1)C 62a_100000688753_200000210301 [0,1,0,0,0,0|3,0,0]=4 410 B9R1.7 CSCc1nnc(s1)C 62a_200000210301_100000688753 [0,1,0,0,0,0|3,0,0]=4 411 B9R1.7 Cc1c[nH]c(n1)SCF 62a_100015361967_100161115468 [0,1,0,0,0,0|2,1,0]=4 412 B9R1.7 Cc1c[nH]c(n1)SCF 62a_100161115468_100015361967 [0,1,0,0,0,0|2,1,0]=4 413 B9R1.7 Cc1ccc(s1)CN[13CH3] 2230a_100000238518_200025704644 [0,1,0,0,0,0|3,0,0]=4 414 B9R1.7 Cc1ccc(s1)CO[13CH3] 34a_100000238367_200025704644 [0,1,0,0,0,0|3,0,0]=4 415 B9R1.7 Cc1ccc(s1)SCF 62a_100000031368_100015361967 [0,1,0,0,0,0|2,1,0]=4 416 B9R1.7 Cc1ccc(s1)SCF 62a_100015361967_100000031368 [0,1,0,0,0,0|2,1,0]=4 417 B9R1.7 Cc1cnc(o1)CN[13CH3] 2230a_100138411809_200025704644 [0,1,0,0,0,0|2,1,0]=4 418 B9R1.7 Cc1cnc(o1)CN[13CH3] 34a_100138411809_200025704644 [0,1,0,0,0,0|2,1,0]=4 419 B9R1.7 Cc1cnc(s1)SCF 62a_100000690809_100015361967 [0,1,0,0,0,0|1,1,0]=3 420 B9R1.7 Cc1cnc(s1)SCF 62a_100015361967_100000690809 [0,1,0,0,0,0|1,1,0]=3 421 B9R1.7 Cc1csc(c1)CN[13CH3] 2230a_100015204214_200025704644 [0,1,0,0,0,0|3,0,0]=4 422 B9R1.7 Cc1csc(c1)CN[13CH3] 34a_100015204214_200025704644 [0,1,0,0,0,0|3,0,0]=4 423 B9R1.7 Cc1csc(c1)CO[13CH3] 34a_200000068372_200025704644 [0,1,0,0,0,0|3,0,0]=4 424 B9R1.7 Cc1csc(c1)CO[13CH3] 7a_200000068372_200025704644 [0,1,0,0,0,0|3,0,0]=4 425 B9R1.7 Cc1csc(c1)SCF 62a_100009876951_100015361967 [0,1,0,0,0,0|2,1,0]=4 426 B9R1.7 Cc1csc(c1)SCF 62a_100015361967_100009876951 [0,1,0,0,0,0|2,1,0]=4 427 B9R1.7 Cc1csc(n1)CN[13CH3] 2230a_100015183719_200025704644 [0,1,0,0,0,0|2,0,0]=3 428 B9R1.7 Cc1csc(n1)SCF 62a_100011291629_100015361967 [0,1,0,0,0,0|1,1,0]=3 429 B9R1.7 Cc1csc(n1)SCF 62a_100015361967_100011291629 [0,1,0,0,0,0|1,1,0]=3 430 B9R1.7 Cc1nnc(s1)CS[13CH3] 62a_100000688753_200025704644 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.7 Cc1nnc(s1)CS[13CH3] 62a_200025704644_100000688753 [0,1,0,0,0,0|3,0,0]=4 432 B9R1.7 Cc1nnc(s1)SCF 62a_100000686958_100015361967 [0,1,0,0,0,0|2,1,0]=4 433 B9R1.7 Cc1nnc(s1)SCF 62a_100015361967_100000686958 [0,1,0,0,0,0|2,1,0]=4 434 B9R1.7 Cc1nsc(n1)SCF 62a_100000709739_100015361967 [0,1,0,0,0,0|2,1,0]=4 435 B9R1.7 Cc1nsc(n1)SCF 62a_100015361967_100000709739 [0,1,0,0,0,0|2,1,0]=4 436 B9R1.7 Cn1ccc(n1)OCF 34a_100012642153_100015361967 [0,1,0,0,0,0|3,0,0]=4 437 B9R1.7 FCSc1ccc(s1)Br 62a_100010197418_100015361967 [0,1,0,0,0,0|2,1,0]=4 438 B9R1.7 FCSc1ccc(s1)Br 62a_100015361967_100010197418 [0,1,0,0,0,0|2,1,0]=4 439 B9R1.7 FCSc1nc(cs1)Br 62a_100015361967_200016082925 [0,1,0,0,0,0|1,1,0]=3 440 B9R1.7 FCSc1nc(cs1)Br 62a_200016082925_100015361967 [0,1,0,0,0,0|1,1,0]=3 441 B9R1.7 Nc1csc(n1)SCF 62a_100015361967_200015188442 [0,1,0,0,0,0|1,1,0]=3 442 B9R1.7 Nc1csc(n1)SCF 62a_200015188442_100015361967 [0,1,0,0,0,0|1,1,0]=3 443 B9R1.7 Nc1nnc(s1)SCF 62a_100000738278_100015361967 [0,1,0,0,0,0|2,1,0]=4 444 B9R1.7 Nc1nnc(s1)SCF 62a_100015361967_100000738278 [0,1,0,0,0,0|2,1,0]=4 445 B9R1.7 [13CH3]NCc1cc(cs1)Br 2230a_100000741024_200025704644 [0,1,0,0,0,0|3,0,0]=4 446 B9R1.7 [13CH3]NCc1cc(cs1)Br 34a_100000741024_200025704644 [0,1,0,0,0,0|3,0,0]=4 447 B9R1.7 [13CH3]NCc1ccc(s1)Cl 2230a_100000737310_200025704644 [0,1,0,0,0,0|3,0,0]=4 448 B9R1.7 [13CH3]OCc1cc(cs1)Br 34a_100000238369_200025704644 [0,1,0,0,0,0|3,0,0]=4 449 B9R1.7 [13CH3]OCc1cc(cs1)Br 7a_100000238369_200025704644 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.7 [13CH3]OCc1nc(cs1)Br 7a_100012000107_200025704644 [0,1,0,0,0,0|2,0,0]=3 451 B9R1.7 [13CH3]OCc1nnc(s1)N 7a_100000691500_200025704644 [0,1,0,0,0,0|3,0,0]=4 452 B9R1.7 [13CH3]SCc1cc(cs1)Br 62a_100000746031_200025704644 [0,1,0,0,0,0|3,0,0]=4 453 B9R1.7 [13CH3]SCc1cc(cs1)Br 62a_200025704644_100000746031 [0,1,0,0,0,0|3,0,0]=4 454 B9R1.7 [13CH3]SCc1ccc(s1)Br 62a_100000708592_200025704644 [0,1,0,0,0,0|3,0,0]=4 455 B9R1.7 [13CH3]SCc1ccc(s1)Br 62a_200025704644_100000708592 [0,1,0,0,0,0|3,0,0]=4 456 B9R1.7 [13CH3]SCc1ccc(s1)Cl 62a_100000185097_200025704644 [0,1,0,0,0,0|3,0,0]=4 457 B9R1.7 [13CH3]SCc1ccc(s1)Cl 62a_200025704644_100000185097 [0,1,0,0,0,0|3,0,0]=4 458 B9R1.11 CC(N[13CH3])c1cccs1 2230a_100000703493_200025704644 [0,1,0,0,0,0|3,0,0]=4 459 B9R1.11 CC(N[13CH3])c1nccs1 2230a_100000725601_200025704644 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.11 CC(O[13CH3])c1nccs1 7a_100000751044_200025704644 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.11 CNC(C)c1cccs1 2230a_100000703493_200000210301 [0,1,0,0,0,0|3,0,0]=4 462 B9R1.11 CNC(C)c1cccs1 269862a_106832991636_100000185736 [0,1,0,0,0,0|3,0,0]=4 463 B9R1.11 CNC(C)c1ncc[nH]1 269862a_106832991636_100000718901 [0,1,0,0,0,0|3,0,0]=4 464 B9R1.11 CNC(C)c1nccs1 2230a_100000725601_200000210301 [0,1,0,0,0,0|2,0,0]=3 465 B9R1.11 COC(C)c1nccs1 7a_100000751044_200000210301 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.11 CO[C@H](C)c1cccs1 7a_100000750433_200000210301 [0,1,0,0,0,0|3,0,0]=4 467 B9R1.11 C[C@@H](O[13CH3])c1cccs1 7a_100000750433_200025704644 [0,1,0,0,0,0|3,0,0]=4 468 B9R1.12 C#CCNc1ncns1 27a_100000212058_100000693119 [0,1,0,0,0,0|2,0,1]=4 469 B9R1.12 C#CCNc1nncs1 27a_100000212058_100000739804 [0,1,0,0,0,0|2,0,1]=4 470 B9R1.12 C#CCSc1cccs1 62a_100000038162_100011215356 [0,1,0,0,0,0|1,1,1]=4 471 B9R1.12 C#CCSc1ncc[nH]1 62a_100000038162_100025796157 [0,1,0,0,0,0|1,1,1]=4 472 B9R1.12 C#CCSc1ncco1 62a_100000038162_100011787736 [0,1,0,0,0,0|0,2,1]=4 473 B9R1.12 C#CCSc1nccs1 62a_100000038162_100000211983 [0,1,0,0,0,0|0,1,1]=3 474 B9R1.12 C#CCSc1ncns1 62a_100000038162_100000693119 [0,1,0,0,0,0|1,1,1]=4 475 B9R1.12 C#CCSc1nncs1 62a_100000038162_100000739804 [0,1,0,0,0,0|1,1,1]=4 476 B9R1.12 C=CCNc1ncns1 27a_100020586998_100000693119 [0,1,0,0,0,0|2,0,1]=4 477 B9R1.12 C=CCNc1nncs1 27a_100020586998_100000739804 [0,1,0,0,0,0|2,0,1]=4 478 B9R1.12 C=CCSc1cccs1 62a_100000210623_100011215356 [0,1,0,0,0,0|1,1,1]=4 479 B9R1.12 C=CCSc1cccs1 62a_100011215356_100000210623 [0,1,0,0,0,0|1,1,1]=4 480 B9R1.12 C=CCSc1ncc[nH]1 62a_100000210623_100025796157 [0,1,0,0,0,0|1,1,1]=4 481 B9R1.12 C=CCSc1ncc[nH]1 62a_100025796157_100000210623 [0,1,0,0,0,0|1,1,1]=4 482 B9R1.12 C=CCSc1ncco1 62a_100000210623_100011787736 [0,1,0,0,0,0|0,2,1]=4 483 B9R1.12 C=CCSc1ncco1 62a_100011787736_100000210623 [0,1,0,0,0,0|0,2,1]=4 484 B9R1.12 C=CCSc1nccs1 62a_100000210623_100000211983 [0,1,0,0,0,0|0,1,1]=3 485 B9R1.12 C=CCSc1nccs1 62a_100000211983_100000210623 [0,1,0,0,0,0|0,1,1]=3 486 B9R1.12 C=CCSc1ncns1 62a_100000210623_100000693119 [0,1,0,0,0,0|1,1,1]=4 487 B9R1.12 C=CCSc1ncns1 62a_100000693119_100000210623 [0,1,0,0,0,0|1,1,1]=4 488 B9R1.12 C=CCSc1nncs1 62a_100000210623_100000739804 [0,1,0,0,0,0|1,1,1]=4 489 B9R1.12 C=CCSc1nncs1 62a_100000739804_100000210623 [0,1,0,0,0,0|1,1,1]=4 490 B9R1.12 CC=NNc1nccs1 4a_100011198208_200000210099 [0,1,0,0,0,0|1,0,1]=3 491 B9R1.12 CCCCc1c[nH]cn1 271570a_100020621405_100000756875 [0,1,0,0,0,0|3,0,0]=4 492 B9R1.12 CCCCc1cc[nH]n1 271570a_100020621405_100000062575 [0,1,0,0,0,0|3,0,0]=4 493 B9R1.12 CCCCc1ccco1 271570a_100020621405_100009814098 [0,1,0,0,0,0|2,1,0]=4 494 B9R1.12 CCCCc1cccs1 271570a_100020621405_100011215356 [0,1,0,0,0,0|2,0,0]=3 495 B9R1.12 CCCCc1ccsn1 271570a_100020621405_100009818082 [0,1,0,0,0,0|3,0,0]=4 496 B9R1.12 CCCCc1cncs1 271570a_100020621405_100011934649 [0,1,0,0,0,0|3,0,0]=4 497 B9R1.12 CCCCc1cscn1 271570a_100020621405_100000751502 [0,1,0,0,0,0|3,0,0]=4 498 B9R1.12 CCCCc1nc[nH]n1 271570a_100020621405_100000761765 [0,1,0,0,0,0|3,0,0]=4 499 B9R1.12 CCCCc1ncc[nH]1 271570a_100020621405_100025796157 [0,1,0,0,0,0|2,0,0]=3 500 B9R1.12 CCCCc1ncco1 271570a_100020621405_100011787736 [0,1,0,0,0,0|1,1,0]=3 501 B9R1.12 CCCCc1nccs1 271570a_100020621405_100000211983 [0,1,0,0,0,0|1,0,0]=2 502 B9R1.12 CCCCc1ncns1 271570a_100020621405_100000693119 [0,1,0,0,0,0|2,0,0]=3 503 B9R1.12 CCCCc1nncs1 271570a_100020621405_100000739804 [0,1,0,0,0,0|2,0,0]=3 504 B9R1.12 CCCOc1ccsc1 34a_100000106738_100000210303 [0,1,0,0,0,0|3,0,0]=4 505 B9R1.12 CCCOc1ccsc1 7a_100000106738_100000210303 [0,1,0,0,0,0|3,0,0]=4 506 B9R1.12 CCCSc1c[nH]cn1 62a_100000210303_100000756875 [0,1,0,0,0,0|2,1,0]=4 507 B9R1.12 CCCSc1c[nH]cn1 62a_100000756875_100000210303 [0,1,0,0,0,0|2,1,0]=4 508 B9R1.12 CCCSc1cc[nH]n1 62a_100000062575_100000210303 [0,1,0,0,0,0|2,1,0]=4 509 B9R1.12 CCCSc1cc[nH]n1 62a_100000210303_100000062575 [0,1,0,0,0,0|2,1,0]=4 510 B9R1.12 CCCSc1ccco1 62a_100000210303_100009814098 [0,1,0,0,0,0|1,2,0]=4 511 B9R1.12 CCCSc1ccco1 62a_100009814098_100000210303 [0,1,0,0,0,0|1,2,0]=4 512 B9R1.12 CCCSc1cccs1 62a_100000210303_100011215356 [0,1,0,0,0,0|1,1,0]=3 513 B9R1.12 CCCSc1cccs1 62a_100011215356_100000210303 [0,1,0,0,0,0|1,1,0]=3 514 B9R1.12 CCCSc1ccon1 62a_100000210303_100009818083 [0,1,0,0,0,0|2,1,0]=4 515 B9R1.12 CCCSc1ccon1 62a_100009818083_100000210303 [0,1,0,0,0,0|2,1,0]=4 516 B9R1.12 CCCSc1ccsn1 62a_100000210303_100009818082 [0,1,0,0,0,0|2,1,0]=4 517 B9R1.12 CCCSc1ccsn1 62a_100009818082_100000210303 [0,1,0,0,0,0|2,1,0]=4 518 B9R1.12 CCCSc1cncs1 62a_100000210303_100011934649 [0,1,0,0,0,0|2,1,0]=4 519 B9R1.12 CCCSc1cncs1 62a_100011934649_100000210303 [0,1,0,0,0,0|2,1,0]=4 520 B9R1.12 CCCSc1cscn1 62a_100000210303_100000751502 [0,1,0,0,0,0|2,1,0]=4 521 B9R1.12 CCCSc1cscn1 62a_100000751502_100000210303 [0,1,0,0,0,0|2,1,0]=4 522 B9R1.12 CCCSc1nc[nH]n1 62a_100000210303_100000761765 [0,1,0,0,0,0|2,1,0]=4 523 B9R1.12 CCCSc1nc[nH]n1 62a_100000761765_100000210303 [0,1,0,0,0,0|2,1,0]=4 524 B9R1.12 CCCSc1ncc[nH]1 62a_100000210303_100025796157 [0,1,0,0,0,0|1,1,0]=3 525 B9R1.12 CCCSc1ncc[nH]1 62a_100025796157_100000210303 [0,1,0,0,0,0|1,1,0]=3 526 B9R1.12 CCCSc1ncco1 62a_100000210303_100011787736 [0,1,0,0,0,0|0,2,0]=3 527 B9R1.12 CCCSc1ncco1 62a_100011787736_100000210303 [0,1,0,0,0,0|0,2,0]=3 528 B9R1.12 CCCSc1nccs1 62a_100000210303_100000211983 [0,1,0,0,0,0|0,1,0]=2 529 B9R1.12 CCCSc1nccs1 62a_100000211983_100000210303 [0,1,0,0,0,0|0,1,0]=2 530 B9R1.12 CCCSc1ncns1 62a_100000210303_100000693119 [0,1,0,0,0,0|1,1,0]=3 531 B9R1.12 CCCSc1ncns1 62a_100000693119_100000210303 [0,1,0,0,0,0|1,1,0]=3 532 B9R1.12 CCCSc1nncs1 62a_100000210303_100000739804 [0,1,0,0,0,0|1,1,0]=3 533 B9R1.12 CCCSc1nncs1 62a_100000739804_100000210303 [0,1,0,0,0,0|1,1,0]=3 534 B9R1.12 CCNCc1c[nH]cn1 2230a_100015525214_100000707719 [0,1,0,0,0,0|3,0,0]=4 535 B9R1.12 CCNCc1cc[nH]n1 207a_100015525214_100000738523 [0,1,0,0,0,0|3,0,0]=4 536 B9R1.12 CCNCc1cc[nH]n1 270004a_100015525214_100000738523 [0,1,0,0,0,0|3,0,0]=4 537 B9R1.12 CCNCc1ccco1 207a_100015525214_100000186105 [0,1,0,0,0,0|2,1,0]=4 538 B9R1.12 CCNCc1ccco1 2230a_100000185738_100000210202 [0,1,0,0,0,0|2,1,0]=4 539 B9R1.12 CCNCc1ccco1 270004a_100015525214_100000186105 [0,1,0,0,0,0|2,1,0]=4 540 B9R1.12 CCNCc1ccco1 34a_100000185738_100000210202 [0,1,0,0,0,0|2,1,0]=4 541 B9R1.12 CCNCc1cccs1 207a_100015525214_100000209959 [0,1,0,0,0,0|2,0,0]=3 542 B9R1.12 CCNCc1cccs1 2230a_100000211653_100000210202 [0,1,0,0,0,0|2,0,0]=3 543 B9R1.12 CCNCc1cccs1 270004a_100015525214_100000209959 [0,1,0,0,0,0|2,0,0]=3 544 B9R1.12 CCNCc1ccon1 2230a_100015525214_100000234950 [0,1,0,0,0,0|3,0,0]=4 545 B9R1.12 CCNCc1cncs1 207a_100015525214_100000749870 [0,1,0,0,0,0|3,0,0]=4 546 B9R1.12 CCNCc1cncs1 2230a_100015525214_100015185245 [0,1,0,0,0,0|3,0,0]=4 547 B9R1.12 CCNCc1cncs1 2230a_100016987365_100000210202 [0,1,0,0,0,0|3,0,0]=4 548 B9R1.12 CCNCc1cncs1 270004a_100015525214_100000749870 [0,1,0,0,0,0|3,0,0]=4 549 B9R1.12 CCNCc1cocn1 270004a_100015525214_100000050382 [0,1,0,0,0,0|3,0,0]=4 550 B9R1.12 CCNCc1cscn1 207a_100015525214_100000743575 [0,1,0,0,0,0|3,0,0]=4 551 B9R1.12 CCNCc1cscn1 2230a_100015185402_100000210202 [0,1,0,0,0,0|3,0,0]=4 552 B9R1.12 CCNCc1cscn1 2230a_100015525214_100000205941 [0,1,0,0,0,0|3,0,0]=4 553 B9R1.12 CCNCc1cscn1 270004a_100015525214_100000743575 [0,1,0,0,0,0|3,0,0]=4 554 B9R1.12 CCNCc1ncc[nH]1 207a_100015525214_100000743867 [0,1,0,0,0,0|2,0,0]=3 555 B9R1.12 CCNCc1ncc[nH]1 2230a_100015525214_100016991755 [0,1,0,0,0,0|2,0,0]=3 556 B9R1.12 CCNCc1ncco1 2230a_100015525214_103436540062 [0,1,0,0,0,0|1,1,0]=3 557 B9R1.12 CCNCc1ncco1 2230a_100016994969_100000210202 [0,1,0,0,0,0|1,1,0]=3 558 B9R1.12 CCNCc1ncco1 270004a_100015525214_100000064290 [0,1,0,0,0,0|1,1,0]=3 559 B9R1.12 CCNCc1nccs1 207a_100015525214_100000750902 [0,1,0,0,0,0|1,0,0]=2 560 B9R1.12 CCNCc1nccs1 2230a_100000740555_100000210202 [0,1,0,0,0,0|1,0,0]=2 561 B9R1.12 CCNCc1nccs1 2230a_100015525214_100015184050 [0,1,0,0,0,0|1,0,0]=2 562 B9R1.12 CCNCc1nccs1 270004a_100015525214_100000750902 [0,1,0,0,0,0|1,0,0]=2 563 B9R1.12 CCNCc1nnc[nH]1 2230a_200015183720_100000210202 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.12 CCNN=C1CC=CC1 4a_100000756455_100000766571 [0,1,0,0,0,0|3,0,0]=4 565 B9R1.12 CCOCC1=NCCN1 34a_100121572206_100000737910 [0,1,0,0,0,0|1,0,2]=4 566 B9R1.12 CCOCC1CC=CC1 34a_100000688395_100000210202 [0,1,0,0,0,0|2,0,1]=4 567 B9R1.12 CCOCN1CC=CC1 269982a_100015195280_100000739092 [0,1,0,0,0,0|3,0,0]=4 568 B9R1.12 CCOCc1c[nH]cn1 34a_100121572206_100000707719 [0,1,0,0,0,0|2,0,0]=3 569 B9R1.12 CCOCc1ccco1 34a_100000210059_100000210202 [0,1,0,0,0,0|1,1,0]=3 570 B9R1.12 CCOCc1cccs1 34a_100000211240_100000210202 [0,1,0,0,0,0|1,0,0]=2 571 B9R1.12 CCOCc1ccn[nH]1 34a_100121572206_100000728653 [0,1,0,0,0,0|2,0,1]=4 572 B9R1.12 CCOCc1ccno1 34a_100000740478_100000210202 [0,1,0,0,0,0|2,1,0]=4 573 B9R1.12 CCOCc1ccoc1 34a_100011215357_100000210202 [0,1,0,0,0,0|3,0,0]=4 574 B9R1.12 CCOCc1ccon1 34a_100121572206_100000234950 [0,1,0,0,0,0|2,0,0]=3 575 B9R1.12 CCOCc1ccsc1 34a_100011215551_100000210202 [0,1,0,0,0,0|3,0,0]=4 576 B9R1.12 CCOCc1ccsc1 34a_100121572206_100011261437 [0,1,0,0,0,0|3,0,0]=4 577 B9R1.12 CCOCc1cncs1 34a_100121572206_100015185245 [0,1,0,0,0,0|2,0,0]=3 578 B9R1.12 CCOCc1cscn1 34a_100121572206_100000205941 [0,1,0,0,0,0|2,0,0]=3 579 B9R1.12 CCOCc1ncc[nH]1 34a_100121572206_100016991755 [0,1,0,0,0,0|1,0,0]=2 580 B9R1.12 CCOCc1ncco1 34a_100000062594_100000210202 [0,1,0,0,0,0|0,1,0]=2 581 B9R1.12 CCOCc1ncco1 34a_100121572206_103436540062 [0,1,0,0,0,0|0,1,0]=2 582 B9R1.12 CCOCc1nccs1 34a_100121572206_100015184050 [0,1,0,0,0,0|0,0,0]=1 583 B9R1.12 CCOCc1ncon1 34a_100121572206_100000233494 [0,1,0,0,0,0|2,0,0]=3 584 B9R1.12 CCOCc1nnn[nH]1 34a_100121572206_100000765167 [0,1,0,0,0,0|3,0,0]=4 585 B9R1.12 CCOCn1cccn1 34a_100000731028_100000210202 [0,1,0,0,0,0|2,0,0]=3 586 B9R1.12 CCOCn1cncn1 34a_100121572206_200020645497 [0,1,0,0,0,0|3,0,0]=4 587 B9R1.12 CCSCc1c[nH]cn1 62a_100000210202_100000707719 [0,1,0,0,0,0|2,1,0]=4 588 B9R1.12 CCSCc1c[nH]cn1 62a_100000707719_100000210202 [0,1,0,0,0,0|2,1,0]=4 589 B9R1.12 CCSCc1ccon1 62a_100000210202_100000234950 [0,1,0,0,0,0|2,1,0]=4 590 B9R1.12 CCSCc1ccon1 62a_100000234950_100000210202 [0,1,0,0,0,0|2,1,0]=4 591 B9R1.12 CCSCc1cncs1 62a_100000210202_100015185245 [0,1,0,0,0,0|2,1,0]=4 592 B9R1.12 CCSCc1cncs1 62a_100015185245_100000210202 [0,1,0,0,0,0|2,1,0]=4 593 B9R1.12 CCSCc1cscn1 62a_100000205941_100000210202 [0,1,0,0,0,0|2,1,0]=4 594 B9R1.12 CCSCc1cscn1 62a_100000210202_100000205941 [0,1,0,0,0,0|2,1,0]=4 595 B9R1.12 CCSCc1ncc[nH]1 62a_100000210202_100016991755 [0,1,0,0,0,0|1,1,0]=3 596 B9R1.12 CCSCc1ncc[nH]1 62a_100016991755_100000210202 [0,1,0,0,0,0|1,1,0]=3 597 B9R1.12 CCSCc1ncco1 62a_100000210202_103436540062 [0,1,0,0,0,0|0,2,0]=3 598 B9R1.12 CCSCc1ncco1 62a_103436540062_100000210202 [0,1,0,0,0,0|0,2,0]=3 599 B9R1.12 CCSCc1nccs1 62a_100000210202_100015184050 [0,1,0,0,0,0|0,1,0]=2 600 B9R1.12 CCSCc1nccs1 62a_100015184050_100000210202 [0,1,0,0,0,0|0,1,0]=2 601 B9R1.12 CCSCc1ncon1 62a_100000210202_100000233494 [0,1,0,0,0,0|2,1,0]=4 602 B9R1.12 CCSCc1ncon1 62a_100000233494_100000210202 [0,1,0,0,0,0|2,1,0]=4 603 B9R1.12 CNCCc1c[nH]cn1 2230a_106832991635_100020628418 [0,1,0,0,0,0|3,0,0]=4 604 B9R1.12 CNCCc1c[nH]cn1 7a_106832991635_100020628418 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.12 CNCCc1ccco1 2230a_100000694680_200000210301 [0,1,0,0,0,0|2,1,0]=4 606 B9R1.12 CNCCc1ccco1 34a_100000694680_200000210301 [0,1,0,0,0,0|2,1,0]=4 607 B9R1.12 CNCCc1cccs1 2230a_100000203755_200000210301 [0,1,0,0,0,0|2,0,0]=3 608 B9R1.12 CNCCc1cccs1 2230a_106832991635_100000748579 [0,1,0,0,0,0|2,0,0]=3 609 B9R1.12 CNCCc1cccs1 34a_100000203755_200000210301 [0,1,0,0,0,0|2,0,0]=3 610 B9R1.12 CNCCc1cccs1 34a_100102657272_100000748579 [0,1,0,0,0,0|2,0,0]=3 611 B9R1.12 CNCCc1cccs1 7a_106832991635_100000748579 [0,1,0,0,0,0|2,0,0]=3 612 B9R1.12 CNCCc1cncs1 2230a_100016991637_200000210301 [0,1,0,0,0,0|3,0,0]=4 613 B9R1.12 CNCCc1nccs1 2230a_100015186391_200000210301 [0,1,0,0,0,0|1,0,0]=2 614 B9R1.12 CNCCn1cccn1 2230a_100011200920_200000210301 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.12 CNCCn1cccn1 2230a_106832991635_100000685285 [0,1,0,0,0,0|3,0,0]=4 616 B9R1.12 CNCCn1cccn1 34a_100102657272_100015204718 [0,1,0,0,0,0|3,0,0]=4 617 B9R1.12 CNCCn1cccn1 7a_106832991635_100000685285 [0,1,0,0,0,0|3,0,0]=4 618 B9R1.12 COCCc1cccs1 34a_100011216825_200000210301 [0,1,0,0,0,0|2,0,0]=3 619 B9R1.12 COCCc1cccs1 34a_100138415774_100000748579 [0,1,0,0,0,0|2,0,0]=3 620 B9R1.12 COCCc1cccs1 7a_100011216825_200000210301 [0,1,0,0,0,0|2,0,0]=3 621 B9R1.12 COCCc1ncc[nH]1 34a_103549771195_200000210301 [0,1,0,0,0,0|2,0,0]=3 622 B9R1.12 COCCn1cccn1 34a_100000743371_200000210301 [0,1,0,0,0,0|3,0,0]=4 623 B9R1.12 COCCn1cccn1 34a_100138415774_100015204718 [0,1,0,0,0,0|3,0,0]=4 624 B9R1.12 COCSc1c[nH]cn1 62a_100000756875_100000766300 [0,1,0,0,0,0|2,1,0]=4 625 B9R1.12 COCSc1c[nH]cn1 62a_100000766300_100000756875 [0,1,0,0,0,0|2,1,0]=4 626 B9R1.12 COCSc1cc[nH]n1 62a_100000062575_100000766300 [0,1,0,0,0,0|2,1,0]=4 627 B9R1.12 COCSc1cc[nH]n1 62a_100000766300_100000062575 [0,1,0,0,0,0|2,1,0]=4 628 B9R1.12 COCSc1ccco1 62a_100000766300_100009814098 [0,1,0,0,0,0|1,2,0]=4 629 B9R1.12 COCSc1ccco1 62a_100009814098_100000766300 [0,1,0,0,0,0|1,2,0]=4 630 B9R1.12 COCSc1cccs1 62a_100000766300_100011215356 [0,1,0,0,0,0|1,1,0]=3 631 B9R1.12 COCSc1cccs1 62a_100011215356_100000766300 [0,1,0,0,0,0|1,1,0]=3 632 B9R1.12 COCSc1ccon1 62a_100000766300_100009818083 [0,1,0,0,0,0|2,1,0]=4 633 B9R1.12 COCSc1ccon1 62a_100009818083_100000766300 [0,1,0,0,0,0|2,1,0]=4 634 B9R1.12 COCSc1ccsn1 62a_100000766300_100009818082 [0,1,0,0,0,0|2,1,0]=4 635 B9R1.12 COCSc1ccsn1 62a_100009818082_100000766300 [0,1,0,0,0,0|2,1,0]=4 636 B9R1.12 COCSc1cncs1 62a_100000766300_100011934649 [0,1,0,0,0,0|2,1,0]=4 637 B9R1.12 COCSc1cncs1 62a_100011934649_100000766300 [0,1,0,0,0,0|2,1,0]=4 638 B9R1.12 COCSc1cscn1 62a_100000751502_100000766300 [0,1,0,0,0,0|2,1,0]=4 639 B9R1.12 COCSc1cscn1 62a_100000766300_100000751502 [0,1,0,0,0,0|2,1,0]=4 640 B9R1.12 COCSc1nc[nH]n1 62a_100000761765_100000766300 [0,1,0,0,0,0|2,1,0]=4 641 B9R1.12 COCSc1nc[nH]n1 62a_100000766300_100000761765 [0,1,0,0,0,0|2,1,0]=4 642 B9R1.12 COCSc1ncc[nH]1 62a_100000766300_100025796157 [0,1,0,0,0,0|1,1,0]=3 643 B9R1.12 COCSc1ncc[nH]1 62a_100025796157_100000766300 [0,1,0,0,0,0|1,1,0]=3 644 B9R1.12 COCSc1ncco1 62a_100000766300_100011787736 [0,1,0,0,0,0|0,2,0]=3 645 B9R1.12 COCSc1ncco1 62a_100011787736_100000766300 [0,1,0,0,0,0|0,2,0]=3 646 B9R1.12 COCSc1nccs1 62a_100000211983_100000766300 [0,1,0,0,0,0|0,1,0]=2 647 B9R1.12 COCSc1nccs1 62a_100000766300_100000211983 [0,1,0,0,0,0|0,1,0]=2 648 B9R1.12 COCSc1ncns1 62a_100000693119_100000766300 [0,1,0,0,0,0|1,1,0]=3 649 B9R1.12 COCSc1ncns1 62a_100000766300_100000693119 [0,1,0,0,0,0|1,1,0]=3 650 B9R1.12 COCSc1nncs1 62a_100000739804_100000766300 [0,1,0,0,0,0|1,1,0]=3 651 B9R1.12 COCSc1nncs1 62a_100000766300_100000739804 [0,1,0,0,0,0|1,1,0]=3 652 B9R1.12 CSCCc1c[nH]cn1 62a_100020628418_200000210301 [0,1,0,0,0,0|3,0,0]=4 653 B9R1.12 CSCCc1c[nH]cn1 62a_200000210301_100020628418 [0,1,0,0,0,0|3,0,0]=4 654 B9R1.12 CSCCc1cccs1 62a_100000748579_200000210301 [0,1,0,0,0,0|2,0,0]=3 655 B9R1.12 CSCCc1cccs1 62a_200000210301_100000748579 [0,1,0,0,0,0|2,0,0]=3 656 B9R1.12 CSCCn1cccn1 62a_100015204718_200000210301 [0,1,0,0,0,0|3,0,0]=4 657 B9R1.12 CSCCn1cccn1 62a_200000210301_100000685285 [0,1,0,0,0,0|3,0,0]=4 658 B9R1.12 CSCOc1ccsc1 34a_100000106738_100011218213 [0,1,0,0,0,0|3,0,0]=4 659 B9R1.12 CSCSc1c[nH]cn1 62a_100000756875_100011218213 [0,1,0,0,0,0|2,1,0]=4 660 B9R1.12 CSCSc1c[nH]cn1 62a_100011218213_100000756875 [0,1,0,0,0,0|2,1,0]=4 661 B9R1.12 CSCSc1cc[nH]n1 62a_100000062575_100011218213 [0,1,0,0,0,0|2,1,0]=4 662 B9R1.12 CSCSc1cc[nH]n1 62a_100011218213_100000062575 [0,1,0,0,0,0|2,1,0]=4 663 B9R1.12 CSCSc1ccco1 62a_100009814098_100011218213 [0,1,0,0,0,0|1,2,0]=4 664 B9R1.12 CSCSc1ccco1 62a_100011218213_100009814098 [0,1,0,0,0,0|1,2,0]=4 665 B9R1.12 CSCSc1cccs1 62a_100011215356_100011218213 [0,1,0,0,0,0|1,1,0]=3 666 B9R1.12 CSCSc1cccs1 62a_100011218213_100011215356 [0,1,0,0,0,0|1,1,0]=3 667 B9R1.12 CSCSc1ccon1 62a_100009818083_100011218213 [0,1,0,0,0,0|2,1,0]=4 668 B9R1.12 CSCSc1ccon1 62a_100011218213_100009818083 [0,1,0,0,0,0|2,1,0]=4 669 B9R1.12 CSCSc1ccsn1 62a_100009818082_100011218213 [0,1,0,0,0,0|2,1,0]=4 670 B9R1.12 CSCSc1ccsn1 62a_100011218213_100009818082 [0,1,0,0,0,0|2,1,0]=4 671 B9R1.12 CSCSc1cncs1 62a_100011218213_100011934649 [0,1,0,0,0,0|2,1,0]=4 672 B9R1.12 CSCSc1cncs1 62a_100011934649_100011218213 [0,1,0,0,0,0|2,1,0]=4 673 B9R1.12 CSCSc1cscn1 62a_100000751502_100011218213 [0,1,0,0,0,0|2,1,0]=4 674 B9R1.12 CSCSc1cscn1 62a_100011218213_100000751502 [0,1,0,0,0,0|2,1,0]=4 675 B9R1.12 CSCSc1nc[nH]n1 62a_100000761765_100011218213 [0,1,0,0,0,0|2,1,0]=4 676 B9R1.12 CSCSc1nc[nH]n1 62a_100011218213_100000761765 [0,1,0,0,0,0|2,1,0]=4 677 B9R1.12 CSCSc1ncc[nH]1 62a_100011218213_100025796157 [0,1,0,0,0,0|1,1,0]=3 678 B9R1.12 CSCSc1ncc[nH]1 62a_100025796157_100011218213 [0,1,0,0,0,0|1,1,0]=3 679 B9R1.12 CSCSc1ncco1 62a_100011218213_100011787736 [0,1,0,0,0,0|0,2,0]=3 680 B9R1.12 CSCSc1ncco1 62a_100011787736_100011218213 [0,1,0,0,0,0|0,2,0]=3 681 B9R1.12 CSCSc1nccs1 62a_100000211983_100011218213 [0,1,0,0,0,0|0,1,0]=2 682 B9R1.12 CSCSc1nccs1 62a_100011218213_100000211983 [0,1,0,0,0,0|0,1,0]=2 683 B9R1.12 CSCSc1ncns1 62a_100000693119_100011218213 [0,1,0,0,0,0|1,1,0]=3 684 B9R1.12 CSCSc1ncns1 62a_100011218213_100000693119 [0,1,0,0,0,0|1,1,0]=3 685 B9R1.12 CSCSc1nncs1 62a_100000739804_100011218213 [0,1,0,0,0,0|1,1,0]=3 686 B9R1.12 CSCSc1nncs1 62a_100011218213_100000739804 [0,1,0,0,0,0|1,1,0]=3 687 B9R1.12 FCCOc1ccsc1 34a_100000106738_100011217306 [0,1,0,0,0,0|3,0,0]=4 688 B9R1.12 FCCOc1ccsc1 7a_100000106738_100011217306 [0,1,0,0,0,0|3,0,0]=4 689 B9R1.12 FCCSc1c[nH]cn1 62a_100000756875_100011217306 [0,1,0,0,0,0|2,1,0]=4 690 B9R1.12 FCCSc1c[nH]cn1 62a_100011217306_100000756875 [0,1,0,0,0,0|2,1,0]=4 691 B9R1.12 FCCSc1cc[nH]n1 62a_100000062575_100011217306 [0,1,0,0,0,0|2,1,0]=4 692 B9R1.12 FCCSc1cc[nH]n1 62a_100011217306_100000062575 [0,1,0,0,0,0|2,1,0]=4 693 B9R1.12 FCCSc1ccco1 62a_100009814098_100011217306 [0,1,0,0,0,0|1,2,0]=4 694 B9R1.12 FCCSc1ccco1 62a_100011217306_100009814098 [0,1,0,0,0,0|1,2,0]=4 695 B9R1.12 FCCSc1cccs1 62a_100011215356_100011217306 [0,1,0,0,0,0|1,1,0]=3 696 B9R1.12 FCCSc1cccs1 62a_100011217306_100011215356 [0,1,0,0,0,0|1,1,0]=3 697 B9R1.12 FCCSc1ccon1 62a_100009818083_100011217306 [0,1,0,0,0,0|2,1,0]=4 698 B9R1.12 FCCSc1ccon1 62a_100011217306_100009818083 [0,1,0,0,0,0|2,1,0]=4 699 B9R1.12 FCCSc1ccsn1 62a_100009818082_100011217306 [0,1,0,0,0,0|2,1,0]=4 700 B9R1.12 FCCSc1ccsn1 62a_100011217306_100009818082 [0,1,0,0,0,0|2,1,0]=4 701 B9R1.12 FCCSc1cncs1 62a_100011217306_100011934649 [0,1,0,0,0,0|2,1,0]=4 702 B9R1.12 FCCSc1cncs1 62a_100011934649_100011217306 [0,1,0,0,0,0|2,1,0]=4 703 B9R1.12 FCCSc1cscn1 62a_100000751502_100011217306 [0,1,0,0,0,0|2,1,0]=4 704 B9R1.12 FCCSc1cscn1 62a_100011217306_100000751502 [0,1,0,0,0,0|2,1,0]=4 705 B9R1.12 FCCSc1nc[nH]n1 62a_100000761765_100011217306 [0,1,0,0,0,0|2,1,0]=4 706 B9R1.12 FCCSc1nc[nH]n1 62a_100011217306_100000761765 [0,1,0,0,0,0|2,1,0]=4 707 B9R1.12 FCCSc1ncc[nH]1 62a_100011217306_100025796157 [0,1,0,0,0,0|1,1,0]=3 708 B9R1.12 FCCSc1ncc[nH]1 62a_100025796157_100011217306 [0,1,0,0,0,0|1,1,0]=3 709 B9R1.12 FCCSc1ncco1 62a_100011217306_100011787736 [0,1,0,0,0,0|0,2,0]=3 710 B9R1.12 FCCSc1ncco1 62a_100011787736_100011217306 [0,1,0,0,0,0|0,2,0]=3 711 B9R1.12 FCCSc1nccs1 62a_100000211983_100011217306 [0,1,0,0,0,0|0,1,0]=2 712 B9R1.12 FCCSc1nccs1 62a_100011217306_100000211983 [0,1,0,0,0,0|0,1,0]=2 713 B9R1.12 FCCSc1ncns1 62a_100000693119_100011217306 [0,1,0,0,0,0|1,1,0]=3 714 B9R1.12 FCCSc1ncns1 62a_100011217306_100000693119 [0,1,0,0,0,0|1,1,0]=3 715 B9R1.12 FCCSc1nncs1 62a_100000739804_100011217306 [0,1,0,0,0,0|1,1,0]=3 716 B9R1.12 FCCSc1nncs1 62a_100011217306_100000739804 [0,1,0,0,0,0|1,1,0]=3 717 B9R1.12 FCOCc1ccco1 34a_100000210059_100015361967 [0,1,0,0,0,0|2,1,0]=4 718 B9R1.12 FCOCc1cccs1 34a_100000211240_100015361967 [0,1,0,0,0,0|2,0,0]=3 719 B9R1.12 FCOCc1ncco1 34a_100000062594_100015361967 [0,1,0,0,0,0|1,1,0]=3 720 B9R1.12 FCOCn1cccn1 34a_100000731028_100015361967 [0,1,0,0,0,0|3,0,0]=4 721 B9R1.12 FCSCc1ncc[nH]1 62a_100015361967_100016991755 [0,1,0,0,0,0|2,1,0]=4 722 B9R1.12 FCSCc1ncc[nH]1 62a_100016991755_100015361967 [0,1,0,0,0,0|2,1,0]=4 723 B9R1.12 FCSCc1ncco1 62a_100015361967_103436540062 [0,1,0,0,0,0|1,2,0]=4 724 B9R1.12 FCSCc1ncco1 62a_103436540062_100015361967 [0,1,0,0,0,0|1,2,0]=4 725 B9R1.12 FCSCc1nccs1 62a_100015184050_100015361967 [0,1,0,0,0,0|1,1,0]=3 726 B9R1.12 FCSCc1nccs1 62a_100015361967_100015184050 [0,1,0,0,0,0|1,1,0]=3 727 B9R1.12 N#CCSc1cccs1 62a_100011215356_100011215382 [0,1,0,0,0,0|1,1,1]=4 728 B9R1.12 N#CCSc1cccs1 62a_100011215382_100011215356 [0,1,0,0,0,0|1,1,1]=4 729 B9R1.12 N#CCSc1ncc[nH]1 62a_100011215382_100025796157 [0,1,0,0,0,0|1,1,1]=4 730 B9R1.12 N#CCSc1ncc[nH]1 62a_100025796157_100011215382 [0,1,0,0,0,0|1,1,1]=4 731 B9R1.12 N#CCSc1ncco1 62a_100011215382_100011787736 [0,1,0,0,0,0|0,2,1]=4 732 B9R1.12 N#CCSc1ncco1 62a_100011787736_100011215382 [0,1,0,0,0,0|0,2,1]=4 733 B9R1.12 N#CCSc1nccs1 62a_100000211983_100011215382 [0,1,0,0,0,0|0,1,1]=3 734 B9R1.12 N#CCSc1nccs1 62a_100011215382_100000211983 [0,1,0,0,0,0|0,1,1]=3 735 B9R1.12 N#CCSc1ncns1 62a_100000693119_100011215382 [0,1,0,0,0,0|1,1,1]=4 736 B9R1.12 N#CCSc1ncns1 62a_100011215382_100000693119 [0,1,0,0,0,0|1,1,1]=4 737 B9R1.12 N#CCSc1nncs1 62a_100000739804_100011215382 [0,1,0,0,0,0|1,1,1]=4 738 B9R1.12 N#CCSc1nncs1 62a_100011215382_100000739804 [0,1,0,0,0,0|1,1,1]=4 739 B9R1.12 O=CCSc1cccs1 62a_100011215356_200015260668 [0,1,0,0,0,0|1,1,1]=4 740 B9R1.12 O=CCSc1cccs1 62a_200015260668_100011215356 [0,1,0,0,0,0|1,1,1]=4 741 B9R1.12 O=CCSc1ncc[nH]1 62a_100025796157_200015260668 [0,1,0,0,0,0|1,1,1]=4 742 B9R1.12 O=CCSc1ncc[nH]1 62a_200015260668_100025796157 [0,1,0,0,0,0|1,1,1]=4 743 B9R1.12 O=CCSc1ncco1 62a_100011787736_200015260668 [0,1,0,0,0,0|0,2,1]=4 744 B9R1.12 O=CCSc1ncco1 62a_200015260668_100011787736 [0,1,0,0,0,0|0,2,1]=4 745 B9R1.12 O=CCSc1nccs1 62a_100000211983_200015260668 [0,1,0,0,0,0|0,1,1]=3 746 B9R1.12 O=CCSc1nccs1 62a_200015260668_100000211983 [0,1,0,0,0,0|0,1,1]=3 747 B9R1.12 O=CCSc1ncns1 62a_100000693119_200015260668 [0,1,0,0,0,0|1,1,1]=4 748 B9R1.12 O=CCSc1ncns1 62a_200015260668_100000693119 [0,1,0,0,0,0|1,1,1]=4 749 B9R1.12 O=CCSc1nncs1 62a_100000739804_200015260668 [0,1,0,0,0,0|1,1,1]=4 750 B9R1.12 O=CCSc1nncs1 62a_200015260668_100000739804 [0,1,0,0,0,0|1,1,1]=4 751 B9R1.12 OCCNc1ncns1 27a_100000210304_100000693119 [0,1,0,0,0,0|2,0,0]=3 752 B9R1.12 OCCNc1nncs1 27a_100000210304_100000739804 [0,1,0,0,0,0|2,0,0]=3 753 B9R1.12 OCCOc1ccsc1 34a_100000106738_100000211926 [0,1,0,0,0,0|3,0,0]=4 754 B9R1.12 OCCOc1ccsc1 7a_100000106738_100000211926 [0,1,0,0,0,0|3,0,0]=4 755 B9R1.12 OCCSc1c[nH]cn1 62a_100000211926_100000756875 [0,1,0,0,0,0|2,1,0]=4 756 B9R1.12 OCCSc1c[nH]cn1 62a_100000756875_100000211926 [0,1,0,0,0,0|2,1,0]=4 757 B9R1.12 OCCSc1cc[nH]n1 62a_100000062575_100000211926 [0,1,0,0,0,0|2,1,0]=4 758 B9R1.12 OCCSc1cc[nH]n1 62a_100000211926_100000062575 [0,1,0,0,0,0|2,1,0]=4 759 B9R1.12 OCCSc1ccco1 62a_100000211926_100009814098 [0,1,0,0,0,0|1,2,0]=4 760 B9R1.12 OCCSc1ccco1 62a_100009814098_100000211926 [0,1,0,0,0,0|1,2,0]=4 761 B9R1.12 OCCSc1cccs1 62a_100000211926_100011215356 [0,1,0,0,0,0|1,1,0]=3 762 B9R1.12 OCCSc1cccs1 62a_100011215356_100000211926 [0,1,0,0,0,0|1,1,0]=3 763 B9R1.12 OCCSc1ccon1 62a_100000211926_100009818083 [0,1,0,0,0,0|2,1,0]=4 764 B9R1.12 OCCSc1ccon1 62a_100009818083_100000211926 [0,1,0,0,0,0|2,1,0]=4 765 B9R1.12 OCCSc1ccsn1 62a_100000211926_100009818082 [0,1,0,0,0,0|2,1,0]=4 766 B9R1.12 OCCSc1ccsn1 62a_100009818082_100000211926 [0,1,0,0,0,0|2,1,0]=4 767 B9R1.12 OCCSc1cncs1 62a_100000211926_100011934649 [0,1,0,0,0,0|2,1,0]=4 768 B9R1.12 OCCSc1cncs1 62a_100011934649_100000211926 [0,1,0,0,0,0|2,1,0]=4 769 B9R1.12 OCCSc1cscn1 62a_100000211926_100000751502 [0,1,0,0,0,0|2,1,0]=4 770 B9R1.12 OCCSc1cscn1 62a_100000751502_100000211926 [0,1,0,0,0,0|2,1,0]=4 771 B9R1.12 OCCSc1nc[nH]n1 62a_100000211926_100000761765 [0,1,0,0,0,0|2,1,0]=4 772 B9R1.12 OCCSc1nc[nH]n1 62a_100000761765_100000211926 [0,1,0,0,0,0|2,1,0]=4 773 B9R1.12 OCCSc1ncc[nH]1 62a_100000211926_100025796157 [0,1,0,0,0,0|1,1,0]=3 774 B9R1.12 OCCSc1ncc[nH]1 62a_100025796157_100000211926 [0,1,0,0,0,0|1,1,0]=3 775 B9R1.12 OCCSc1ncco1 62a_100000211926_100011787736 [0,1,0,0,0,0|0,2,0]=3 776 B9R1.12 OCCSc1ncco1 62a_100011787736_100000211926 [0,1,0,0,0,0|0,2,0]=3 777 B9R1.12 OCCSc1nccs1 62a_100000211926_100000211983 [0,1,0,0,0,0|0,1,0]=2 778 B9R1.12 OCCSc1nccs1 62a_100000211983_100000211926 [0,1,0,0,0,0|0,1,0]=2 779 B9R1.12 OCCSc1ncns1 62a_100000211926_100000693119 [0,1,0,0,0,0|1,1,0]=3 780 B9R1.12 OCCSc1ncns1 62a_100000693119_100000211926 [0,1,0,0,0,0|1,1,0]=3 781 B9R1.12 OCCSc1nncs1 62a_100000211926_100000739804 [0,1,0,0,0,0|1,1,0]=3 782 B9R1.12 OCCSc1nncs1 62a_100000739804_100000211926 [0,1,0,0,0,0|1,1,0]=3 783 B9R1.12 [13CH3]NCCc1ccco1 2230a_100000694680_200025704644 [0,1,0,0,0,0|2,1,0]=4 784 B9R1.12 [13CH3]NCCc1ccco1 34a_100000694680_200025704644 [0,1,0,0,0,0|2,1,0]=4 785 B9R1.12 [13CH3]NCCc1cccs1 2230a_100000203755_200025704644 [0,1,0,0,0,0|2,0,0]=3 786 B9R1.12 [13CH3]NCCc1cccs1 34a_100000203755_200025704644 [0,1,0,0,0,0|2,0,0]=3 787 B9R1.12 [13CH3]NCCc1cncs1 2230a_100016991637_200025704644 [0,1,0,0,0,0|3,0,0]=4 788 B9R1.12 [13CH3]NCCc1nccs1 2230a_100015186391_200025704644 [0,1,0,0,0,0|1,0,0]=2 789 B9R1.12 [13CH3]NCCn1cccn1 2230a_100011200920_200025704644 [0,1,0,0,0,0|3,0,0]=4 790 B9R1.12 [13CH3]OCCc1cccs1 34a_100011216825_200025704644 [0,1,0,0,0,0|2,0,0]=3 791 B9R1.12 [13CH3]OCCc1cccs1 7a_100011216825_200025704644 [0,1,0,0,0,0|2,0,0]=3 792 B9R1.12 [13CH3]OCCc1ncc[nH]1 34a_103549771195_200025704644 [0,1,0,0,0,0|2,0,0]=3 793 B9R1.12 [13CH3]OCCn1cccn1 34a_100000743371_200025704644 [0,1,0,0,0,0|3,0,0]=4 794 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_100020628418_200025704644 [0,1,0,0,0,0|3,0,0]=4 795 B9R1.12 [13CH3]SCCc1c[nH]cn1 62a_200025704644_100020628418 [0,1,0,0,0,0|3,0,0]=4 796 B9R1.12 [13CH3]SCCc1cccs1 62a_100000748579_200025704644 [0,1,0,0,0,0|2,0,0]=3 797 B9R1.12 [13CH3]SCCc1cccs1 62a_200025704644_100000748579 [0,1,0,0,0,0|2,0,0]=3 798 B9R1.12 [13CH3]SCCn1cccn1 62a_100015204718_200025704644 [0,1,0,0,0,0|3,0,0]=4 799 B9R1.12 [13CH3]SCCn1cccn1 62a_200025704644_100000685285 [0,1,0,0,0,0|3,0,0]=4 800 B9R1.13 CC(=Cc1cccs1)C 271570a_100102525489_100011215356 [0,1,0,0,0,0|2,0,1]=4 801 B9R1.13 CC(=Cc1ncc[nH]1)C 271570a_100102525489_100025796157 [0,1,0,0,0,0|2,0,1]=4 802 B9R1.13 CC(=Cc1ncco1)C 271570a_100102525489_100011787736 [0,1,0,0,0,0|1,1,1]=4 803 B9R1.13 CC(=Cc1nccs1)C 271570a_100102525489_100000211983 [0,1,0,0,0,0|1,0,1]=3 804 B9R1.13 CC(=Cc1ncns1)C 271570a_100102525489_100000693119 [0,1,0,0,0,0|2,0,1]=4 805 B9R1.13 CC(=Cc1nncs1)C 271570a_100102525489_100000739804 [0,1,0,0,0,0|2,0,1]=4 806 B9R1.13 CC(=O)Cc1cccs1 1458a_100000210189_200000210301 [0,1,0,0,0,0|2,0,1]=4 807 B9R1.13 CC(=O)Cc1ncco1 1458a_100000070787_103436540062 [0,1,0,0,0,0|1,1,1]=4 808 B9R1.13 CC(=O)Cc1nccs1 1458a_100000070787_100015184050 [0,1,0,0,0,0|1,0,1]=3 809 B9R1.13 CC(C)Nc1ncns1 27a_100138425928_100000693119 [0,1,0,0,0,0|2,0,0]=3 810 B9R1.13 CC(C)Nc1nncs1 27a_100138425928_100000739804 [0,1,0,0,0,0|2,0,0]=3 811 B9R1.13 CC(C)Oc1ccsc1 34a_100000106738_100000210206 [0,1,0,0,0,0|3,0,0]=4 812 B9R1.13 CC(C)Oc1ccsc1 7a_100000106738_100000210206 [0,1,0,0,0,0|3,0,0]=4 813 B9R1.13 CC(C)Sc1c[nH]cn1 62a_100000210206_100000756875 [0,1,0,0,0,0|2,1,0]=4 814 B9R1.13 CC(C)Sc1c[nH]cn1 62a_100000756875_100000210206 [0,1,0,0,0,0|2,1,0]=4 815 B9R1.13 CC(C)Sc1cc[nH]n1 62a_100000062575_100000210206 [0,1,0,0,0,0|2,1,0]=4 816 B9R1.13 CC(C)Sc1cc[nH]n1 62a_100000210206_100000062575 [0,1,0,0,0,0|2,1,0]=4 817 B9R1.13 CC(C)Sc1ccco1 62a_100000210206_100009814098 [0,1,0,0,0,0|1,2,0]=4 818 B9R1.13 CC(C)Sc1ccco1 62a_100009814098_100000210206 [0,1,0,0,0,0|1,2,0]=4 819 B9R1.13 CC(C)Sc1cccs1 62a_100000210206_100011215356 [0,1,0,0,0,0|1,1,0]=3 820 B9R1.13 CC(C)Sc1cccs1 62a_100011215356_100000210206 [0,1,0,0,0,0|1,1,0]=3 821 B9R1.13 CC(C)Sc1ccon1 62a_100000210206_100009818083 [0,1,0,0,0,0|2,1,0]=4 822 B9R1.13 CC(C)Sc1ccon1 62a_100009818083_100000210206 [0,1,0,0,0,0|2,1,0]=4 823 B9R1.13 CC(C)Sc1ccsn1 62a_100000210206_100009818082 [0,1,0,0,0,0|2,1,0]=4 824 B9R1.13 CC(C)Sc1ccsn1 62a_100009818082_100000210206 [0,1,0,0,0,0|2,1,0]=4 825 B9R1.13 CC(C)Sc1cncs1 62a_100000210206_100011934649 [0,1,0,0,0,0|2,1,0]=4 826 B9R1.13 CC(C)Sc1cncs1 62a_100011934649_100000210206 [0,1,0,0,0,0|2,1,0]=4 827 B9R1.13 CC(C)Sc1cscn1 62a_100000210206_100000751502 [0,1,0,0,0,0|2,1,0]=4 828 B9R1.13 CC(C)Sc1cscn1 62a_100000751502_100000210206 [0,1,0,0,0,0|2,1,0]=4 829 B9R1.13 CC(C)Sc1nc[nH]n1 62a_100000210206_100000761765 [0,1,0,0,0,0|2,1,0]=4 830 B9R1.13 CC(C)Sc1nc[nH]n1 62a_100000761765_100000210206 [0,1,0,0,0,0|2,1,0]=4 831 B9R1.13 CC(C)Sc1ncc[nH]1 62a_100000210206_100025796157 [0,1,0,0,0,0|1,1,0]=3 832 B9R1.13 CC(C)Sc1ncc[nH]1 62a_100025796157_100000210206 [0,1,0,0,0,0|1,1,0]=3 833 B9R1.13 CC(C)Sc1ncco1 62a_100000210206_100011787736 [0,1,0,0,0,0|0,2,0]=3 834 B9R1.13 CC(C)Sc1ncco1 62a_100011787736_100000210206 [0,1,0,0,0,0|0,2,0]=3 835 B9R1.13 CC(C)Sc1nccs1 62a_100000210206_100000211983 [0,1,0,0,0,0|0,1,0]=2 836 B9R1.13 CC(C)Sc1nccs1 62a_100000211983_100000210206 [0,1,0,0,0,0|0,1,0]=2 837 B9R1.13 CC(C)Sc1ncns1 62a_100000210206_100000693119 [0,1,0,0,0,0|1,1,0]=3 838 B9R1.13 CC(C)Sc1ncns1 62a_100000693119_100000210206 [0,1,0,0,0,0|1,1,0]=3 839 B9R1.13 CC(C)Sc1nncs1 62a_100000210206_100000739804 [0,1,0,0,0,0|1,1,0]=3 840 B9R1.13 CC(C)Sc1nncs1 62a_100000739804_100000210206 [0,1,0,0,0,0|1,1,0]=3 841 B9R1.13 CN(C)Cc1cccs1 2230a_100000184426_200000210301 [0,1,0,0,0,0|3,0,0]=4 842 B9R1.13 CN(C)Cc1cccs1 269982a_100000184426_200000210301 [0,1,0,0,0,0|3,0,0]=4 843 B9R1.13 CN(C)Cc1cccs1 270004a_100102631434_100000209959 [0,1,0,0,0,0|3,0,0]=4 844 B9R1.13 CN(C)Cc1ncc[nH]1 2230a_100015184136_200000210301 [0,1,0,0,0,0|3,0,0]=4 845 B9R1.13 CN(C)Cc1ncc[nH]1 2230a_100102631434_100016991755 [0,1,0,0,0,0|3,0,0]=4 846 B9R1.13 CN(C)Cc1ncc[nH]1 269982a_100015184136_200000210301 [0,1,0,0,0,0|3,0,0]=4 847 B9R1.13 CN(C)Cc1ncc[nH]1 269982a_100102631434_100016991755 [0,1,0,0,0,0|3,0,0]=4 848 B9R1.13 CN(C)Cc1ncco1 2230a_100102631434_103436540062 [0,1,0,0,0,0|2,1,0]=4 849 B9R1.13 CN(C)Cc1ncco1 269982a_100102631434_103436540062 [0,1,0,0,0,0|2,1,0]=4 850 B9R1.13 CN(C)Cc1ncco1 270004a_100102631434_100000064290 [0,1,0,0,0,0|2,1,0]=4 851 B9R1.13 CN(C)Cc1nccs1 2230a_100000765864_200000210301 [0,1,0,0,0,0|2,0,0]=3 852 B9R1.13 CN(C)Cc1nccs1 2230a_100102631434_100015184050 [0,1,0,0,0,0|2,0,0]=3 853 B9R1.13 CN(C)Cc1nccs1 269982a_100000765864_200000210301 [0,1,0,0,0,0|2,0,0]=3 854 B9R1.13 CN(C)Cc1nccs1 269982a_100102631434_100015184050 [0,1,0,0,0,0|2,0,0]=3 855 B9R1.13 CN(C)Cc1nccs1 270004a_100102631434_100000750902 [0,1,0,0,0,0|2,0,0]=3 856 B9R1.13 CN([13CH3])Cc1cccs1 2230a_100000184426_200025704644 [0,1,0,0,0,0|3,0,0]=4 857 B9R1.13 CN([13CH3])Cc1cccs1 269982a_100000184426_200025704644 [0,1,0,0,0,0|3,0,0]=4 858 B9R1.13 CN([13CH3])Cc1ncc[nH]1 2230a_100015184136_200025704644 [0,1,0,0,0,0|3,0,0]=4 859 B9R1.13 CN([13CH3])Cc1ncc[nH]1 269982a_100015184136_200025704644 [0,1,0,0,0,0|3,0,0]=4 860 B9R1.13 CN([13CH3])Cc1nccs1 2230a_100000765864_200025704644 [0,1,0,0,0,0|2,0,0]=3 861 B9R1.13 CN([13CH3])Cc1nccs1 269982a_100000765864_200025704644 [0,1,0,0,0,0|2,0,0]=3 862 B9R1.13 [13CH3]C(=O)Cc1cccs1 1458a_100000210189_200025704644 [0,1,0,0,0,0|2,0,1]=4 863 B9R1.33 CC=Cc1nccn1C 271570a_100016259895_100000707724 [0,1,0,0,0,0|2,0,1]=4 864 B9R1.33 CC=Cc1sccc1Br 271570a_100016259895_100012361411 [0,1,0,0,0,0|2,0,1]=4 865 B9R1.33 CC=Cc1sccc1C 271570a_100016259895_100000742657 [0,1,0,0,0,0|2,0,1]=4 866 B9R1.33 CCNc1ncnn1C 27a_100015525214_100000732653 [0,1,0,0,0,0|3,0,0]=4 867 B9R1.33 CCOc1ccnn1C 34a_100020632926_100000210202 [0,1,0,0,0,0|2,0,1]=4 868 B9R1.33 CCSc1n[nH]cc1Br 62a_100000210202_100015839836 [0,1,0,0,0,0|2,1,0]=4 869 B9R1.33 CCSc1n[nH]cc1Br 62a_100015839836_100000210202 [0,1,0,0,0,0|2,1,0]=4 870 B9R1.33 CCSc1n[nH]cc1C 62a_100000210202_100009871783 [0,1,0,0,0,0|2,1,0]=4 871 B9R1.33 CCSc1n[nH]cc1C 62a_100009871783_100000210202 [0,1,0,0,0,0|2,1,0]=4 872 B9R1.33 CCSc1n[nH]cc1N 62a_100000210202_100010894806 [0,1,0,0,0,0|2,1,0]=4 873 B9R1.33 CCSc1n[nH]cc1N 62a_100010894806_100000210202 [0,1,0,0,0,0|2,1,0]=4 874 B9R1.33 CCSc1nc[nH]c1C 62a_100000210202_100010186451 [0,1,0,0,0,0|2,1,0]=4 875 B9R1.33 CCSc1nc[nH]c1C 62a_100010186451_100000210202 [0,1,0,0,0,0|2,1,0]=4 876 B9R1.33 CCSc1nccn1C 62a_100000210202_100000707724 [0,1,0,0,0,0|1,1,0]=3 877 B9R1.33 CCSc1nccn1C 62a_100000707724_100000210202 [0,1,0,0,0,0|1,1,0]=3 878 B9R1.33 CCSc1ncnn1C 62a_100000210202_100000732653 [0,1,0,0,0,0|2,1,0]=4 879 B9R1.33 CCSc1ncnn1C 62a_100000732653_100000210202 [0,1,0,0,0,0|2,1,0]=4 880 B9R1.33 CCSc1ncsc1C 62a_100000210202_100000732656 [0,1,0,0,0,0|2,1,0]=4 881 B9R1.33 CCSc1ncsc1C 62a_100000732656_100000210202 [0,1,0,0,0,0|2,1,0]=4 882 B9R1.33 CCSc1sccc1Br 62a_100000210202_100012361411 [0,1,0,0,0,0|1,1,0]=3 883 B9R1.33 CCSc1sccc1Br 62a_100012361411_100000210202 [0,1,0,0,0,0|1,1,0]=3 884 B9R1.33 CCSc1sccc1C 62a_100000210202_100010247149 [0,1,0,0,0,0|1,1,0]=3 885 B9R1.33 CCSc1sccc1C 62a_100010247149_100000210202 [0,1,0,0,0,0|1,1,0]=3 886 B9R1.33 CCSc1scnc1C 62a_100000210202_100009817116 [0,1,0,0,0,0|2,1,0]=4 887 B9R1.33 CCSc1scnc1C 62a_100009817116_100000210202 [0,1,0,0,0,0|2,1,0]=4 888 B9R1.33 CNCc1nccn1C 207a_100102657272_100000748660 [0,1,0,0,0,0|3,0,0]=4 889 B9R1.33 CNCc1nccn1C 2230a_100015186572_200000210301 [0,1,0,0,0,0|3,0,0]=4 890 B9R1.33 CNCc1nccn1C 2230a_106832991635_100000700302 [0,1,0,0,0,0|3,0,0]=4 891 B9R1.33 CNCc1nccn1C 270004a_106832991635_100000748660 [0,1,0,0,0,0|3,0,0]=4 892 B9R1.33 CNCc1nccn1C 34a_100102657272_100000700302 [0,1,0,0,0,0|3,0,0]=4 893 B9R1.33 CNCc1nccn1C 7a_106832991635_100000700302 [0,1,0,0,0,0|3,0,0]=4 894 B9R1.33 CNCc1sccc1Br 207a_100102657272_100000766043 [0,1,0,0,0,0|3,0,0]=4 895 B9R1.33 CNCc1sccc1Br 270004a_106832991635_100000766043 [0,1,0,0,0,0|3,0,0]=4 896 B9R1.33 CNCc1sccc1C 207a_100102657272_100000210881 [0,1,0,0,0,0|3,0,0]=4 897 B9R1.33 CNCc1sccc1C 2230a_100000238519_200000210301 [0,1,0,0,0,0|3,0,0]=4 898 B9R1.33 CNCc1sccc1C 270004a_106832991635_100000210881 [0,1,0,0,0,0|3,0,0]=4 899 B9R1.33 CNCc1sccc1C 34a_100000238519_200000210301 [0,1,0,0,0,0|3,0,0]=4 900 B9R1.33 CNCc1sccc1Cl 207a_100102657272_100000722334 [0,1,0,0,0,0|3,0,0]=4 901 B9R1.33 CNCc1sccc1Cl 2230a_100011934584_200000210301 [0,1,0,0,0,0|3,0,0]=4 902 B9R1.33 CNCc1sccc1Cl 270004a_106832991635_100000722334 [0,1,0,0,0,0|3,0,0]=4 903 B9R1.33 CNCc1sccc1Cl 34a_100011934584_200000210301 [0,1,0,0,0,0|3,0,0]=4 904 B9R1.33 CNCc1sccc1O 271570a_203496583355_100000767120 [0,1,0,0,0,0|3,0,0]=4 905 B9R1.33 COCc1nccn1C 34a_100138415774_100000700302 [0,1,0,0,0,0|3,0,0]=4 906 B9R1.33 COCc1nccn1C 7a_100000691215_200000210301 [0,1,0,0,0,0|3,0,0]=4 907 B9R1.33 COCc1sccc1Br 34a_100000702026_200000210301 [0,1,0,0,0,0|3,0,0]=4 908 B9R1.33 COCc1sccc1C 34a_100000238368_200000210301 [0,1,0,0,0,0|3,0,0]=4 909 B9R1.33 COCc1sccc1C 7a_100000238368_200000210301 [0,1,0,0,0,0|3,0,0]=4 910 B9R1.33 COCc1sccc1Cl 34a_100000722387_200000210301 [0,1,0,0,0,0|3,0,0]=4 911 B9R1.33 COCc1sccc1Cl 7a_100000722387_200000210301 [0,1,0,0,0,0|3,0,0]=4 912 B9R1.33 CSCc1nccn1C 62a_100000700302_200000210301 [0,1,0,0,0,0|3,0,0]=4 913 B9R1.33 CSCc1nccn1C 62a_200000210301_100000700302 [0,1,0,0,0,0|3,0,0]=4 914 B9R1.33 Cc1ccsc1CN[13CH3] 2230a_100000238519_200025704644 [0,1,0,0,0,0|3,0,0]=4 915 B9R1.33 Cc1ccsc1CN[13CH3] 34a_100000238519_200025704644 [0,1,0,0,0,0|3,0,0]=4 916 B9R1.33 Cc1ccsc1CO[13CH3] 34a_100000238368_200025704644 [0,1,0,0,0,0|3,0,0]=4 917 B9R1.33 Cc1ccsc1CO[13CH3] 7a_100000238368_200025704644 [0,1,0,0,0,0|3,0,0]=4 918 B9R1.33 Cc1ccsc1SCF 62a_100010247149_100015361967 [0,1,0,0,0,0|2,1,0]=4 919 B9R1.33 Cc1ccsc1SCF 62a_100015361967_100010247149 [0,1,0,0,0,0|2,1,0]=4 920 B9R1.33 Cn1ccnc1CN[13CH3] 2230a_100015186572_200025704644 [0,1,0,0,0,0|3,0,0]=4 921 B9R1.33 Cn1ccnc1CO[13CH3] 7a_100000691215_200025704644 [0,1,0,0,0,0|3,0,0]=4 922 B9R1.33 Cn1ccnc1CS[13CH3] 62a_100000700302_200025704644 [0,1,0,0,0,0|3,0,0]=4 923 B9R1.33 Cn1ccnc1CS[13CH3] 62a_200025704644_100000700302 [0,1,0,0,0,0|3,0,0]=4 924 B9R1.33 Cn1ccnc1SCF 62a_100000707724_100015361967 [0,1,0,0,0,0|2,1,0]=4 925 B9R1.33 Cn1ccnc1SCF 62a_100015361967_100000707724 [0,1,0,0,0,0|2,1,0]=4 926 B9R1.33 FCSc1sccc1Br 62a_100012361411_100015361967 [0,1,0,0,0,0|2,1,0]=4 927 B9R1.33 FCSc1sccc1Br 62a_100015361967_100012361411 [0,1,0,0,0,0|2,1,0]=4 928 B9R1.33 [13CH3]NCc1sccc1Cl 2230a_100011934584_200025704644 [0,1,0,0,0,0|3,0,0]=4 929 B9R1.33 [13CH3]NCc1sccc1Cl 34a_100011934584_200025704644 [0,1,0,0,0,0|3,0,0]=4 930 B9R1.33 [13CH3]OCc1sccc1Br 34a_100000702026_200025704644 [0,1,0,0,0,0|3,0,0]=4 931 B9R1.33 [13CH3]OCc1sccc1Cl 34a_100000722387_200025704644 [0,1,0,0,0,0|3,0,0]=4 932 B9R1.33 [13CH3]OCc1sccc1Cl 7a_100000722387_200025704644 [0,1,0,0,0,0|3,0,0]=4 933 B7R0.1 C/C=C/CCOCC 34a_100016278192_100000210202 [0,0,1,0,0,0|2,0,1]=4 934 B7R0.1 C=CCSCOCC 62a_100000210623_100000739092 [0,0,1,0,0,0|1,0,2]=4 935 B7R0.1 C=CCSCOCC 62a_100000739092_100000210623 [0,0,1,0,0,0|1,0,2]=4 936 B7R0.1 CCOCSCC=O 62a_100000739092_200015260668 [0,0,1,0,0,0|1,0,2]=4 937 B7R0.1 CCOCSCC=O 62a_200015260668_100000739092 [0,0,1,0,0,0|1,0,2]=4 938 B7R0.7 C=CCC(=O)CCC 1458a_100000210193_100000210303 [0,0,1,0,0,0|2,1,0]=4 939 B7R0.7 C=CCC(=O)CCC 1458a_100000211992_100000210623 [0,0,1,0,0,0|2,1,0]=4 940 B7R0.7 C=CCC(=O)NCC 11a_100015525214_100000210193 [0,0,1,0,0,0|2,1,0]=4 941 B7R0.7 C=CCC(=O)NCC 240690a_100015525214_100000210193 [0,0,1,0,0,0|2,1,0]=4 942 B7R0.7 C=CCC(=O)NCC 527a_100015525214_100000210193 [0,0,1,0,0,0|2,1,0]=4 943 B7R0.7 C=CC[C@@H](C)OCC 34a_100000731007_100000210202 [0,0,1,0,0,0|2,0,1]=4 944 B7R0.7 C=CC[C@@H](C)OCC 7a_100000731007_100000210202 [0,0,1,0,0,0|2,0,1]=4 945 B7R0.12 C=CC(C=C)OCC 34a_100000033096_100000210202 [0,0,1,0,0,0|2,0,1]=4 946 B9R2.2 c1c[nH]c(n1)C2CC2 271570a_100011220607_100025796157 [0,0,0,1,0,0|2,0,0]=3 947 B9R2.2 c1cc(n[nH]1)C2CC2 271570a_100011220607_100000062575 [0,0,0,1,0,0|3,0,0]=4 948 B9R2.2 c1cc(ns1)C2CC2 271570a_100011220607_100009818082 [0,0,0,1,0,0|3,0,0]=4 949 B9R2.2 c1coc(c1)C2CC2 271570a_100011220607_100009814098 [0,0,0,1,0,0|2,1,0]=4 950 B9R2.2 c1coc(n1)C2CC2 271570a_100011220607_100011787736 [0,0,0,1,0,0|1,1,0]=3 951 B9R2.2 c1csc(c1)C2CC2 271570a_100011220607_100011215356 [0,0,0,1,0,0|2,0,0]=3 952 B9R2.2 c1csc(n1)C2CC2 271570a_100011220607_100000211983 [0,0,0,1,0,0|1,0,0]=2 953 B9R2.2 c1nc(c[nH]1)C2CC2 271570a_100011220607_100000756875 [0,0,0,1,0,0|3,0,0]=4 954 B9R2.2 c1nc(cs1)C2CC2 271570a_100011220607_100000751502 [0,0,0,1,0,0|3,0,0]=4 955 B9R2.2 c1nc(n[nH]1)C2CC2 271570a_100011220607_100000761765 [0,0,0,1,0,0|3,0,0]=4 956 B9R2.2 c1ncc(s1)C2CC2 271570a_100011220607_100011934649 [0,0,0,1,0,0|3,0,0]=4 957 B9R2.2 c1nnc(s1)C2CC2 271570a_100011220607_100000739804 [0,0,0,1,0,0|2,0,0]=3 958 B9R2.2 c1nsc(n1)C2CC2 271570a_100011220607_100000693119 [0,0,0,1,0,0|2,0,0]=3 959 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [0,0,0,0,0,1|2,0,1]=4 960 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [0,0,0,0,0,1|2,0,1]=4 961 B9R1.8 CC=Cc1cccnn1 271570a_100016259895_100016991348 [0,0,0,0,0,1|2,0,1]=4 962 B9R1.8 CC=Cc1ccncn1 271570a_100016259895_100000703185 [0,0,0,0,0,1|2,0,1]=4 963 B9R1.8 CC=Cc1cnccn1 271570a_100016259895_100000758340 [0,0,0,0,0,1|2,0,1]=4 964 B9R1.8 CC=Cc1ncccn1 271570a_100016259895_100000211032 [0,0,0,0,0,1|2,0,1]=4 965 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [0,0,0,0,0,1|3,0,0]=4 966 B9R1.8 CCNc1cccnn1 27a_100015525214_100016991348 [0,0,0,0,0,1|2,0,0]=3 967 B9R1.8 CCNc1ccncn1 27a_100015525214_100000703185 [0,0,0,0,0,1|2,0,0]=3 968 B9R1.8 CCNc1cnccn1 27a_100015525214_100000211759 [0,0,0,0,0,1|2,0,0]=3 969 B9R1.8 CCNc1ncccn1 27a_100015525214_100000211032 [0,0,0,0,0,1|2,0,0]=3 970 B9R1.8 CCOC1CC=CCC1 34a_100000073881_100000210202 [0,0,0,0,0,1|2,0,1]=4 971 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [0,0,0,0,0,1|2,0,0]=3 972 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [0,0,0,0,0,1|2,0,0]=3 973 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [0,0,0,0,0,1|1,0,0]=2 974 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [0,0,0,0,0,1|1,0,0]=2 975 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [0,0,0,0,0,1|2,0,0]=3 976 B9R1.8 CCOc1ccnnc1 34a_100015204005_100000210202 [0,0,0,0,0,1|2,0,0]=3 977 B9R1.8 CCOc1cncnc1 7a_100000754086_100000210202 [0,0,0,0,0,1|2,0,0]=3 978 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [0,0,0,0,0,1|2,1,0]=4 979 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [0,0,0,0,0,1|2,1,0]=4 980 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [0,0,0,0,0,1|1,1,0]=3 981 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [0,0,0,0,0,1|1,1,0]=3 982 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [0,0,0,0,0,1|1,1,0]=3 983 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [0,0,0,0,0,1|1,1,0]=3 984 B9R1.8 CCSc1cccnn1 62a_100000210202_100016991348 [0,0,0,0,0,1|1,1,0]=3 985 B9R1.8 CCSc1cccnn1 62a_100016991348_100000210202 [0,0,0,0,0,1|1,1,0]=3 986 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [0,0,0,0,0,1|2,1,0]=4 987 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [0,0,0,0,0,1|2,1,0]=4 988 B9R1.8 CCSc1ccncn1 62a_100000210202_100000703185 [0,0,0,0,0,1|1,1,0]=3 989 B9R1.8 CCSc1ccncn1 62a_100000703185_100000210202 [0,0,0,0,0,1|1,1,0]=3 990 B9R1.8 CCSc1ccnnc1 62a_100000210202_100000732662 [0,0,0,0,0,1|2,1,0]=4 991 B9R1.8 CCSc1ccnnc1 62a_100000732662_100000210202 [0,0,0,0,0,1|2,1,0]=4 992 B9R1.8 CCSc1cnccn1 62a_100000210202_100000211759 [0,0,0,0,0,1|1,1,0]=3 993 B9R1.8 CCSc1cnccn1 62a_100000211759_100000210202 [0,0,0,0,0,1|1,1,0]=3 994 B9R1.8 CCSc1cncnc1 62a_100000210202_100011206942 [0,0,0,0,0,1|2,1,0]=4 995 B9R1.8 CCSc1cncnc1 62a_100011206942_100000210202 [0,0,0,0,0,1|2,1,0]=4 996 B9R1.8 CCSc1ncccn1 62a_100000210202_100000211032 [0,0,0,0,0,1|1,1,0]=3 997 B9R1.8 CCSc1ncccn1 62a_100000211032_100000210202 [0,0,0,0,0,1|1,1,0]=3 998 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [0,0,0,0,0,1|3,0,0]=4 999 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [0,0,0,0,0,1|3,0,0]=4 1000 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [0,0,0,0,0,1|3,0,0]=4 1001 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [0,0,0,0,0,1|3,0,0]=4 1002 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [0,0,0,0,0,1|3,0,0]=4 1003 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [0,0,0,0,0,1|3,0,0]=4 1004 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [0,0,0,0,0,1|3,0,0]=4 1005 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [0,0,0,0,0,1|3,0,0]=4 1006 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [0,0,0,0,0,1|3,0,0]=4 1007 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [0,0,0,0,0,1|3,0,0]=4 1008 B9R1.8 CNCc1cccnn1 2230a_100159270163_200000210301 [0,0,0,0,0,1|3,0,0]=4 1009 B9R1.8 CNCc1cccnn1 2230a_106832991635_100016990269 [0,0,0,0,0,1|3,0,0]=4 1010 B9R1.8 CNCc1cccnn1 34a_100102657272_100016990269 [0,0,0,0,0,1|3,0,0]=4 1011 B9R1.8 CNCc1cccnn1 7a_106832991635_100016990269 [0,0,0,0,0,1|3,0,0]=4 1012 B9R1.8 CNCc1cnccn1 2230a_106832991635_100016995436 [0,0,0,0,0,1|3,0,0]=4 1013 B9R1.8 CNCc1cnccn1 270004a_106832991635_100000749867 [0,0,0,0,0,1|3,0,0]=4 1014 B9R1.8 CNCc1cnccn1 34a_100102657272_100016995436 [0,0,0,0,0,1|3,0,0]=4 1015 B9R1.8 CNCc1cnccn1 7a_106832991635_100016995436 [0,0,0,0,0,1|3,0,0]=4 1016 B9R1.8 CNCc1ncccn1 2230a_106832991635_100000703007 [0,0,0,0,0,1|3,0,0]=4 1017 B9R1.8 CNCc1ncccn1 270004a_106832991635_100011532527 [0,0,0,0,0,1|3,0,0]=4 1018 B9R1.8 CNCc1ncccn1 34a_100102657272_100000703007 [0,0,0,0,0,1|3,0,0]=4 1019 B9R1.8 CNCc1ncccn1 7a_106832991635_100000703007 [0,0,0,0,0,1|3,0,0]=4 1020 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [0,0,0,0,0,1|3,0,0]=4 1021 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [0,0,0,0,0,1|3,0,0]=4 1022 B9R1.8 COCc1cccnn1 34a_100138415774_100016990269 [0,0,0,0,0,1|3,0,0]=4 1023 B9R1.8 COCc1cnccn1 34a_100138415774_100016995436 [0,0,0,0,0,1|3,0,0]=4 1024 B9R1.8 COCc1ncccn1 34a_100138415774_100000703007 [0,0,0,0,0,1|3,0,0]=4 1025 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [0,0,0,0,0,1|3,0,0]=4 1026 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [0,0,0,0,0,1|3,0,0]=4 1027 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [0,0,0,0,0,1|3,0,0]=4 1028 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [0,0,0,0,0,1|3,0,0]=4 1029 B9R1.8 CSCc1cccnn1 62a_100016990269_200000210301 [0,0,0,0,0,1|3,0,0]=4 1030 B9R1.8 CSCc1cccnn1 62a_200000210301_100016990269 [0,0,0,0,0,1|3,0,0]=4 1031 B9R1.8 CSCc1cnccn1 62a_100016995436_200000210301 [0,0,0,0,0,1|3,0,0]=4 1032 B9R1.8 CSCc1cnccn1 62a_200000210301_100016995436 [0,0,0,0,0,1|3,0,0]=4 1033 B9R1.8 CSCc1ncccn1 62a_100000703007_200000210301 [0,0,0,0,0,1|3,0,0]=4 1034 B9R1.8 CSCc1ncccn1 62a_200000210301_100000703007 [0,0,0,0,0,1|3,0,0]=4 1035 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [0,0,0,0,0,1|3,0,0]=4 1036 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [0,0,0,0,0,1|3,0,0]=4 1037 B9R1.8 FCOc1cccnc1 34a_100000210849_100015361967 [0,0,0,0,0,1|2,0,0]=3 1038 B9R1.8 FCOc1cccnc1 7a_100000210849_100015361967 [0,0,0,0,0,1|2,0,0]=3 1039 B9R1.8 FCOc1ccncc1 34a_100000212176_100015361967 [0,0,0,0,0,1|3,0,0]=4 1040 B9R1.8 FCOc1ccnnc1 34a_100015204005_100015361967 [0,0,0,0,0,1|3,0,0]=4 1041 B9R1.8 FCOc1cncnc1 7a_100000754086_100015361967 [0,0,0,0,0,1|3,0,0]=4 1042 B9R1.8 FCSc1ccccn1 62a_100011216584_100015361967 [0,0,0,0,0,1|2,1,0]=4 1043 B9R1.8 FCSc1ccccn1 62a_100015361967_100011216584 [0,0,0,0,0,1|2,1,0]=4 1044 B9R1.8 FCSc1cccnc1 62a_100000210063_100015361967 [0,0,0,0,0,1|2,1,0]=4 1045 B9R1.8 FCSc1cccnc1 62a_100015361967_100000210063 [0,0,0,0,0,1|2,1,0]=4 1046 B9R1.8 FCSc1cccnn1 62a_100015361967_100016991348 [0,0,0,0,0,1|2,1,0]=4 1047 B9R1.8 FCSc1cccnn1 62a_100016991348_100015361967 [0,0,0,0,0,1|2,1,0]=4 1048 B9R1.8 FCSc1ccncn1 62a_100000703185_100015361967 [0,0,0,0,0,1|2,1,0]=4 1049 B9R1.8 FCSc1ccncn1 62a_100015361967_100000703185 [0,0,0,0,0,1|2,1,0]=4 1050 B9R1.8 FCSc1cnccn1 62a_100000211759_100015361967 [0,0,0,0,0,1|2,1,0]=4 1051 B9R1.8 FCSc1cnccn1 62a_100015361967_100000211759 [0,0,0,0,0,1|2,1,0]=4 1052 B9R1.8 FCSc1ncccn1 62a_100000211032_100015361967 [0,0,0,0,0,1|2,1,0]=4 1053 B9R1.8 FCSc1ncccn1 62a_100015361967_100000211032 [0,0,0,0,0,1|2,1,0]=4 1054 B9R1.8 [13CH3]NCc1cccnn1 2230a_100159270163_200025704644 [0,0,0,0,0,1|3,0,0]=4 1055 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [0,0,0,0,0,1|3,0,0]=4 1056 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [0,0,0,0,0,1|3,0,0]=4 1057 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [0,0,0,0,0,1|3,0,0]=4 1058 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [0,0,0,0,0,1|3,0,0]=4 1059 B9R1.8 [13CH3]SCc1cccnn1 62a_100016990269_200025704644 [0,0,0,0,0,1|3,0,0]=4 1060 B9R1.8 [13CH3]SCc1cccnn1 62a_200025704644_100016990269 [0,0,0,0,0,1|3,0,0]=4 1061 B9R1.8 [13CH3]SCc1cnccn1 62a_100016995436_200025704644 [0,0,0,0,0,1|3,0,0]=4 1062 B9R1.8 [13CH3]SCc1cnccn1 62a_200025704644_100016995436 [0,0,0,0,0,1|3,0,0]=4 1063 B9R1.8 [13CH3]SCc1ncccn1 62a_100000703007_200025704644 [0,0,0,0,0,1|3,0,0]=4 1064 B9R1.8 [13CH3]SCc1ncccn1 62a_200025704644_100000703007 [0,0,0,0,0,1|3,0,0]=4 1065 B6R0.6 C/C=C/COCC 34a_100016270725_100000210202 [1,0,1,0,0,0|1,0,1]=4 1066 B6R0.6 C/C=C/COCC 34a_100121572206_100102629194 [1,0,1,0,0,0|1,0,1]=4 1067 B6R0.6 C=CCCOCC 34a_100011205117_100000210202 [1,0,1,0,0,0|1,0,1]=4 1068 B6R0.6 C=CCCOCC 34a_100121572206_100000754431 [1,0,1,0,0,0|1,0,1]=4 1069 B6R0.6 CC=CCOCC 34a_100121572206_100000070051 [1,0,1,0,0,0|1,0,1]=4 1070 B6R0.1 C=CC(=O)CCC 1458a_100000185746_100000210303 [1,0,1,0,0,0|1,1,0]=4 1071 B6R0.1 C=CC(=O)NCC 240690a_100015525214_200121576911 [1,0,1,0,0,0|1,1,0]=4 1072 B6R0.1 C=CC(C)OCC 34a_100000695699_100000210202 [1,0,1,0,0,0|1,0,1]=4 1073 B6R0.1 C=CCC(=O)CC 1458a_100000210193_100000210202 [1,0,1,0,0,0|1,1,0]=4 1074 B6R0.1 C=CCC(=O)CC 1458a_100000210414_100000210623 [1,0,1,0,0,0|1,1,0]=4 1075 B6R1.2 Oc1c[nH]cn1 271570a_203496583355_100000756875 [2,0,0,0,0,0|2,0,0]=4 1076 B6R1.2 Oc1cc[nH]n1 271570a_203496583355_100000062575 [2,0,0,0,0,0|2,0,0]=4 1077 B6R1.2 Oc1ccco1 271570a_203496583355_100009814098 [2,0,0,0,0,0|1,1,0]=4 1078 B6R1.2 Oc1cccs1 271570a_203496583355_100011215356 [2,0,0,0,0,0|1,0,0]=3 1079 B6R1.2 Oc1ccsn1 271570a_203496583355_100009818082 [2,0,0,0,0,0|2,0,0]=4 1080 B6R1.2 Oc1cncs1 271570a_203496583355_100011934649 [2,0,0,0,0,0|2,0,0]=4 1081 B6R1.2 Oc1cscn1 271570a_203496583355_100000751502 [2,0,0,0,0,0|2,0,0]=4 1082 B6R1.2 Oc1nc[nH]n1 271570a_203496583355_100000761765 [2,0,0,0,0,0|2,0,0]=4 1083 B6R1.2 Oc1ncc[nH]1 271570a_203496583355_100025796157 [2,0,0,0,0,0|1,0,0]=3 1084 B6R1.2 Oc1ncco1 271570a_203496583355_100011787736 [2,0,0,0,0,0|0,1,0]=3 1085 B6R1.2 Oc1nccs1 271570a_203496583355_100000211983 [2,0,0,0,0,0|0,0,0]=2 1086 B6R1.2 Oc1ncns1 271570a_203496583355_100000693119 [2,0,0,0,0,0|1,0,0]=3 1087 B6R1.2 Oc1nncs1 271570a_203496583355_100000739804 [2,0,0,0,0,0|1,0,0]=3 1088 B8R0.4 C/C=C/C=C/COCC 34a_100016283227_100000210202 [0,1,1,0,0,0|2,0,0]=4 1089 B8R0.4 C/C=C/CSCOCC 62a_100000739092_100102629194 [0,1,1,0,0,0|1,0,1]=4 1090 B8R0.4 C/C=C/CSCOCC 62a_100102629194_100000739092 [0,1,1,0,0,0|1,0,1]=4 1091 B8R0.4 CC=CCSCOCC 62a_100000070051_100000739092 [0,1,1,0,0,0|1,0,1]=4 1092 B8R0.4 CC=CCSCOCC 62a_100000739092_100000070051 [0,1,1,0,0,0|1,0,1]=4 1093 B8R1.1 C=Cc1nc(cs1)Br 271570a_100011290941_200016082925 [1,1,0,0,0,0|0,0,2]=4 1094 B8R1.1 C=Cc1nc(cs1)C 271570a_100011290941_100011291629 [1,1,0,0,0,0|0,0,2]=4 1095 B8R1.1 C=Cc1nc(cs1)N 271570a_100011290941_200015188442 [1,1,0,0,0,0|0,0,2]=4 1096 B8R1.1 C=Cc1ncc(s1)C 271570a_100011290941_100000690809 [1,1,0,0,0,0|0,0,2]=4 1097 B8R1.1 CCc1cc(cs1)O 271570a_203496583355_100009846239 [1,1,0,0,0,0|1,0,0]=3 1098 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,1,0,0,0,0|1,0,0]=3 1099 B8R1.1 CCc1nc(no1)C 270196a_100000212224_100000210414 [1,1,0,0,0,0|1,1,0]=4 1100 B8R1.1 CCc1nc(no1)O 271570a_203496583355_100012003642 [1,1,0,0,0,0|1,1,0]=4 1101 B8R1.1 CCc1noc(n1)C 270196a_200000212204_100000070787 [1,1,0,0,0,0|2,0,0]=4 1102 B8R1.1 CCc1noc(n1)O 270196a_200000212204_100015183105 [1,1,0,0,0,0|2,0,0]=4 1103 B8R1.1 CCn1cc(cn1)O 271570a_203496583355_100011400201 [1,1,0,0,0,0|2,0,0]=4 1104 B8R1.1 CCn1ccc(n1)O 271570a_203496583355_100012350556 [1,1,0,0,0,0|2,0,0]=4 1105 B8R1.1 CNc1nc(ns1)C 27a_100102657272_100000709739 [1,1,0,0,0,0|2,0,0]=4 1106 B8R1.1 CNc1nnc(s1)C 27a_100102657272_100000686958 [1,1,0,0,0,0|2,0,0]=4 1107 B8R1.1 CNc1nnc(s1)N 27a_100102657272_100000738278 [1,1,0,0,0,0|2,0,0]=4 1108 B8R1.1 CNc1nnc(s1)O 271570a_203496583355_200012111945 [1,1,0,0,0,0|2,0,0]=4 1109 B8R1.1 COc1ccn(n1)C 34a_100012642153_200000210301 [1,1,0,0,0,0|2,0,0]=4 1110 B8R1.1 COc1nc(cs1)O 271570a_203496583355_100000727839 [1,1,0,0,0,0|0,0,0]=2 1111 B8R1.1 COc1ncc(s1)O 271570a_203496583355_100000729428 [1,1,0,0,0,0|0,0,0]=2 1112 B8R1.1 CSc1cc(cs1)C 62a_100009876951_200000210301 [1,1,0,0,0,0|1,1,0]=4 1113 B8R1.1 CSc1cc(cs1)C 62a_200000210301_100009876951 [1,1,0,0,0,0|1,1,0]=4 1114 B8R1.1 CSc1cc(cs1)O 271570a_203496583355_200010256830 [1,1,0,0,0,0|1,1,0]=4 1115 B8R1.1 CSc1ccc(s1)Br 62a_100010197418_200000210301 [1,1,0,0,0,0|1,1,0]=4 1116 B8R1.1 CSc1ccc(s1)Br 62a_200000210301_100010197418 [1,1,0,0,0,0|1,1,0]=4 1117 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,1,0,0,0,0|1,1,0]=4 1118 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,1,0,0,0,0|1,1,0]=4 1119 B8R1.1 CSc1nc(c[nH]1)C 62a_100161115468_200000210301 [1,1,0,0,0,0|1,1,0]=4 1120 B8R1.1 CSc1nc(c[nH]1)C 62a_200000210301_100161115468 [1,1,0,0,0,0|1,1,0]=4 1121 B8R1.1 CSc1nc(cs1)Br 62a_200000210301_200016082925 [1,1,0,0,0,0|0,1,0]=3 1122 B8R1.1 CSc1nc(cs1)Br 62a_200016082925_200000210301 [1,1,0,0,0,0|0,1,0]=3 1123 B8R1.1 CSc1nc(cs1)C 62a_100011291629_200000210301 [1,1,0,0,0,0|0,1,0]=3 1124 B8R1.1 CSc1nc(cs1)C 62a_200000210301_100011291629 [1,1,0,0,0,0|0,1,0]=3 1125 B8R1.1 CSc1nc(cs1)N 62a_200000210301_200015188442 [1,1,0,0,0,0|0,1,0]=3 1126 B8R1.1 CSc1nc(cs1)N 62a_200015188442_200000210301 [1,1,0,0,0,0|0,1,0]=3 1127 B8R1.1 CSc1nc(cs1)O 271570a_203496583355_100000732701 [1,1,0,0,0,0|0,1,0]=3 1128 B8R1.1 CSc1nc(ns1)C 62a_100000709739_200000210301 [1,1,0,0,0,0|1,1,0]=4 1129 B8R1.1 CSc1nc(ns1)C 62a_200000210301_100000709739 [1,1,0,0,0,0|1,1,0]=4 1130 B8R1.1 CSc1nc(ns1)O 271570a_203496583355_200010005773 [1,1,0,0,0,0|1,1,0]=4 1131 B8R1.1 CSc1ncc(s1)C 62a_100000690809_200000210301 [1,1,0,0,0,0|0,1,0]=3 1132 B8R1.1 CSc1ncc(s1)C 62a_200000210301_100000690809 [1,1,0,0,0,0|0,1,0]=3 1133 B8R1.1 CSc1nnc(s1)C 62a_100000686958_200000210301 [1,1,0,0,0,0|1,1,0]=4 1134 B8R1.1 CSc1nnc(s1)C 62a_200000210301_100000686958 [1,1,0,0,0,0|1,1,0]=4 1135 B8R1.1 CSc1nnc(s1)N 62a_100000738278_200000210301 [1,1,0,0,0,0|1,1,0]=4 1136 B8R1.1 CSc1nnc(s1)N 62a_200000210301_100000738278 [1,1,0,0,0,0|1,1,0]=4 1137 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_100161115468_200025704644 [1,1,0,0,0,0|1,1,0]=4 1138 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_200025704644_100161115468 [1,1,0,0,0,0|1,1,0]=4 1139 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,1,0,0,0,0|1,1,0]=4 1140 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,1,0,0,0,0|1,1,0]=4 1141 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_100000690809_200025704644 [1,1,0,0,0,0|0,1,0]=3 1142 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_200025704644_100000690809 [1,1,0,0,0,0|0,1,0]=3 1143 B8R1.1 Cc1csc(c1)S[13CH3] 62a_100009876951_200025704644 [1,1,0,0,0,0|1,1,0]=4 1144 B8R1.1 Cc1csc(c1)S[13CH3] 62a_200025704644_100009876951 [1,1,0,0,0,0|1,1,0]=4 1145 B8R1.1 Cc1csc(n1)S[13CH3] 62a_100011291629_200025704644 [1,1,0,0,0,0|0,1,0]=3 1146 B8R1.1 Cc1csc(n1)S[13CH3] 62a_200025704644_100011291629 [1,1,0,0,0,0|0,1,0]=3 1147 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_100000686958_200025704644 [1,1,0,0,0,0|1,1,0]=4 1148 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_200025704644_100000686958 [1,1,0,0,0,0|1,1,0]=4 1149 B8R1.1 Cc1nsc(n1)S[13CH3] 62a_100000709739_200025704644 [1,1,0,0,0,0|1,1,0]=4 1150 B8R1.1 Cc1nsc(n1)S[13CH3] 62a_200025704644_100000709739 [1,1,0,0,0,0|1,1,0]=4 1151 B8R1.1 Cn1ccc(n1)O[13CH3] 34a_100012642153_200025704644 [1,1,0,0,0,0|2,0,0]=4 1152 B8R1.1 N#Cc1nc(cs1)O 271570a_203496583355_100009819034 [1,1,0,0,0,0|1,0,1]=4 1153 B8R1.1 NCc1ccc(s1)O 271570a_203496583355_100000737305 [1,1,0,0,0,0|2,0,0]=4 1154 B8R1.1 NCc1ncc(s1)O 271570a_203496583355_100016991807 [1,1,0,0,0,0|1,0,0]=3 1155 B8R1.1 O=Cc1nc(cs1)O 271570a_203496583355_100009816814 [1,1,0,0,0,0|1,0,1]=4 1156 B8R1.1 O=Cc1ncc(s1)O 271570a_203496583355_100000699580 [1,1,0,0,0,0|1,0,1]=4 1157 B8R1.1 OCc1cc(cs1)O 271570a_203496583355_100000238369 [1,1,0,0,0,0|2,0,0]=4 1158 B8R1.1 OCc1ccc(s1)O 271570a_203496583355_100000246291 [1,1,0,0,0,0|2,0,0]=4 1159 B8R1.1 OCc1nc(cs1)O 271570a_203496583355_100012000107 [1,1,0,0,0,0|1,0,0]=3 1160 B8R1.1 OCc1ncc(s1)O 271570a_203496583355_100000696694 [1,1,0,0,0,0|1,0,0]=3 1161 B8R1.1 [13CH3]Sc1ccc(s1)Br 62a_100010197418_200025704644 [1,1,0,0,0,0|1,1,0]=4 1162 B8R1.1 [13CH3]Sc1ccc(s1)Br 62a_200025704644_100010197418 [1,1,0,0,0,0|1,1,0]=4 1163 B8R1.1 [13CH3]Sc1nc(cs1)Br 62a_200016082925_200025704644 [1,1,0,0,0,0|0,1,0]=3 1164 B8R1.1 [13CH3]Sc1nc(cs1)Br 62a_200025704644_200016082925 [1,1,0,0,0,0|0,1,0]=3 1165 B8R1.1 [13CH3]Sc1nc(cs1)N 62a_200015188442_200025704644 [1,1,0,0,0,0|0,1,0]=3 1166 B8R1.1 [13CH3]Sc1nc(cs1)N 62a_200025704644_200015188442 [1,1,0,0,0,0|0,1,0]=3 1167 B8R1.1 [13CH3]Sc1nnc(s1)N 62a_100000738278_200025704644 [1,1,0,0,0,0|1,1,0]=4 1168 B8R1.1 [13CH3]Sc1nnc(s1)N 62a_200025704644_100000738278 [1,1,0,0,0,0|1,1,0]=4 1169 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,1,0,0,0,0|1,0,1]=4 1170 B8R1.7 C=C(C)c1ncc[nH]1 271570a_100000694244_100025796157 [1,1,0,0,0,0|1,0,1]=4 1171 B8R1.7 C=C(C)c1ncco1 271570a_100000694244_100011787736 [1,1,0,0,0,0|0,1,1]=4 1172 B8R1.7 C=C(C)c1nccs1 271570a_100000694244_100000211983 [1,1,0,0,0,0|0,0,1]=3 1173 B8R1.7 C=C(C)c1ncns1 271570a_100000694244_100000693119 [1,1,0,0,0,0|1,0,1]=4 1174 B8R1.7 C=C(C)c1nncs1 271570a_100000694244_100000739804 [1,1,0,0,0,0|1,0,1]=4 1175 B8R1.7 CN(C)c1ncns1 27a_100102631434_100000693119 [1,1,0,0,0,0|2,0,0]=4 1176 B8R1.7 CN(C)c1nncs1 27a_100102631434_100000739804 [1,1,0,0,0,0|2,0,0]=4 1177 B8R1.11 CCn1nccc1O 271570a_203496583355_100000728327 [1,1,0,0,0,0|2,0,0]=4 1178 B8R1.11 COc1n[nH]cc1O 271570a_203496583355_100010982843 [1,1,0,0,0,0|2,0,0]=4 1179 B8R1.11 CSc1nccn1C 62a_100000707724_200000210301 [1,1,0,0,0,0|1,1,0]=4 1180 B8R1.11 CSc1nccn1C 62a_200000210301_100000707724 [1,1,0,0,0,0|1,1,0]=4 1181 B8R1.11 CSc1sccc1Br 62a_100012361411_200000210301 [1,1,0,0,0,0|1,1,0]=4 1182 B8R1.11 CSc1sccc1Br 62a_200000210301_100012361411 [1,1,0,0,0,0|1,1,0]=4 1183 B8R1.11 CSc1sccc1C 62a_100010247149_200000210301 [1,1,0,0,0,0|1,1,0]=4 1184 B8R1.11 CSc1sccc1C 62a_200000210301_100010247149 [1,1,0,0,0,0|1,1,0]=4 1185 B8R1.11 CSc1sccc1O 271570a_203496583355_200010341309 [1,1,0,0,0,0|1,1,0]=4 1186 B8R1.11 Cc1ccsc1S[13CH3] 62a_100010247149_200025704644 [1,1,0,0,0,0|1,1,0]=4 1187 B8R1.11 Cc1ccsc1S[13CH3] 62a_200025704644_100010247149 [1,1,0,0,0,0|1,1,0]=4 1188 B8R1.11 Cn1ccnc1S[13CH3] 62a_100000707724_200025704644 [1,1,0,0,0,0|1,1,0]=4 1189 B8R1.11 Cn1ccnc1S[13CH3] 62a_200025704644_100000707724 [1,1,0,0,0,0|1,1,0]=4 1190 B8R1.11 OCc1sccc1O 271570a_203496583355_100000702026 [1,1,0,0,0,0|2,0,0]=4 1191 B8R1.11 [13CH3]Sc1sccc1Br 62a_100012361411_200025704644 [1,1,0,0,0,0|1,1,0]=4 1192 B8R1.11 [13CH3]Sc1sccc1Br 62a_200025704644_100012361411 [1,1,0,0,0,0|1,1,0]=4 1193 B10R1.1 CCNc1ccc(cn1)Br 27a_100015525214_100000686858 [0,1,0,0,0,1|2,0,0]=4 1194 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [0,1,0,0,0,1|2,0,0]=4 1195 B10R1.1 CCNc1ccc(nn1)C 27a_100015525214_100000744512 [0,1,0,0,0,1|2,0,0]=4 1196 B10R1.1 CCNc1ccc(nn1)O 271570a_203496583355_100000215268 [0,1,0,0,0,1|2,0,0]=4 1197 B10R1.1 CCNc1cnc(cn1)Br 27a_100015525214_100010187541 [0,1,0,0,0,1|2,0,0]=4 1198 B10R1.1 CCNc1cnc(cn1)C 27a_100015525214_100000074397 [0,1,0,0,0,1|2,0,0]=4 1199 B10R1.1 CCNc1cnc(cn1)F 27a_100015525214_100009856528 [0,1,0,0,0,1|2,0,0]=4 1200 B10R1.1 CCNc1ncc(cn1)Br 27a_100015525214_100000690281 [0,1,0,0,0,1|2,0,0]=4 1201 B10R1.1 CCNc1ncc(cn1)C 27a_100015525214_100000061069 [0,1,0,0,0,1|2,0,0]=4 1202 B10R1.1 CCNc1ncc(cn1)Cl 27a_100015525214_100011356929 [0,1,0,0,0,1|2,0,0]=4 1203 B10R1.1 CCNc1ncc(cn1)F 27a_100015525214_100000685220 [0,1,0,0,0,1|2,0,0]=4 1204 B10R1.1 CCOc1ccc(=O)[nH]c1 34a_100000075641_100000210202 [0,1,0,0,0,1|1,0,1]=4 1205 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [0,1,0,0,0,1|2,0,0]=4 1206 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [0,1,0,0,0,1|2,0,0]=4 1207 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [0,1,0,0,0,1|2,0,0]=4 1208 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [0,1,0,0,0,1|2,0,0]=4 1209 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [0,1,0,0,0,1|2,0,0]=4 1210 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [0,1,0,0,0,1|2,0,0]=4 1211 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [0,1,0,0,0,1|2,0,0]=4 1212 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [0,1,0,0,0,1|2,0,0]=4 1213 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [0,1,0,0,0,1|2,0,0]=4 1214 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [0,1,0,0,0,1|2,0,0]=4 1215 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [0,1,0,0,0,1|2,0,0]=4 1216 B10R1.1 CCOc1ccc(cn1)C 34a_100000759353_100000210202 [0,1,0,0,0,1|1,0,0]=3 1217 B10R1.1 CCOc1ccc(cn1)Cl 34a_100011215309_100000210202 [0,1,0,0,0,1|1,0,0]=3 1218 B10R1.1 CCOc1ccc(cn1)F 34a_100000742473_100000210202 [0,1,0,0,0,1|1,0,0]=3 1219 B10R1.1 CCOc1ccc(cn1)N 34a_100000729260_100000210202 [0,1,0,0,0,1|1,0,0]=3 1220 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [0,1,0,0,0,1|1,0,0]=3 1221 B10R1.1 CCOc1ccc(nc1)Br 34a_100000685995_100000210202 [0,1,0,0,0,1|1,0,0]=3 1222 B10R1.1 CCOc1ccc(nc1)Br 7a_100000685995_100000210202 [0,1,0,0,0,1|1,0,0]=3 1223 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [0,1,0,0,0,1|1,0,0]=3 1224 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [0,1,0,0,0,1|1,0,0]=3 1225 B10R1.1 CCOc1ccc(nc1)Cl 34a_100000744096_100000210202 [0,1,0,0,0,1|1,0,0]=3 1226 B10R1.1 CCOc1ccc(nc1)Cl 7a_100000744096_100000210202 [0,1,0,0,0,1|1,0,0]=3 1227 B10R1.1 CCOc1ccc(nc1)F 34a_100000688820_100000210202 [0,1,0,0,0,1|1,0,0]=3 1228 B10R1.1 CCOc1ccc(nc1)F 7a_100000688820_100000210202 [0,1,0,0,0,1|1,0,0]=3 1229 B10R1.1 CCOc1ccc(nc1)I 34a_100000687607_100000210202 [0,1,0,0,0,1|1,0,0]=3 1230 B10R1.1 CCOc1ccc(nc1)I 7a_100000687607_100000210202 [0,1,0,0,0,1|1,0,0]=3 1231 B10R1.1 CCOc1ccc(nc1)N 34a_100015188713_100000210202 [0,1,0,0,0,1|1,0,0]=3 1232 B10R1.1 CCOc1ccc(nc1)N 7a_100015188713_100000210202 [0,1,0,0,0,1|1,0,0]=3 1233 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [0,1,0,0,0,1|1,0,0]=3 1234 B10R1.1 CCOc1ccc(nn1)O 271570a_203496583355_100000757289 [0,1,0,0,0,1|1,0,0]=3 1235 B10R1.1 CCOc1cnc(cn1)Br 34a_100011934580_100000210202 [0,1,0,0,0,1|1,0,0]=3 1236 B10R1.1 CCOc1cnc(cn1)Cl 34a_100015839800_100000210202 [0,1,0,0,0,1|1,0,0]=3 1237 B10R1.1 CCOc1cnc(cn1)O 271570a_203496583355_200012356188 [0,1,0,0,0,1|1,0,0]=3 1238 B10R1.1 CCOc1cnc(nc1)Br 34a_100000730009_100000210202 [0,1,0,0,0,1|2,0,0]=4 1239 B10R1.1 CCOc1cnc(nc1)Br 7a_100000730009_100000210202 [0,1,0,0,0,1|2,0,0]=4 1240 B10R1.1 CCOc1cnc(nc1)C 34a_100000062939_100000210202 [0,1,0,0,0,1|2,0,0]=4 1241 B10R1.1 CCOc1cnc(nc1)C 7a_100000062939_100000210202 [0,1,0,0,0,1|2,0,0]=4 1242 B10R1.1 CCOc1cnc(nc1)Cl 34a_100000092845_100000210202 [0,1,0,0,0,1|2,0,0]=4 1243 B10R1.1 CCOc1cnc(nc1)Cl 7a_100000092845_100000210202 [0,1,0,0,0,1|2,0,0]=4 1244 B10R1.1 CCOc1cnc(nc1)F 34a_200009874573_100000210202 [0,1,0,0,0,1|2,0,0]=4 1245 B10R1.1 CCOc1cnc(nc1)F 7a_200009874573_100000210202 [0,1,0,0,0,1|2,0,0]=4 1246 B10R1.1 CCOc1cnc(nc1)N 34a_100000087137_100000210202 [0,1,0,0,0,1|2,0,0]=4 1247 B10R1.1 CCOc1cnc(nc1)N 7a_100000087137_100000210202 [0,1,0,0,0,1|2,0,0]=4 1248 B10R1.1 CCOc1cnc(nc1)O 271570a_203496583355_100000099823 [0,1,0,0,0,1|2,0,0]=4 1249 B10R1.1 CCOc1ncc(cn1)F 34a_100011934040_100000210202 [0,1,0,0,0,1|1,0,0]=3 1250 B10R1.1 CCOc1ncc(cn1)O 271570a_203496583355_100011934766 [0,1,0,0,0,1|1,0,0]=3 1251 B10R1.1 CCSc1ccc(=O)[nH]n1 62a_100000210202_100009820020 [0,1,0,0,0,1|1,1,0]=4 1252 B10R1.1 CCSc1ccc(=O)[nH]n1 62a_100009820020_100000210202 [0,1,0,0,0,1|1,1,0]=4 1253 B10R1.1 CCSc1ccc(cn1)Br 62a_100000210202_100000686858 [0,1,0,0,0,1|1,1,0]=4 1254 B10R1.1 CCSc1ccc(cn1)Br 62a_100000686858_100000210202 [0,1,0,0,0,1|1,1,0]=4 1255 B10R1.1 CCSc1ccc(cn1)C 62a_100000210202_100000754016 [0,1,0,0,0,1|1,1,0]=4 1256 B10R1.1 CCSc1ccc(cn1)C 62a_100011192072_100000210202 [0,1,0,0,0,1|1,1,0]=4 1257 B10R1.1 CCSc1ccc(cn1)Cl 62a_100000210202_100011356976 [0,1,0,0,0,1|1,1,0]=4 1258 B10R1.1 CCSc1ccc(cn1)Cl 62a_100011356976_100000210202 [0,1,0,0,0,1|1,1,0]=4 1259 B10R1.1 CCSc1ccc(cn1)F 62a_100000210202_100000744514 [0,1,0,0,0,1|1,1,0]=4 1260 B10R1.1 CCSc1ccc(cn1)F 62a_100000744514_100000210202 [0,1,0,0,0,1|1,1,0]=4 1261 B10R1.1 CCSc1ccc(cn1)N 62a_100000210202_100000737798 [0,1,0,0,0,1|1,1,0]=4 1262 B10R1.1 CCSc1ccc(cn1)N 62a_100000737798_100000210202 [0,1,0,0,0,1|1,1,0]=4 1263 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [0,1,0,0,0,1|1,1,0]=4 1264 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [0,1,0,0,0,1|1,1,0]=4 1265 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [0,1,0,0,0,1|1,1,0]=4 1266 B10R1.1 CCSc1ccc(nc1)Br 62a_100000210202_100009814638 [0,1,0,0,0,1|1,1,0]=4 1267 B10R1.1 CCSc1ccc(nc1)Br 62a_100009814638_100000210202 [0,1,0,0,0,1|1,1,0]=4 1268 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [0,1,0,0,0,1|1,1,0]=4 1269 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [0,1,0,0,0,1|1,1,0]=4 1270 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000034144_100000210202 [0,1,0,0,0,1|1,1,0]=4 1271 B10R1.1 CCSc1ccc(nc1)Cl 62a_100000210202_100000034144 [0,1,0,0,0,1|1,1,0]=4 1272 B10R1.1 CCSc1ccc(nc1)F 62a_100000042367_100000210202 [0,1,0,0,0,1|1,1,0]=4 1273 B10R1.1 CCSc1ccc(nc1)F 62a_100000210202_100000042367 [0,1,0,0,0,1|1,1,0]=4 1274 B10R1.1 CCSc1ccc(nc1)N 62a_100000187370_100000210202 [0,1,0,0,0,1|1,1,0]=4 1275 B10R1.1 CCSc1ccc(nc1)N 62a_100000210202_100000187370 [0,1,0,0,0,1|1,1,0]=4 1276 B10R1.1 CCSc1ccc(nn1)C 62a_100000210202_100000744512 [0,1,0,0,0,1|1,1,0]=4 1277 B10R1.1 CCSc1ccc(nn1)C 62a_100000744512_100000210202 [0,1,0,0,0,1|1,1,0]=4 1278 B10R1.1 CCSc1ccc(nn1)Cl 62a_100000068654_100000210202 [0,1,0,0,0,1|1,1,0]=4 1279 B10R1.1 CCSc1ccc(nn1)Cl 62a_100000210202_100000068654 [0,1,0,0,0,1|1,1,0]=4 1280 B10R1.1 CCSc1ccc(nn1)N 62a_100000210202_100010219413 [0,1,0,0,0,1|1,1,0]=4 1281 B10R1.1 CCSc1ccc(nn1)N 62a_100010219413_100000210202 [0,1,0,0,0,1|1,1,0]=4 1282 B10R1.1 CCSc1cnc(cn1)Br 62a_100000210202_100010187541 [0,1,0,0,0,1|1,1,0]=4 1283 B10R1.1 CCSc1cnc(cn1)Br 62a_100010187541_100000210202 [0,1,0,0,0,1|1,1,0]=4 1284 B10R1.1 CCSc1cnc(cn1)C 62a_100000210202_100011999403 [0,1,0,0,0,1|1,1,0]=4 1285 B10R1.1 CCSc1cnc(cn1)C 62a_100011999403_100000210202 [0,1,0,0,0,1|1,1,0]=4 1286 B10R1.1 CCSc1cnc(cn1)Cl 62a_100000210202_100010214907 [0,1,0,0,0,1|1,1,0]=4 1287 B10R1.1 CCSc1cnc(cn1)Cl 62a_100010214907_100000210202 [0,1,0,0,0,1|1,1,0]=4 1288 B10R1.1 CCSc1cnc(cn1)F 62a_100000210202_100009856528 [0,1,0,0,0,1|1,1,0]=4 1289 B10R1.1 CCSc1cnc(cn1)F 62a_100009856528_100000210202 [0,1,0,0,0,1|1,1,0]=4 1290 B10R1.1 CCSc1cnc(cn1)N 62a_100000210202_100000744751 [0,1,0,0,0,1|1,1,0]=4 1291 B10R1.1 CCSc1cnc(cn1)N 62a_100000744751_100000210202 [0,1,0,0,0,1|1,1,0]=4 1292 B10R1.1 CCSc1cnc(cn1)O 62a_100000210202_100015839800 [0,1,0,0,0,1|1,1,0]=4 1293 B10R1.1 CCSc1cnc(cn1)O 62a_100011934580_100000210202 [0,1,0,0,0,1|1,1,0]=4 1294 B10R1.1 CCSc1ncc(cn1)Br 62a_100000210202_100000690281 [0,1,0,0,0,1|1,1,0]=4 1295 B10R1.1 CCSc1ncc(cn1)Br 62a_100000690281_100000210202 [0,1,0,0,0,1|1,1,0]=4 1296 B10R1.1 CCSc1ncc(cn1)C 62a_100000061069_100000210202 [0,1,0,0,0,1|1,1,0]=4 1297 B10R1.1 CCSc1ncc(cn1)C 62a_100000210202_100000061069 [0,1,0,0,0,1|1,1,0]=4 1298 B10R1.1 CCSc1ncc(cn1)Cl 62a_100000210202_100011356929 [0,1,0,0,0,1|1,1,0]=4 1299 B10R1.1 CCSc1ncc(cn1)Cl 62a_100011356929_100000210202 [0,1,0,0,0,1|1,1,0]=4 1300 B10R1.1 CCSc1ncc(cn1)F 62a_100000210202_100000685220 [0,1,0,0,0,1|1,1,0]=4 1301 B10R1.1 CCSc1ncc(cn1)F 62a_100000685220_100000210202 [0,1,0,0,0,1|1,1,0]=4 1302 B10R1.1 CCSc1ncc(cn1)N 62a_100000068403_100000210202 [0,1,0,0,0,1|1,1,0]=4 1303 B10R1.1 CCSc1ncc(cn1)N 62a_100000210202_100000068403 [0,1,0,0,0,1|1,1,0]=4 1304 B10R1.1 CCSc1ncc(cn1)O 271570a_203496583355_200011939514 [0,1,0,0,0,1|1,1,0]=4 1305 B10R1.1 CCSc1ncc(cn1)O 62a_100000210202_100000092845 [0,1,0,0,0,1|1,1,0]=4 1306 B10R1.1 CCSc1ncc(cn1)O 62a_100000730009_100000210202 [0,1,0,0,0,1|1,1,0]=4 1307 B10R1.1 Cc1ccc(cn1)OCF 34a_100000745506_100015361967 [0,1,0,0,0,1|2,0,0]=4 1308 B10R1.1 Cc1ccc(cn1)OCF 7a_100000745506_100015361967 [0,1,0,0,0,1|2,0,0]=4 1309 B10R1.1 Cc1ccc(nc1)OCF 34a_100000759353_100015361967 [0,1,0,0,0,1|2,0,0]=4 1310 B10R1.1 FCOc1ccc(cn1)Cl 34a_100011215309_100015361967 [0,1,0,0,0,1|2,0,0]=4 1311 B10R1.1 FCOc1ccc(cn1)F 34a_100000742473_100015361967 [0,1,0,0,0,1|2,0,0]=4 1312 B10R1.1 FCOc1ccc(nc1)Br 34a_100000685995_100015361967 [0,1,0,0,0,1|2,0,0]=4 1313 B10R1.1 FCOc1ccc(nc1)Br 7a_100000685995_100015361967 [0,1,0,0,0,1|2,0,0]=4 1314 B10R1.1 FCOc1ccc(nc1)Cl 34a_100000744096_100015361967 [0,1,0,0,0,1|2,0,0]=4 1315 B10R1.1 FCOc1ccc(nc1)Cl 7a_100000744096_100015361967 [0,1,0,0,0,1|2,0,0]=4 1316 B10R1.1 FCOc1ccc(nc1)F 34a_100000688820_100015361967 [0,1,0,0,0,1|2,0,0]=4 1317 B10R1.1 FCOc1ccc(nc1)F 7a_100000688820_100015361967 [0,1,0,0,0,1|2,0,0]=4 1318 B10R1.1 FCOc1ccc(nc1)I 34a_100000687607_100015361967 [0,1,0,0,0,1|2,0,0]=4 1319 B10R1.1 FCOc1ccc(nc1)I 7a_100000687607_100015361967 [0,1,0,0,0,1|2,0,0]=4 1320 B10R1.1 FCOc1cnc(cn1)Br 34a_100011934580_100015361967 [0,1,0,0,0,1|2,0,0]=4 1321 B10R1.1 FCOc1cnc(cn1)Cl 34a_100015839800_100015361967 [0,1,0,0,0,1|2,0,0]=4 1322 B10R1.1 FCOc1ncc(cn1)F 34a_100011934040_100015361967 [0,1,0,0,0,1|2,0,0]=4 1323 B10R1.1 Nc1ccc(cn1)OCF 34a_100015188713_100015361967 [0,1,0,0,0,1|2,0,0]=4 1324 B10R1.1 Nc1ccc(cn1)OCF 7a_100015188713_100015361967 [0,1,0,0,0,1|2,0,0]=4 1325 B10R1.1 Nc1ccc(nc1)OCF 34a_100000729260_100015361967 [0,1,0,0,0,1|2,0,0]=4 1326 B10R1.4 CCCc1ncncc1O 271570a_203496583355_100009816987 [0,1,0,0,0,1|2,0,0]=4 1327 B10R1.4 CCNc1ncccc1Br 27a_100015525214_100000696092 [0,1,0,0,0,1|2,0,0]=4 1328 B10R1.4 CCNc1nccnc1C 27a_100015525214_100011999405 [0,1,0,0,0,1|2,0,0]=4 1329 B10R1.4 CCNc1nccnc1F 27a_100015525214_200010125657 [0,1,0,0,0,1|2,0,0]=4 1330 B10R1.4 CCNc1ncncc1C 27a_100015525214_100011998708 [0,1,0,0,0,1|2,0,0]=4 1331 B10R1.4 CCNc1ncncc1F 27a_100015525214_100000069762 [0,1,0,0,0,1|2,0,0]=4 1332 B10R1.4 CCNc1ncncc1N 27a_100015525214_100000709731 [0,1,0,0,0,1|2,0,0]=4 1333 B10R1.4 CCNc1nnccc1C 27a_100015525214_100000089043 [0,1,0,0,0,1|2,0,0]=4 1334 B10R1.4 CCOc1cccc[n+]1[O-] 7a_100000211761_100000210202 [0,1,0,0,0,1|1,0,1]=4 1335 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [0,1,0,0,0,1|2,0,0]=4 1336 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [0,1,0,0,0,1|2,0,0]=4 1337 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [0,1,0,0,0,1|2,0,0]=4 1338 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [0,1,0,0,0,1|2,0,0]=4 1339 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [0,1,0,0,0,1|2,0,0]=4 1340 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [0,1,0,0,0,1|2,0,0]=4 1341 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [0,1,0,0,0,1|2,0,0]=4 1342 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [0,1,0,0,0,1|2,0,0]=4 1343 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [0,1,0,0,0,1|2,0,0]=4 1344 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [0,1,0,0,0,1|2,0,0]=4 1345 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [0,1,0,0,0,1|2,0,0]=4 1346 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [0,1,0,0,0,1|2,0,0]=4 1347 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [0,1,0,0,0,1|2,0,0]=4 1348 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [0,1,0,0,0,1|1,0,0]=3 1349 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [0,1,0,0,0,1|1,0,0]=3 1350 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [0,1,0,0,0,1|1,0,0]=3 1351 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [0,1,0,0,0,1|1,0,0]=3 1352 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [0,1,0,0,0,1|1,0,0]=3 1353 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [0,1,0,0,0,1|1,0,0]=3 1354 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [0,1,0,0,0,1|1,0,0]=3 1355 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [0,1,0,0,0,1|1,0,0]=3 1356 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [0,1,0,0,0,1|1,0,0]=3 1357 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [0,1,0,0,0,1|1,0,0]=3 1358 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [0,1,0,0,0,1|1,0,0]=3 1359 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [0,1,0,0,0,1|1,0,0]=3 1360 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [0,1,0,0,0,1|1,0,0]=3 1361 B10R1.4 CCOc1cccoc1=O 34a_100000077404_100000210202 [0,1,0,0,0,1|1,1,0]=4 1362 B10R1.4 CCOc1cccoc1=O 7a_100000077404_100000210202 [0,1,0,0,0,1|1,1,0]=4 1363 B10R1.4 CCOc1ccncc1Br 34a_100011996408_100000210202 [0,1,0,0,0,1|2,0,0]=4 1364 B10R1.4 CCOc1ccncc1C 34a_100000694293_100000210202 [0,1,0,0,0,1|2,0,0]=4 1365 B10R1.4 CCOc1ccncc1Cl 34a_100011997054_100000210202 [0,1,0,0,0,1|2,0,0]=4 1366 B10R1.4 CCOc1ccncc1F 34a_200000081243_100000210202 [0,1,0,0,0,1|2,0,0]=4 1367 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [0,1,0,0,0,1|1,0,0]=3 1368 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [0,1,0,0,0,1|1,0,0]=3 1369 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [0,1,0,0,0,1|1,0,0]=3 1370 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [0,1,0,0,0,1|1,0,0]=3 1371 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [0,1,0,0,0,1|1,0,0]=3 1372 B10R1.4 CCOc1cncnc1N 7a_100000112926_100000210202 [0,1,0,0,0,1|2,0,0]=4 1373 B10R1.4 CCOc1coccc1=O 34a_100000060831_100000210202 [0,1,0,0,0,1|1,1,0]=4 1374 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [0,1,0,0,0,1|1,0,0]=3 1375 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [0,1,0,0,0,1|1,0,0]=3 1376 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [0,1,0,0,0,1|1,0,0]=3 1377 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [0,1,0,0,0,1|1,0,0]=3 1378 B10R1.4 CCOc1nccnc1C 34a_100000766352_100000210202 [0,1,0,0,0,1|1,0,0]=3 1379 B10R1.4 CCOc1nccnc1O 271570a_203496583355_200010128176 [0,1,0,0,0,1|1,0,0]=3 1380 B10R1.4 CCSc1cccnc1Br 62a_100000210202_100010202626 [0,1,0,0,0,1|1,1,0]=4 1381 B10R1.4 CCSc1cccnc1Br 62a_100010202626_100000210202 [0,1,0,0,0,1|1,1,0]=4 1382 B10R1.4 CCSc1cccnc1C 62a_100000210202_100000751574 [0,1,0,0,0,1|1,1,0]=4 1383 B10R1.4 CCSc1cccnc1C 62a_100000751574_100000210202 [0,1,0,0,0,1|1,1,0]=4 1384 B10R1.4 CCSc1cccnc1Cl 62a_100000036424_100000210202 [0,1,0,0,0,1|1,1,0]=4 1385 B10R1.4 CCSc1cccnc1Cl 62a_100000210202_100000036424 [0,1,0,0,0,1|1,1,0]=4 1386 B10R1.4 CCSc1cccnc1F 62a_100000210202_100009816115 [0,1,0,0,0,1|1,1,0]=4 1387 B10R1.4 CCSc1cccnc1F 62a_100009816115_100000210202 [0,1,0,0,0,1|1,1,0]=4 1388 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [0,1,0,0,0,1|1,1,0]=4 1389 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [0,1,0,0,0,1|1,1,0]=4 1390 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [0,1,0,0,0,1|1,1,0]=4 1391 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [0,1,0,0,0,1|1,1,0]=4 1392 B10R1.4 CCSc1cnccc1Br 62a_100000210202_100010138639 [0,1,0,0,0,1|1,1,0]=4 1393 B10R1.4 CCSc1cnccc1Br 62a_100010138639_100000210202 [0,1,0,0,0,1|1,1,0]=4 1394 B10R1.4 CCSc1cnccc1C 62a_100000210202_100000761580 [0,1,0,0,0,1|1,1,0]=4 1395 B10R1.4 CCSc1cnccc1C 62a_100000761580_100000210202 [0,1,0,0,0,1|1,1,0]=4 1396 B10R1.4 CCSc1cnccc1Cl 62a_100000210202_100009995489 [0,1,0,0,0,1|1,1,0]=4 1397 B10R1.4 CCSc1cnccc1Cl 62a_100009995489_100000210202 [0,1,0,0,0,1|1,1,0]=4 1398 B10R1.4 CCSc1cnccc1F 62a_100000210202_100009820683 [0,1,0,0,0,1|1,1,0]=4 1399 B10R1.4 CCSc1cnccc1F 62a_100009820683_100000210202 [0,1,0,0,0,1|1,1,0]=4 1400 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [0,1,0,0,0,1|1,1,0]=4 1401 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [0,1,0,0,0,1|1,1,0]=4 1402 B10R1.4 CCSc1ncc[nH]c1=O 62a_100000210202_100000763361 [0,1,0,0,0,1|1,1,0]=4 1403 B10R1.4 CCSc1ncccc1Br 62a_100000210202_100000696092 [0,1,0,0,0,1|1,1,0]=4 1404 B10R1.4 CCSc1ncccc1Br 62a_100000696092_100000210202 [0,1,0,0,0,1|1,1,0]=4 1405 B10R1.4 CCSc1ncccc1C 62a_100000210202_100000751373 [0,1,0,0,0,1|1,1,0]=4 1406 B10R1.4 CCSc1ncccc1C 62a_100000751373_100000210202 [0,1,0,0,0,1|1,1,0]=4 1407 B10R1.4 CCSc1ncccc1Cl 62a_100000210202_100011356963 [0,1,0,0,0,1|1,1,0]=4 1408 B10R1.4 CCSc1ncccc1Cl 62a_100011356963_100000210202 [0,1,0,0,0,1|1,1,0]=4 1409 B10R1.4 CCSc1ncccc1F 62a_100000210202_100000685392 [0,1,0,0,0,1|1,1,0]=4 1410 B10R1.4 CCSc1ncccc1F 62a_100000685392_100000210202 [0,1,0,0,0,1|1,1,0]=4 1411 B10R1.4 CCSc1ncccc1N 62a_100000210202_100000688686 [0,1,0,0,0,1|1,1,0]=4 1412 B10R1.4 CCSc1ncccc1N 62a_100000688686_100000210202 [0,1,0,0,0,1|1,1,0]=4 1413 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [0,1,0,0,0,1|1,1,0]=4 1414 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [0,1,0,0,0,1|1,1,0]=4 1415 B10R1.4 CCSc1nccnc1C 62a_100000210202_100011999405 [0,1,0,0,0,1|1,1,0]=4 1416 B10R1.4 CCSc1nccnc1C 62a_100011999405_100000210202 [0,1,0,0,0,1|1,1,0]=4 1417 B10R1.4 CCSc1nccnc1Cl 62a_100000210202_100010886584 [0,1,0,0,0,1|1,1,0]=4 1418 B10R1.4 CCSc1nccnc1Cl 62a_100010886584_100000210202 [0,1,0,0,0,1|1,1,0]=4 1419 B10R1.4 CCSc1nccnc1F 62a_100000210202_200010125657 [0,1,0,0,0,1|1,1,0]=4 1420 B10R1.4 CCSc1nccnc1F 62a_200010125657_100000210202 [0,1,0,0,0,1|1,1,0]=4 1421 B10R1.4 CCSc1nccnc1N 62a_100000210202_100000747729 [0,1,0,0,0,1|1,1,0]=4 1422 B10R1.4 CCSc1nccnc1N 62a_100000747729_100000210202 [0,1,0,0,0,1|1,1,0]=4 1423 B10R1.4 CCSc1ncncc1C 62a_100000210202_100011998708 [0,1,0,0,0,1|1,1,0]=4 1424 B10R1.4 CCSc1ncncc1C 62a_100011998708_100000210202 [0,1,0,0,0,1|1,1,0]=4 1425 B10R1.4 CCSc1ncncc1F 62a_100000069762_100000210202 [0,1,0,0,0,1|1,1,0]=4 1426 B10R1.4 CCSc1ncncc1F 62a_100000210202_100000069762 [0,1,0,0,0,1|1,1,0]=4 1427 B10R1.4 CCSc1ncncc1N 62a_100000210202_100000709731 [0,1,0,0,0,1|1,1,0]=4 1428 B10R1.4 CCSc1ncncc1N 62a_100000709731_100000210202 [0,1,0,0,0,1|1,1,0]=4 1429 B10R1.4 CCSc1nnccc1C 62a_100000210202_100000089043 [0,1,0,0,0,1|1,1,0]=4 1430 B10R1.4 Cc1ccncc1OCF 34a_100011997053_100015361967 [0,1,0,0,0,1|2,0,0]=4 1431 B10R1.4 Cc1ccncc1OCF 7a_100011997053_100015361967 [0,1,0,0,0,1|2,0,0]=4 1432 B10R1.4 Cc1ncccc1OCF 34a_100000745507_100015361967 [0,1,0,0,0,1|2,0,0]=4 1433 B10R1.4 Cc1ncccc1OCF 7a_100000745507_100015361967 [0,1,0,0,0,1|2,0,0]=4 1434 B10R1.4 Cc1nccnc1OCF 34a_100000766352_100015361967 [0,1,0,0,0,1|2,0,0]=4 1435 B10R1.4 FCOc1cccnc1Br 34a_100000744436_100015361967 [0,1,0,0,0,1|2,0,0]=4 1436 B10R1.4 FCOc1cccnc1Br 7a_100000744436_100015361967 [0,1,0,0,0,1|2,0,0]=4 1437 B10R1.4 FCOc1cccnc1Cl 34a_100000757616_100015361967 [0,1,0,0,0,1|2,0,0]=4 1438 B10R1.4 FCOc1cccnc1Cl 7a_100000757616_100015361967 [0,1,0,0,0,1|2,0,0]=4 1439 B10R1.4 FCOc1cccnc1F 34a_100000061740_100015361967 [0,1,0,0,0,1|2,0,0]=4 1440 B10R1.4 FCOc1cccnc1F 7a_100000061740_100015361967 [0,1,0,0,0,1|2,0,0]=4 1441 B10R1.4 FCOc1cccnc1I 34a_100000034122_100015361967 [0,1,0,0,0,1|2,0,0]=4 1442 B10R1.4 FCOc1cccnc1I 7a_100000034122_100015361967 [0,1,0,0,0,1|2,0,0]=4 1443 B10R1.4 FCOc1cnccc1Cl 34a_100011996695_100015361967 [0,1,0,0,0,1|2,0,0]=4 1444 B10R1.4 FCOc1cnccc1I 34a_100000050107_100015361967 [0,1,0,0,0,1|2,0,0]=4 1445 B10R1.4 FCOc1ncccc1Cl 34a_100011290957_100015361967 [0,1,0,0,0,1|2,0,0]=4 1446 B10R1.4 FCOc1ncccc1F 34a_100011219419_100015361967 [0,1,0,0,0,1|2,0,0]=4 1447 B10R1.4 Nc1cccnc1OCF 34a_100000746358_100015361967 [0,1,0,0,0,1|2,0,0]=4 1448 B10R1.4 Nc1ccncc1OCF 34a_100000753702_100015361967 [0,1,0,0,0,1|2,0,0]=4 1449 B10R1.4 Nc1ncccc1OCF 34a_100000211975_100015361967 [0,1,0,0,0,1|2,0,0]=4 1450 B10R1.4 Nc1ncccc1OCF 7a_100000211975_100015361967 [0,1,0,0,0,1|2,0,0]=4 1451 B10R1.10 CCNc1c[n+](ccn1)[O-] 27a_100015525214_100009880115 [0,1,0,0,0,1|2,0,0]=4 1452 B10R1.10 CCNc1cc(ccn1)F 27a_100015525214_100000764206 [0,1,0,0,0,1|2,0,0]=4 1453 B10R1.10 CCNc1cc(cnn1)C 27a_100015525214_100000070100 [0,1,0,0,0,1|2,0,0]=4 1454 B10R1.10 CCNc1cc(ncn1)C 27a_100015525214_100000744208 [0,1,0,0,0,1|2,0,0]=4 1455 B10R1.10 CCNc1cc(ncn1)F 27a_100015525214_200009880791 [0,1,0,0,0,1|2,0,0]=4 1456 B10R1.10 CCNc1cc(ncn1)N 27a_100015525214_100000701291 [0,1,0,0,0,1|2,0,0]=4 1457 B10R1.10 CCNc1cc(ncn1)O 271570a_203496583355_200000242512 [0,1,0,0,0,1|2,0,0]=4 1458 B10R1.10 CCNc1cc(ncn1)O 27a_100015525214_100000765262 [0,1,0,0,0,1|2,0,0]=4 1459 B10R1.10 CCNc1cc[nH]c(=O)n1 27a_100015525214_200000134032 [0,1,0,0,0,1|2,0,0]=4 1460 B10R1.10 CCNc1cccc(n1)F 27a_100015525214_100009815982 [0,1,0,0,0,1|2,0,0]=4 1461 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [0,1,0,0,0,1|2,0,0]=4 1462 B10R1.10 CCNc1ccnc(n1)C 27a_100015525214_100000749937 [0,1,0,0,0,1|2,0,0]=4 1463 B10R1.10 CCNc1ccnc(n1)N 27a_100015525214_100000055538 [0,1,0,0,0,1|2,0,0]=4 1464 B10R1.10 CCNc1ccnc(n1)O 271570a_203496583355_100011649949 [0,1,0,0,0,1|2,0,0]=4 1465 B10R1.10 CCNc1cncc(n1)C 27a_100015525214_100000754123 [0,1,0,0,0,1|2,0,0]=4 1466 B10R1.10 CCNc1cncc(n1)Cl 27a_100015525214_100010892449 [0,1,0,0,0,1|2,0,0]=4 1467 B10R1.10 CCNc1cncc(n1)F 27a_100015525214_200009863489 [0,1,0,0,0,1|2,0,0]=4 1468 B10R1.10 CCNc1nccc(n1)C 27a_100015525214_100000750684 [0,1,0,0,0,1|2,0,0]=4 1469 B10R1.10 CCNc1nccc(n1)N 27a_100015525214_100000757536 [0,1,0,0,0,1|2,0,0]=4 1470 B10R1.10 CCNc1nccc(n1)O 271570a_203496583355_100012002086 [0,1,0,0,0,1|2,0,0]=4 1471 B10R1.10 CCNc1nccc(n1)O 27a_100015525214_100011649813 [0,1,0,0,0,1|2,0,0]=4 1472 B10R1.10 CCNc1ncnc(n1)N 27a_100015525214_100000123831 [0,1,0,0,0,1|2,0,0]=4 1473 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [0,1,0,0,0,1|1,0,0]=3 1474 B10R1.10 CCOc1cc(cnn1)C 34a_100000766097_100000210202 [0,1,0,0,0,1|1,0,0]=3 1475 B10R1.10 CCOc1cc(ncn1)O 271570a_203496583355_100000765465 [0,1,0,0,0,1|1,0,0]=3 1476 B10R1.10 CCOc1cc[nH]c(=O)c1 34a_100000032262_100000210202 [0,1,0,0,0,1|2,0,0]=4 1477 B10R1.10 CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000210202 [0,1,0,0,0,1|1,0,1]=4 1478 B10R1.10 CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000210202 [0,1,0,0,0,1|1,0,1]=4 1479 B10R1.10 CCOc1cccc(=O)[nH]1 34a_100000033347_100000210202 [0,1,0,0,0,1|1,0,1]=4 1480 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [0,1,0,0,0,1|2,0,0]=4 1481 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [0,1,0,0,0,1|2,0,0]=4 1482 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [0,1,0,0,0,1|2,0,0]=4 1483 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [0,1,0,0,0,1|2,0,0]=4 1484 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [0,1,0,0,0,1|2,0,0]=4 1485 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [0,1,0,0,0,1|2,0,0]=4 1486 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [0,1,0,0,0,1|2,0,0]=4 1487 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [0,1,0,0,0,1|2,0,0]=4 1488 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [0,1,0,0,0,1|2,0,0]=4 1489 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [0,1,0,0,0,1|2,0,0]=4 1490 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [0,1,0,0,0,1|2,0,0]=4 1491 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [0,1,0,0,0,1|2,0,0]=4 1492 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [0,1,0,0,0,1|1,0,0]=3 1493 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [0,1,0,0,0,1|1,0,0]=3 1494 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [0,1,0,0,0,1|2,0,0]=4 1495 B10R1.10 CCOc1ccnc(c1)Cl 34a_100000762945_100000210202 [0,1,0,0,0,1|2,0,0]=4 1496 B10R1.10 CCOc1ccnc(c1)F 34a_100000732698_100000210202 [0,1,0,0,0,1|2,0,0]=4 1497 B10R1.10 CCOc1ccnc(c1)N 34a_100011834064_100000210202 [0,1,0,0,0,1|2,0,0]=4 1498 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [0,1,0,0,0,1|2,0,0]=4 1499 B10R1.10 CCOc1ccnc(n1)O 271570a_203496583355_100011649779 [0,1,0,0,0,1|1,0,0]=3 1500 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [0,1,0,0,0,1|1,0,0]=3 1501 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [0,1,0,0,0,1|1,0,0]=3 1502 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [0,1,0,0,0,1|1,0,0]=3 1503 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [0,1,0,0,0,1|1,0,0]=3 1504 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [0,1,0,0,0,1|1,0,0]=3 1505 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [0,1,0,0,0,1|1,0,0]=3 1506 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [0,1,0,0,0,1|1,0,0]=3 1507 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [0,1,0,0,0,1|1,0,0]=3 1508 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [0,1,0,0,0,1|1,0,0]=3 1509 B10R1.10 CCOc1cncc(n1)O 271570a_203496583355_100000757043 [0,1,0,0,0,1|1,0,0]=3 1510 B10R1.10 CCOc1cnnc(c1)Cl 34a_200010734679_100000210202 [0,1,0,0,0,1|2,0,0]=4 1511 B10R1.10 CCOc1cnnc(c1)N 34a_200015193112_100000210202 [0,1,0,0,0,1|2,0,0]=4 1512 B10R1.10 CCSc1c[n+](ccn1)[O-] 62a_100000210202_100009880115 [0,1,0,0,0,1|1,1,0]=4 1513 B10R1.10 CCSc1cc(=O)[nH]cn1 62a_100012002517_100000210202 [0,1,0,0,0,1|1,1,0]=4 1514 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [0,1,0,0,0,1|1,1,0]=4 1515 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [0,1,0,0,0,1|1,1,0]=4 1516 B10R1.10 CCSc1cc(ccn1)Cl 62a_100000210202_100010167805 [0,1,0,0,0,1|1,1,0]=4 1517 B10R1.10 CCSc1cc(ccn1)Cl 62a_100010167805_100000210202 [0,1,0,0,0,1|1,1,0]=4 1518 B10R1.10 CCSc1cc(ccn1)F 62a_100000210202_100000764206 [0,1,0,0,0,1|1,1,0]=4 1519 B10R1.10 CCSc1cc(ccn1)F 62a_100000764206_100000210202 [0,1,0,0,0,1|1,1,0]=4 1520 B10R1.10 CCSc1cc(ccn1)N 62a_100000210202_100009814236 [0,1,0,0,0,1|1,1,0]=4 1521 B10R1.10 CCSc1cc(ccn1)N 62a_100009814236_100000210202 [0,1,0,0,0,1|1,1,0]=4 1522 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [0,1,0,0,0,1|1,1,0]=4 1523 B10R1.10 CCSc1cc(cnn1)C 62a_100000070100_100000210202 [0,1,0,0,0,1|1,1,0]=4 1524 B10R1.10 CCSc1cc(cnn1)C 62a_100000210202_100000070100 [0,1,0,0,0,1|1,1,0]=4 1525 B10R1.10 CCSc1cc(cnn1)N 62a_100000210202_100011996757 [0,1,0,0,0,1|1,1,0]=4 1526 B10R1.10 CCSc1cc(cnn1)N 62a_100011996757_100000210202 [0,1,0,0,0,1|1,1,0]=4 1527 B10R1.10 CCSc1cc(cnn1)O 62a_100000210202_200010734679 [0,1,0,0,0,1|1,1,0]=4 1528 B10R1.10 CCSc1cc(ncn1)C 62a_100000210202_100000744208 [0,1,0,0,0,1|1,1,0]=4 1529 B10R1.10 CCSc1cc(ncn1)C 62a_100000744208_100000210202 [0,1,0,0,0,1|1,1,0]=4 1530 B10R1.10 CCSc1cc(ncn1)Cl 62a_100000210202_100010161198 [0,1,0,0,0,1|1,1,0]=4 1531 B10R1.10 CCSc1cc(ncn1)Cl 62a_100010161198_100000210202 [0,1,0,0,0,1|1,1,0]=4 1532 B10R1.10 CCSc1cc(ncn1)F 62a_100000210202_200009880791 [0,1,0,0,0,1|1,1,0]=4 1533 B10R1.10 CCSc1cc(ncn1)F 62a_200009880791_100000210202 [0,1,0,0,0,1|1,1,0]=4 1534 B10R1.10 CCSc1cc(ncn1)N 62a_100000210202_100000701291 [0,1,0,0,0,1|1,1,0]=4 1535 B10R1.10 CCSc1cc(ncn1)N 62a_100000701291_100000210202 [0,1,0,0,0,1|1,1,0]=4 1536 B10R1.10 CCSc1cc(ncn1)O 62a_100000210202_100000765262 [0,1,0,0,0,1|1,1,0]=4 1537 B10R1.10 CCSc1cc[nH]c(=O)n1 62a_100000210202_200000134032 [0,1,0,0,0,1|1,1,0]=4 1538 B10R1.10 CCSc1cccc(n1)Br 62a_100000210202_100000684672 [0,1,0,0,0,1|1,1,0]=4 1539 B10R1.10 CCSc1cccc(n1)Br 62a_100000684672_100000210202 [0,1,0,0,0,1|1,1,0]=4 1540 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [0,1,0,0,0,1|1,1,0]=4 1541 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [0,1,0,0,0,1|1,1,0]=4 1542 B10R1.10 CCSc1cccc(n1)Cl 62a_100000051397_100000210202 [0,1,0,0,0,1|1,1,0]=4 1543 B10R1.10 CCSc1cccc(n1)Cl 62a_100000210202_100000051397 [0,1,0,0,0,1|1,1,0]=4 1544 B10R1.10 CCSc1cccc(n1)F 62a_100000210202_100009815982 [0,1,0,0,0,1|1,1,0]=4 1545 B10R1.10 CCSc1cccc(n1)F 62a_100009815982_100000210202 [0,1,0,0,0,1|1,1,0]=4 1546 B10R1.10 CCSc1cccc(n1)N 62a_100000210202_100000740741 [0,1,0,0,0,1|1,1,0]=4 1547 B10R1.10 CCSc1cccc(n1)N 62a_100000740741_100000210202 [0,1,0,0,0,1|1,1,0]=4 1548 B10R1.10 CCSc1ccnc(n1)C 62a_100000210202_100000749937 [0,1,0,0,0,1|1,1,0]=4 1549 B10R1.10 CCSc1ccnc(n1)C 62a_100000749937_100000210202 [0,1,0,0,0,1|1,1,0]=4 1550 B10R1.10 CCSc1ccnc(n1)Cl 62a_100000210202_100010154678 [0,1,0,0,0,1|1,1,0]=4 1551 B10R1.10 CCSc1ccnc(n1)Cl 62a_100010154678_100000210202 [0,1,0,0,0,1|1,1,0]=4 1552 B10R1.10 CCSc1ccnc(n1)N 62a_100000055538_100000210202 [0,1,0,0,0,1|1,1,0]=4 1553 B10R1.10 CCSc1ccnc(n1)N 62a_100000210202_100000055538 [0,1,0,0,0,1|1,1,0]=4 1554 B10R1.10 CCSc1cncc(c1)Br 62a_100000210202_100000728054 [0,1,0,0,0,1|1,1,0]=4 1555 B10R1.10 CCSc1cncc(c1)Br 62a_100000728054_100000210202 [0,1,0,0,0,1|1,1,0]=4 1556 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [0,1,0,0,0,1|1,1,0]=4 1557 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [0,1,0,0,0,1|1,1,0]=4 1558 B10R1.10 CCSc1cncc(c1)Cl 62a_100000049639_100000210202 [0,1,0,0,0,1|1,1,0]=4 1559 B10R1.10 CCSc1cncc(c1)Cl 62a_100000210202_100000049639 [0,1,0,0,0,1|1,1,0]=4 1560 B10R1.10 CCSc1cncc(c1)F 62a_100000210202_100000744099 [0,1,0,0,0,1|1,1,0]=4 1561 B10R1.10 CCSc1cncc(c1)F 62a_100000744099_100000210202 [0,1,0,0,0,1|1,1,0]=4 1562 B10R1.10 CCSc1cncc(c1)N 62a_100000210202_100000687067 [0,1,0,0,0,1|1,1,0]=4 1563 B10R1.10 CCSc1cncc(c1)N 62a_100000687067_100000210202 [0,1,0,0,0,1|1,1,0]=4 1564 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [0,1,0,0,0,1|1,1,0]=4 1565 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [0,1,0,0,0,1|1,1,0]=4 1566 B10R1.10 CCSc1cncc(n1)C 62a_100000210202_100000754123 [0,1,0,0,0,1|1,1,0]=4 1567 B10R1.10 CCSc1cncc(n1)C 62a_100000754123_100000210202 [0,1,0,0,0,1|1,1,0]=4 1568 B10R1.10 CCSc1cncc(n1)Cl 62a_100000210202_100010892449 [0,1,0,0,0,1|1,1,0]=4 1569 B10R1.10 CCSc1cncc(n1)Cl 62a_100010892449_100000210202 [0,1,0,0,0,1|1,1,0]=4 1570 B10R1.10 CCSc1cncc(n1)F 62a_100000210202_200009863489 [0,1,0,0,0,1|1,1,0]=4 1571 B10R1.10 CCSc1cncc(n1)F 62a_200009863489_100000210202 [0,1,0,0,0,1|1,1,0]=4 1572 B10R1.10 CCSc1cncc(n1)N 62a_100000210202_100000747728 [0,1,0,0,0,1|1,1,0]=4 1573 B10R1.10 CCSc1cncc(n1)N 62a_100000747728_100000210202 [0,1,0,0,0,1|1,1,0]=4 1574 B10R1.10 CCSc1cncc(n1)O 62a_100000210202_100011269956 [0,1,0,0,0,1|1,1,0]=4 1575 B10R1.10 CCSc1nccc(n1)C 62a_100000210202_100011243806 [0,1,0,0,0,1|1,1,0]=4 1576 B10R1.10 CCSc1nccc(n1)C 62a_100011243806_100000210202 [0,1,0,0,0,1|1,1,0]=4 1577 B10R1.10 CCSc1nccc(n1)N 62a_100000210202_100000757536 [0,1,0,0,0,1|1,1,0]=4 1578 B10R1.10 CCSc1nccc(n1)N 62a_100000757536_100000210202 [0,1,0,0,0,1|1,1,0]=4 1579 B10R1.10 CCSc1nccc(n1)O 62a_100000210202_100011649813 [0,1,0,0,0,1|1,1,0]=4 1580 B10R1.10 CCSc1ncnc(n1)N 62a_100000123831_100000210202 [0,1,0,0,0,1|1,1,0]=4 1581 B10R1.10 CCSc1ncnc(n1)N 62a_100000210202_100000123831 [0,1,0,0,0,1|1,1,0]=4 1582 B10R1.10 Cc1cncc(c1)OCF 34a_100011830280_100015361967 [0,1,0,0,0,1|2,0,0]=4 1583 B10R1.10 Cc1cncc(c1)OCF 7a_100011830280_100015361967 [0,1,0,0,0,1|2,0,0]=4 1584 B10R1.10 Cc1cnnc(c1)OCF 34a_100000766097_100015361967 [0,1,0,0,0,1|2,0,0]=4 1585 B10R1.10 FCOc1cccc(n1)F 34a_100011432558_100015361967 [0,1,0,0,0,1|2,0,0]=4 1586 B10R1.10 FCOc1cncc(c1)Br 34a_100000754920_100015361967 [0,1,0,0,0,1|2,0,0]=4 1587 B10R1.10 FCOc1cncc(c1)Br 7a_100000754920_100015361967 [0,1,0,0,0,1|2,0,0]=4 1588 B10R1.10 FCOc1cncc(c1)Cl 7a_100000032511_100015361967 [0,1,0,0,0,1|2,0,0]=4 1589 B10R1.10 FCOc1cncc(c1)F 34a_100011830296_100015361967 [0,1,0,0,0,1|2,0,0]=4 1590 B10R1.10 FCOc1cncc(c1)F 7a_100011830296_100015361967 [0,1,0,0,0,1|2,0,0]=4 1591 B10R1.10 Nc1cncc(c1)OCF 34a_100011997051_100015361967 [0,1,0,0,0,1|2,0,0]=4 1592 B10R1.17 C#CCOc1cccnc1 34a_100000210849_100000184674 [0,1,0,0,0,1|1,0,1]=4 1593 B10R1.17 C#CCOc1cccnc1 7a_100000210849_100000038162 [0,1,0,0,0,1|1,0,1]=4 1594 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [0,1,0,0,0,1|1,0,1]=4 1595 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [0,1,0,0,0,1|1,0,1]=4 1596 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [0,1,0,0,0,1|2,0,0]=4 1597 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [0,1,0,0,0,1|2,0,0]=4 1598 B10R1.17 CCCCc1cccnn1 271570a_100020621405_100016991348 [0,1,0,0,0,1|2,0,0]=4 1599 B10R1.17 CCCCc1ccncn1 271570a_100020621405_100000703185 [0,1,0,0,0,1|2,0,0]=4 1600 B10R1.17 CCCCc1cnccn1 271570a_100020621405_100000758340 [0,1,0,0,0,1|2,0,0]=4 1601 B10R1.17 CCCCc1ncccn1 271570a_100020621405_100000211032 [0,1,0,0,0,1|2,0,0]=4 1602 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [0,1,0,0,0,1|2,0,0]=4 1603 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [0,1,0,0,0,1|2,0,0]=4 1604 B10R1.17 CCCOc1cccnc1 34a_100000210849_100000210303 [0,1,0,0,0,1|1,0,0]=3 1605 B10R1.17 CCCOc1cccnc1 7a_100000210849_100000210303 [0,1,0,0,0,1|1,0,0]=3 1606 B10R1.17 CCCOc1ccncc1 34a_100000212176_100000210303 [0,1,0,0,0,1|2,0,0]=4 1607 B10R1.17 CCCOc1ccnnc1 34a_100015204005_100000210303 [0,1,0,0,0,1|2,0,0]=4 1608 B10R1.17 CCCOc1cncnc1 7a_100000754086_100000210303 [0,1,0,0,0,1|2,0,0]=4 1609 B10R1.17 CCCSc1ccccn1 62a_100000210303_100011216584 [0,1,0,0,0,1|1,1,0]=4 1610 B10R1.17 CCCSc1ccccn1 62a_100011216584_100000210303 [0,1,0,0,0,1|1,1,0]=4 1611 B10R1.17 CCCSc1cccnc1 62a_100000210063_100000210303 [0,1,0,0,0,1|1,1,0]=4 1612 B10R1.17 CCCSc1cccnc1 62a_100000210303_100000210063 [0,1,0,0,0,1|1,1,0]=4 1613 B10R1.17 CCCSc1cccnn1 62a_100000210303_100016991348 [0,1,0,0,0,1|1,1,0]=4 1614 B10R1.17 CCCSc1cccnn1 62a_100016991348_100000210303 [0,1,0,0,0,1|1,1,0]=4 1615 B10R1.17 CCCSc1ccncn1 62a_100000210303_100000703185 [0,1,0,0,0,1|1,1,0]=4 1616 B10R1.17 CCCSc1ccncn1 62a_100000703185_100000210303 [0,1,0,0,0,1|1,1,0]=4 1617 B10R1.17 CCCSc1cnccn1 62a_100000210303_100000211759 [0,1,0,0,0,1|1,1,0]=4 1618 B10R1.17 CCCSc1cnccn1 62a_100000211759_100000210303 [0,1,0,0,0,1|1,1,0]=4 1619 B10R1.17 CCCSc1ncccn1 62a_100000210303_100000211032 [0,1,0,0,0,1|1,1,0]=4 1620 B10R1.17 CCCSc1ncccn1 62a_100000211032_100000210303 [0,1,0,0,0,1|1,1,0]=4 1621 B10R1.17 CCNCc1ccccn1 207a_100015525214_100000209966 [0,1,0,0,0,1|2,0,0]=4 1622 B10R1.17 CCNCc1ccccn1 2230a_100015525214_100000721315 [0,1,0,0,0,1|2,0,0]=4 1623 B10R1.17 CCNCc1ccccn1 270004a_100015525214_100000209966 [0,1,0,0,0,1|2,0,0]=4 1624 B10R1.17 CCNCc1cccnc1 207a_100015525214_100000209961 [0,1,0,0,0,1|2,0,0]=4 1625 B10R1.17 CCNCc1cccnc1 2230a_100015525214_100000741622 [0,1,0,0,0,1|2,0,0]=4 1626 B10R1.17 CCNCc1cccnc1 270004a_100015525214_100000209961 [0,1,0,0,0,1|2,0,0]=4 1627 B10R1.17 CCNCc1cccnn1 2230a_100015525214_100016990269 [0,1,0,0,0,1|2,0,0]=4 1628 B10R1.17 CCNCc1cccnn1 2230a_100159270163_100000210202 [0,1,0,0,0,1|2,0,0]=4 1629 B10R1.17 CCNCc1cnccn1 2230a_100015525214_100016995436 [0,1,0,0,0,1|2,0,0]=4 1630 B10R1.17 CCNCc1cnccn1 270004a_100015525214_100000749867 [0,1,0,0,0,1|2,0,0]=4 1631 B10R1.17 CCNCc1ncccn1 2230a_100015525214_100000703007 [0,1,0,0,0,1|2,0,0]=4 1632 B10R1.17 CCNCc1ncccn1 270004a_100015525214_100011532527 [0,1,0,0,0,1|2,0,0]=4 1633 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [0,1,0,0,0,1|2,0,0]=4 1634 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [0,1,0,0,0,1|2,0,0]=4 1635 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [0,1,0,0,0,1|2,0,0]=4 1636 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [0,1,0,0,0,1|1,0,0]=3 1637 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [0,1,0,0,0,1|1,0,0]=3 1638 B10R1.17 CCOCc1cccnn1 34a_100121572206_100016990269 [0,1,0,0,0,1|1,0,0]=3 1639 B10R1.17 CCOCc1cnccn1 34a_100121572206_100016995436 [0,1,0,0,0,1|1,0,0]=3 1640 B10R1.17 CCOCc1cncnc1 34a_100121572206_100015196519 [0,1,0,0,0,1|2,0,0]=4 1641 B10R1.17 CCOCc1ncccn1 34a_100121572206_100000703007 [0,1,0,0,0,1|1,0,0]=3 1642 B10R1.17 CCSCc1ccccn1 62a_100000210202_100000721315 [0,1,0,0,0,1|1,1,0]=4 1643 B10R1.17 CCSCc1ccccn1 62a_100000721315_100000210202 [0,1,0,0,0,1|1,1,0]=4 1644 B10R1.17 CCSCc1cccnc1 62a_100000210202_100000741622 [0,1,0,0,0,1|1,1,0]=4 1645 B10R1.17 CCSCc1cccnc1 62a_100000741622_100000210202 [0,1,0,0,0,1|1,1,0]=4 1646 B10R1.17 CCSCc1cccnn1 62a_100000210202_100016990269 [0,1,0,0,0,1|1,1,0]=4 1647 B10R1.17 CCSCc1cccnn1 62a_100016990269_100000210202 [0,1,0,0,0,1|1,1,0]=4 1648 B10R1.17 CCSCc1cnccn1 62a_100000210202_100016995436 [0,1,0,0,0,1|1,1,0]=4 1649 B10R1.17 CCSCc1cnccn1 62a_100016995436_100000210202 [0,1,0,0,0,1|1,1,0]=4 1650 B10R1.17 CCSCc1ncccn1 62a_100000210202_100000703007 [0,1,0,0,0,1|1,1,0]=4 1651 B10R1.17 CCSCc1ncccn1 62a_100000703007_100000210202 [0,1,0,0,0,1|1,1,0]=4 1652 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [0,1,0,0,0,1|2,0,0]=4 1653 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [0,1,0,0,0,1|2,0,0]=4 1654 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [0,1,0,0,0,1|2,0,0]=4 1655 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [0,1,0,0,0,1|2,0,0]=4 1656 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [0,1,0,0,0,1|2,0,0]=4 1657 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [0,1,0,0,0,1|2,0,0]=4 1658 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [0,1,0,0,0,1|2,0,0]=4 1659 B10R1.17 COCCc1cnccn1 34a_100011349526_200000210301 [0,1,0,0,0,1|2,0,0]=4 1660 B10R1.17 COCSc1ccccn1 62a_100000766300_100011216584 [0,1,0,0,0,1|1,1,0]=4 1661 B10R1.17 COCSc1ccccn1 62a_100011216584_100000766300 [0,1,0,0,0,1|1,1,0]=4 1662 B10R1.17 COCSc1cccnc1 62a_100000210063_100000766300 [0,1,0,0,0,1|1,1,0]=4 1663 B10R1.17 COCSc1cccnc1 62a_100000766300_100000210063 [0,1,0,0,0,1|1,1,0]=4 1664 B10R1.17 COCSc1cccnn1 62a_100000766300_100016991348 [0,1,0,0,0,1|1,1,0]=4 1665 B10R1.17 COCSc1cccnn1 62a_100016991348_100000766300 [0,1,0,0,0,1|1,1,0]=4 1666 B10R1.17 COCSc1ccncn1 62a_100000703185_100000766300 [0,1,0,0,0,1|1,1,0]=4 1667 B10R1.17 COCSc1ccncn1 62a_100000766300_100000703185 [0,1,0,0,0,1|1,1,0]=4 1668 B10R1.17 COCSc1cnccn1 62a_100000211759_100000766300 [0,1,0,0,0,1|1,1,0]=4 1669 B10R1.17 COCSc1cnccn1 62a_100000766300_100000211759 [0,1,0,0,0,1|1,1,0]=4 1670 B10R1.17 COCSc1ncccn1 62a_100000211032_100000766300 [0,1,0,0,0,1|1,1,0]=4 1671 B10R1.17 COCSc1ncccn1 62a_100000766300_100000211032 [0,1,0,0,0,1|1,1,0]=4 1672 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [0,1,0,0,0,1|2,0,0]=4 1673 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [0,1,0,0,0,1|2,0,0]=4 1674 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [0,1,0,0,0,1|2,0,0]=4 1675 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [0,1,0,0,0,1|2,0,0]=4 1676 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [0,1,0,0,0,1|2,0,0]=4 1677 B10R1.17 CSCOc1cccnc1 34a_100000210849_100011218213 [0,1,0,0,0,1|1,0,0]=3 1678 B10R1.17 CSCOc1ccncc1 34a_100000212176_100011218213 [0,1,0,0,0,1|2,0,0]=4 1679 B10R1.17 CSCOc1ccnnc1 34a_100015204005_100011218213 [0,1,0,0,0,1|2,0,0]=4 1680 B10R1.17 CSCSc1ccccn1 62a_100011216584_100011218213 [0,1,0,0,0,1|1,1,0]=4 1681 B10R1.17 CSCSc1ccccn1 62a_100011218213_100011216584 [0,1,0,0,0,1|1,1,0]=4 1682 B10R1.17 CSCSc1cccnc1 62a_100000210063_100011218213 [0,1,0,0,0,1|1,1,0]=4 1683 B10R1.17 CSCSc1cccnc1 62a_100011218213_100000210063 [0,1,0,0,0,1|1,1,0]=4 1684 B10R1.17 CSCSc1cccnn1 62a_100011218213_100016991348 [0,1,0,0,0,1|1,1,0]=4 1685 B10R1.17 CSCSc1cccnn1 62a_100016991348_100011218213 [0,1,0,0,0,1|1,1,0]=4 1686 B10R1.17 CSCSc1ccncn1 62a_100000703185_100011218213 [0,1,0,0,0,1|1,1,0]=4 1687 B10R1.17 CSCSc1ccncn1 62a_100011218213_100000703185 [0,1,0,0,0,1|1,1,0]=4 1688 B10R1.17 CSCSc1cnccn1 62a_100000211759_100011218213 [0,1,0,0,0,1|1,1,0]=4 1689 B10R1.17 CSCSc1cnccn1 62a_100011218213_100000211759 [0,1,0,0,0,1|1,1,0]=4 1690 B10R1.17 CSCSc1ncccn1 62a_100000211032_100011218213 [0,1,0,0,0,1|1,1,0]=4 1691 B10R1.17 CSCSc1ncccn1 62a_100011218213_100000211032 [0,1,0,0,0,1|1,1,0]=4 1692 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [0,1,0,0,0,1|2,0,0]=4 1693 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [0,1,0,0,0,1|2,0,0]=4 1694 B10R1.17 FCCOc1cccnc1 34a_100000210849_100011217306 [0,1,0,0,0,1|1,0,0]=3 1695 B10R1.17 FCCOc1cccnc1 7a_100000210849_100011217306 [0,1,0,0,0,1|1,0,0]=3 1696 B10R1.17 FCCOc1ccncc1 34a_100000212176_100011217306 [0,1,0,0,0,1|2,0,0]=4 1697 B10R1.17 FCCOc1ccnnc1 34a_100015204005_100011217306 [0,1,0,0,0,1|2,0,0]=4 1698 B10R1.17 FCCOc1cncnc1 7a_100000754086_100011217306 [0,1,0,0,0,1|2,0,0]=4 1699 B10R1.17 FCCSc1ccccn1 62a_100011216584_100011217306 [0,1,0,0,0,1|1,1,0]=4 1700 B10R1.17 FCCSc1ccccn1 62a_100011217306_100011216584 [0,1,0,0,0,1|1,1,0]=4 1701 B10R1.17 FCCSc1cccnc1 62a_100000210063_100011217306 [0,1,0,0,0,1|1,1,0]=4 1702 B10R1.17 FCCSc1cccnc1 62a_100011217306_100000210063 [0,1,0,0,0,1|1,1,0]=4 1703 B10R1.17 FCCSc1cccnn1 62a_100011217306_100016991348 [0,1,0,0,0,1|1,1,0]=4 1704 B10R1.17 FCCSc1cccnn1 62a_100016991348_100011217306 [0,1,0,0,0,1|1,1,0]=4 1705 B10R1.17 FCCSc1ccncn1 62a_100000703185_100011217306 [0,1,0,0,0,1|1,1,0]=4 1706 B10R1.17 FCCSc1ccncn1 62a_100011217306_100000703185 [0,1,0,0,0,1|1,1,0]=4 1707 B10R1.17 FCCSc1cnccn1 62a_100000211759_100011217306 [0,1,0,0,0,1|1,1,0]=4 1708 B10R1.17 FCCSc1cnccn1 62a_100011217306_100000211759 [0,1,0,0,0,1|1,1,0]=4 1709 B10R1.17 FCCSc1ncccn1 62a_100000211032_100011217306 [0,1,0,0,0,1|1,1,0]=4 1710 B10R1.17 FCCSc1ncccn1 62a_100011217306_100000211032 [0,1,0,0,0,1|1,1,0]=4 1711 B10R1.17 N#CCOc1cccnc1 7a_100000210849_100011215382 [0,1,0,0,0,1|1,0,1]=4 1712 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [0,1,0,0,0,1|1,0,1]=4 1713 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [0,1,0,0,0,1|1,0,1]=4 1714 B10R1.17 OCCNc1cccnn1 27a_100000210304_100016991348 [0,1,0,0,0,1|2,0,0]=4 1715 B10R1.17 OCCNc1ccncn1 27a_100000210304_100000703185 [0,1,0,0,0,1|2,0,0]=4 1716 B10R1.17 OCCNc1cnccn1 27a_100000210304_100000211759 [0,1,0,0,0,1|2,0,0]=4 1717 B10R1.17 OCCNc1ncccn1 27a_100000210304_100000211032 [0,1,0,0,0,1|2,0,0]=4 1718 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [0,1,0,0,0,1|2,0,0]=4 1719 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [0,1,0,0,0,1|2,0,0]=4 1720 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [0,1,0,0,0,1|1,0,0]=3 1721 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [0,1,0,0,0,1|1,0,0]=3 1722 B10R1.17 OCCOc1ccncc1 34a_100000212176_100000211926 [0,1,0,0,0,1|2,0,0]=4 1723 B10R1.17 OCCOc1ccnnc1 34a_100015204005_100000211926 [0,1,0,0,0,1|2,0,0]=4 1724 B10R1.17 OCCOc1cncnc1 7a_100000754086_100000211926 [0,1,0,0,0,1|2,0,0]=4 1725 B10R1.17 OCCSc1ccccn1 62a_100000211926_100011216584 [0,1,0,0,0,1|1,1,0]=4 1726 B10R1.17 OCCSc1ccccn1 62a_100011216584_100000211926 [0,1,0,0,0,1|1,1,0]=4 1727 B10R1.17 OCCSc1cccnc1 62a_100000210063_100000211926 [0,1,0,0,0,1|1,1,0]=4 1728 B10R1.17 OCCSc1cccnc1 62a_100000211926_100000210063 [0,1,0,0,0,1|1,1,0]=4 1729 B10R1.17 OCCSc1cccnn1 62a_100000211926_100016991348 [0,1,0,0,0,1|1,1,0]=4 1730 B10R1.17 OCCSc1cccnn1 62a_100016991348_100000211926 [0,1,0,0,0,1|1,1,0]=4 1731 B10R1.17 OCCSc1ccncn1 62a_100000211926_100000703185 [0,1,0,0,0,1|1,1,0]=4 1732 B10R1.17 OCCSc1ccncn1 62a_100000703185_100000211926 [0,1,0,0,0,1|1,1,0]=4 1733 B10R1.17 OCCSc1cnccn1 62a_100000211759_100000211926 [0,1,0,0,0,1|1,1,0]=4 1734 B10R1.17 OCCSc1cnccn1 62a_100000211926_100000211759 [0,1,0,0,0,1|1,1,0]=4 1735 B10R1.17 OCCSc1ncccn1 62a_100000211032_100000211926 [0,1,0,0,0,1|1,1,0]=4 1736 B10R1.17 OCCSc1ncccn1 62a_100000211926_100000211032 [0,1,0,0,0,1|1,1,0]=4 1737 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [0,1,0,0,0,1|2,0,0]=4 1738 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [0,1,0,0,0,1|2,0,0]=4 1739 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [0,1,0,0,0,1|2,0,0]=4 1740 B10R1.17 [13CH3]OCCc1cnccn1 34a_100011349526_200025704644 [0,1,0,0,0,1|2,0,0]=4 1741 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [0,1,0,0,0,1|2,0,0]=4 1742 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [0,1,0,0,0,1|2,0,0]=4 1743 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [0,1,0,0,0,1|2,0,0]=4 1744 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [0,1,0,0,0,1|2,0,0]=4 1745 B10R1.18 CC(C)Nc1cccnn1 27a_100138425928_100016991348 [0,1,0,0,0,1|2,0,0]=4 1746 B10R1.18 CC(C)Nc1ccncn1 27a_100138425928_100000703185 [0,1,0,0,0,1|2,0,0]=4 1747 B10R1.18 CC(C)Nc1cnccn1 27a_100138425928_100000211759 [0,1,0,0,0,1|2,0,0]=4 1748 B10R1.18 CC(C)Nc1ncccn1 27a_100138425928_100000211032 [0,1,0,0,0,1|2,0,0]=4 1749 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [0,1,0,0,0,1|2,0,0]=4 1750 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [0,1,0,0,0,1|2,0,0]=4 1751 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [0,1,0,0,0,1|1,0,0]=3 1752 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [0,1,0,0,0,1|1,0,0]=3 1753 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [0,1,0,0,0,1|2,0,0]=4 1754 B10R1.18 CC(C)Oc1ccnnc1 34a_100015204005_100000210206 [0,1,0,0,0,1|2,0,0]=4 1755 B10R1.18 CC(C)Oc1cncnc1 7a_100000754086_100000210206 [0,1,0,0,0,1|2,0,0]=4 1756 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [0,1,0,0,0,1|1,1,0]=4 1757 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [0,1,0,0,0,1|1,1,0]=4 1758 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [0,1,0,0,0,1|1,1,0]=4 1759 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [0,1,0,0,0,1|1,1,0]=4 1760 B10R1.18 CC(C)Sc1cccnn1 62a_100000210206_100016991348 [0,1,0,0,0,1|1,1,0]=4 1761 B10R1.18 CC(C)Sc1cccnn1 62a_100016991348_100000210206 [0,1,0,0,0,1|1,1,0]=4 1762 B10R1.18 CC(C)Sc1ccncn1 62a_100000210206_100000703185 [0,1,0,0,0,1|1,1,0]=4 1763 B10R1.18 CC(C)Sc1ccncn1 62a_100000703185_100000210206 [0,1,0,0,0,1|1,1,0]=4 1764 B10R1.18 CC(C)Sc1cnccn1 62a_100000210206_100000211759 [0,1,0,0,0,1|1,1,0]=4 1765 B10R1.18 CC(C)Sc1cnccn1 62a_100000211759_100000210206 [0,1,0,0,0,1|1,1,0]=4 1766 B10R1.18 CC(C)Sc1ncccn1 62a_100000210206_100000211032 [0,1,0,0,0,1|1,1,0]=4 1767 B10R1.18 CC(C)Sc1ncccn1 62a_100000211032_100000210206 [0,1,0,0,0,1|1,1,0]=4 1768 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,2,0,0,0,0|2,0,0]=4 1769 B10R1.14 CNC(C)c1nc(cs1)C 2230a_100015185622_200000210301 [0,2,0,0,0,0|2,0,0]=4 1770 B10R1.14 CNC(C)c1nc(cs1)C 269862a_106832991636_100011857357 [0,2,0,0,0,0|2,0,0]=4 1771 B10R1.14 CNC(C)c1ncc(s1)C 269862a_106832991636_100011857370 [0,2,0,0,0,0|2,0,0]=4 1772 B10R1.14 COC(=O)c1nc(cs1)O 271570a_203496583355_100012360158 [0,2,0,0,0,0|2,0,0]=4 1773 B10R1.14 COC(=O)c1ncc(s1)O 271570a_203496583355_100010191244 [0,2,0,0,0,0|2,0,0]=4 1774 B10R1.14 Cc1csc(n1)C(C)N[13CH3] 2230a_100015185622_200025704644 [0,2,0,0,0,0|2,0,0]=4 1775 B10R1.16 C#CCSc1nc(cs1)Br 62a_100000038162_200016082925 [0,2,0,0,0,0|0,1,1]=4 1776 B10R1.16 C#CCSc1nc(cs1)C 62a_100000038162_100011291629 [0,2,0,0,0,0|0,1,1]=4 1777 B10R1.16 C#CCSc1nc(cs1)N 62a_100000038162_200015188442 [0,2,0,0,0,0|0,1,1]=4 1778 B10R1.16 C#CCSc1ncc(s1)C 62a_100000038162_100000690809 [0,2,0,0,0,0|0,1,1]=4 1779 B10R1.16 C=CCSc1nc(cs1)Br 62a_100000210623_200016082925 [0,2,0,0,0,0|0,1,1]=4 1780 B10R1.16 C=CCSc1nc(cs1)Br 62a_200016082925_100000210623 [0,2,0,0,0,0|0,1,1]=4 1781 B10R1.16 C=CCSc1nc(cs1)C 62a_100000210623_100011291629 [0,2,0,0,0,0|0,1,1]=4 1782 B10R1.16 C=CCSc1nc(cs1)C 62a_100011291629_100000210623 [0,2,0,0,0,0|0,1,1]=4 1783 B10R1.16 C=CCSc1nc(cs1)N 62a_100000210623_200015188442 [0,2,0,0,0,0|0,1,1]=4 1784 B10R1.16 C=CCSc1nc(cs1)N 62a_200015188442_100000210623 [0,2,0,0,0,0|0,1,1]=4 1785 B10R1.16 C=CCSc1ncc(s1)C 62a_100000210623_100000690809 [0,2,0,0,0,0|0,1,1]=4 1786 B10R1.16 C=CCSc1ncc(s1)C 62a_100000690809_100000210623 [0,2,0,0,0,0|0,1,1]=4 1787 B10R1.16 CC=NNc1nc(cs1)C 4a_100000692962_200000210099 [0,2,0,0,0,0|1,0,1]=4 1788 B10R1.16 CCCCc1cc(cs1)C 271570a_100020621405_100009876951 [0,2,0,0,0,0|2,0,0]=4 1789 B10R1.16 CCCCc1ccc(s1)Br 271570a_100020621405_100010197418 [0,2,0,0,0,0|2,0,0]=4 1790 B10R1.16 CCCCc1ccc(s1)C 271570a_100020621405_100000761539 [0,2,0,0,0,0|2,0,0]=4 1791 B10R1.16 CCCCc1nc(c[nH]1)C 271570a_100020621405_100161115468 [0,2,0,0,0,0|2,0,0]=4 1792 B10R1.16 CCCCc1nc(cs1)Br 271570a_100020621405_200016082925 [0,2,0,0,0,0|1,0,0]=3 1793 B10R1.16 CCCCc1nc(cs1)C 271570a_100020621405_100011291629 [0,2,0,0,0,0|1,0,0]=3 1794 B10R1.16 CCCCc1nc(cs1)N 271570a_100020621405_200015188442 [0,2,0,0,0,0|1,0,0]=3 1795 B10R1.16 CCCCc1nc(ns1)C 271570a_100020621405_100000709739 [0,2,0,0,0,0|2,0,0]=4 1796 B10R1.16 CCCCc1ncc(s1)C 271570a_100020621405_100000690809 [0,2,0,0,0,0|1,0,0]=3 1797 B10R1.16 CCCCc1nnc(s1)C 271570a_100020621405_100000686958 [0,2,0,0,0,0|2,0,0]=4 1798 B10R1.16 CCCCc1nnc(s1)N 271570a_100020621405_100000738278 [0,2,0,0,0,0|2,0,0]=4 1799 B10R1.16 CCCOc1ccn(n1)C 34a_100012642153_100000210303 [0,2,0,0,0,0|2,0,0]=4 1800 B10R1.16 CCCSc1cc(cs1)C 62a_100000210303_100009876951 [0,2,0,0,0,0|1,1,0]=4 1801 B10R1.16 CCCSc1cc(cs1)C 62a_100009876951_100000210303 [0,2,0,0,0,0|1,1,0]=4 1802 B10R1.16 CCCSc1ccc(s1)Br 62a_100000210303_100010197418 [0,2,0,0,0,0|1,1,0]=4 1803 B10R1.16 CCCSc1ccc(s1)Br 62a_100010197418_100000210303 [0,2,0,0,0,0|1,1,0]=4 1804 B10R1.16 CCCSc1ccc(s1)C 62a_100000031368_100000210303 [0,2,0,0,0,0|1,1,0]=4 1805 B10R1.16 CCCSc1ccc(s1)C 62a_100000210303_100000031368 [0,2,0,0,0,0|1,1,0]=4 1806 B10R1.16 CCCSc1nc(c[nH]1)C 62a_100000210303_100161115468 [0,2,0,0,0,0|1,1,0]=4 1807 B10R1.16 CCCSc1nc(c[nH]1)C 62a_100161115468_100000210303 [0,2,0,0,0,0|1,1,0]=4 1808 B10R1.16 CCCSc1nc(cs1)Br 62a_100000210303_200016082925 [0,2,0,0,0,0|0,1,0]=3 1809 B10R1.16 CCCSc1nc(cs1)Br 62a_200016082925_100000210303 [0,2,0,0,0,0|0,1,0]=3 1810 B10R1.16 CCCSc1nc(cs1)C 62a_100000210303_100011291629 [0,2,0,0,0,0|0,1,0]=3 1811 B10R1.16 CCCSc1nc(cs1)C 62a_100011291629_100000210303 [0,2,0,0,0,0|0,1,0]=3 1812 B10R1.16 CCCSc1nc(cs1)N 62a_100000210303_200015188442 [0,2,0,0,0,0|0,1,0]=3 1813 B10R1.16 CCCSc1nc(cs1)N 62a_200015188442_100000210303 [0,2,0,0,0,0|0,1,0]=3 1814 B10R1.16 CCCSc1nc(ns1)C 62a_100000210303_100000709739 [0,2,0,0,0,0|1,1,0]=4 1815 B10R1.16 CCCSc1nc(ns1)C 62a_100000709739_100000210303 [0,2,0,0,0,0|1,1,0]=4 1816 B10R1.16 CCCSc1ncc(s1)C 62a_100000210303_100000690809 [0,2,0,0,0,0|0,1,0]=3 1817 B10R1.16 CCCSc1ncc(s1)C 62a_100000690809_100000210303 [0,2,0,0,0,0|0,1,0]=3 1818 B10R1.16 CCCSc1nnc(s1)C 62a_100000210303_100000686958 [0,2,0,0,0,0|1,1,0]=4 1819 B10R1.16 CCCSc1nnc(s1)C 62a_100000686958_100000210303 [0,2,0,0,0,0|1,1,0]=4 1820 B10R1.16 CCCSc1nnc(s1)N 62a_100000210303_100000738278 [0,2,0,0,0,0|1,1,0]=4 1821 B10R1.16 CCCSc1nnc(s1)N 62a_100000738278_100000210303 [0,2,0,0,0,0|1,1,0]=4 1822 B10R1.16 CCNCc1cc(cs1)Br 207a_100015525214_100000211722 [0,2,0,0,0,0|2,0,0]=4 1823 B10R1.16 CCNCc1cc(cs1)Br 2230a_100000741024_100000210202 [0,2,0,0,0,0|2,0,0]=4 1824 B10R1.16 CCNCc1cc(cs1)Br 2230a_100015525214_100000746031 [0,2,0,0,0,0|2,0,0]=4 1825 B10R1.16 CCNCc1cc(cs1)Br 270004a_100015525214_100000211722 [0,2,0,0,0,0|2,0,0]=4 1826 B10R1.16 CCNCc1cc(cs1)Br 34a_100000741024_100000210202 [0,2,0,0,0,0|2,0,0]=4 1827 B10R1.16 CCNCc1cc(cs1)C 207a_100015525214_100102525248 [0,2,0,0,0,0|2,0,0]=4 1828 B10R1.16 CCNCc1cc(cs1)C 2230a_100015204214_100000210202 [0,2,0,0,0,0|2,0,0]=4 1829 B10R1.16 CCNCc1cc(cs1)C 270004a_100015525214_100102525248 [0,2,0,0,0,0|2,0,0]=4 1830 B10R1.16 CCNCc1cc(cs1)C 34a_100015204214_100000210202 [0,2,0,0,0,0|2,0,0]=4 1831 B10R1.16 CCNCc1cc(cs1)Cl 207a_100015525214_100000102487 [0,2,0,0,0,0|2,0,0]=4 1832 B10R1.16 CCNCc1cc(cs1)Cl 270004a_100015525214_100000102487 [0,2,0,0,0,0|2,0,0]=4 1833 B10R1.16 CCNCc1cc(cs1)I 207a_100015525214_100010179861 [0,2,0,0,0,0|2,0,0]=4 1834 B10R1.16 CCNCc1ccc(s1)Br 207a_100015525214_100000179771 [0,2,0,0,0,0|2,0,0]=4 1835 B10R1.16 CCNCc1ccc(s1)Br 2230a_100015525214_100000708592 [0,2,0,0,0,0|2,0,0]=4 1836 B10R1.16 CCNCc1ccc(s1)Br 270004a_100015525214_100000179771 [0,2,0,0,0,0|2,0,0]=4 1837 B10R1.16 CCNCc1ccc(s1)C 207a_100015525214_100000211121 [0,2,0,0,0,0|2,0,0]=4 1838 B10R1.16 CCNCc1ccc(s1)C 2230a_100000238518_100000210202 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.16 CCNCc1ccc(s1)C 270004a_100015525214_100000211121 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.16 CCNCc1ccc(s1)Cl 207a_100015525214_100000242774 [0,2,0,0,0,0|2,0,0]=4 1841 B10R1.16 CCNCc1ccc(s1)Cl 2230a_100000737310_100000210202 [0,2,0,0,0,0|2,0,0]=4 1842 B10R1.16 CCNCc1ccc(s1)Cl 2230a_100015525214_100000185097 [0,2,0,0,0,0|2,0,0]=4 1843 B10R1.16 CCNCc1ccc(s1)Cl 270004a_100015525214_100000242774 [0,2,0,0,0,0|2,0,0]=4 1844 B10R1.16 CCNCc1nc(c[nH]1)C 207a_100015525214_100000082322 [0,2,0,0,0,0|2,0,0]=4 1845 B10R1.16 CCNCc1nc(c[nH]1)C 270004a_100015525214_100000082322 [0,2,0,0,0,0|2,0,0]=4 1846 B10R1.16 CCNCc1nc(cs1)Br 270004a_100015525214_100009816814 [0,2,0,0,0,0|1,0,0]=3 1847 B10R1.16 CCNCc1nc(cs1)C 207a_100015525214_100000756994 [0,2,0,0,0,0|1,0,0]=3 1848 B10R1.16 CCNCc1nc(cs1)C 2230a_100015183719_100000210202 [0,2,0,0,0,0|1,0,0]=3 1849 B10R1.16 CCNCc1nc(cs1)C 270004a_100015525214_100000756994 [0,2,0,0,0,0|1,0,0]=3 1850 B10R1.16 CCNCc1ncc(o1)C 2230a_100138411809_100000210202 [0,2,0,0,0,0|1,1,0]=4 1851 B10R1.16 CCNCc1ncc(o1)C 34a_100138411809_100000210202 [0,2,0,0,0,0|1,1,0]=4 1852 B10R1.16 CCNCc1ncc(s1)Br 270004a_100015525214_100000699580 [0,2,0,0,0,0|1,0,0]=3 1853 B10R1.16 CCNCc1ncc(s1)C 207a_100015525214_100011361622 [0,2,0,0,0,0|1,0,0]=3 1854 B10R1.16 CCNCc1ncc(s1)C 270004a_100015525214_100011361622 [0,2,0,0,0,0|1,0,0]=3 1855 B10R1.16 CCNCc1ncc(s1)Cl 270004a_100015525214_100000699884 [0,2,0,0,0,0|1,0,0]=3 1856 B10R1.16 CCNCc1nnc(s1)C 2230a_100015525214_100000688753 [0,2,0,0,0,0|2,0,0]=4 1857 B10R1.16 CCOCc1cc(cs1)Br 34a_100000238369_100000210202 [0,2,0,0,0,0|1,0,0]=3 1858 B10R1.16 CCOCc1cc(cs1)Br 34a_100121572206_100000746031 [0,2,0,0,0,0|1,0,0]=3 1859 B10R1.16 CCOCc1cc(cs1)Br 7a_100000238369_100000210202 [0,2,0,0,0,0|1,0,0]=3 1860 B10R1.16 CCOCc1cc(cs1)C 34a_200000068372_100000210202 [0,2,0,0,0,0|1,0,0]=3 1861 B10R1.16 CCOCc1cc(cs1)C 7a_200000068372_100000210202 [0,2,0,0,0,0|1,0,0]=3 1862 B10R1.16 CCOCc1cc(cs1)O 271570a_203496583355_100011542529 [0,2,0,0,0,0|1,0,0]=3 1863 B10R1.16 CCOCc1cc(on1)C 34a_100011216401_100000210202 [0,2,0,0,0,0|2,0,0]=4 1864 B10R1.16 CCOCc1cc(on1)C 34a_100121572206_100000199038 [0,2,0,0,0,0|2,0,0]=4 1865 B10R1.16 CCOCc1ccc(o1)Br 34a_100000246276_100000210202 [0,2,0,0,0,0|1,1,0]=4 1866 B10R1.16 CCOCc1ccc(o1)Br 7a_100000246276_100000210202 [0,2,0,0,0,0|1,1,0]=4 1867 B10R1.16 CCOCc1ccc(o1)C 34a_100011232665_100000210202 [0,2,0,0,0,0|1,1,0]=4 1868 B10R1.16 CCOCc1ccc(o1)C 7a_100011232665_100000210202 [0,2,0,0,0,0|1,1,0]=4 1869 B10R1.16 CCOCc1ccc(s1)Br 34a_100121572206_100000708592 [0,2,0,0,0,0|1,0,0]=3 1870 B10R1.16 CCOCc1ccc(s1)C 34a_100000238367_100000210202 [0,2,0,0,0,0|1,0,0]=3 1871 B10R1.16 CCOCc1ccc(s1)Cl 34a_100121572206_100000185097 [0,2,0,0,0,0|1,0,0]=3 1872 B10R1.16 CCOCc1ccn(n1)C 34a_100000744484_100000210202 [0,2,0,0,0,0|2,0,0]=4 1873 B10R1.16 CCOCc1ccn(n1)C 34a_100121572206_100000726502 [0,2,0,0,0,0|2,0,0]=4 1874 B10R1.16 CCOCc1cn(cn1)C 34a_100000710007_100000210202 [0,2,0,0,0,0|2,0,0]=4 1875 B10R1.16 CCOCc1cn(cn1)C 34a_100121572206_100000717665 [0,2,0,0,0,0|2,0,0]=4 1876 B10R1.16 CCOCc1cnc(s1)Br 34a_100121572206_100000717027 [0,2,0,0,0,0|2,0,0]=4 1877 B10R1.16 CCOCc1cnc(s1)Br 7a_100009816753_100000210202 [0,2,0,0,0,0|2,0,0]=4 1878 B10R1.16 CCOCc1cnc(s1)C 34a_100121572206_100020635045 [0,2,0,0,0,0|2,0,0]=4 1879 B10R1.16 CCOCc1cnc(s1)C 7a_100000743366_100000210202 [0,2,0,0,0,0|2,0,0]=4 1880 B10R1.16 CCOCc1cnc(s1)Cl 34a_100121572206_100000058068 [0,2,0,0,0,0|2,0,0]=4 1881 B10R1.16 CCOCc1cnc(s1)Cl 7a_100000697714_100000210202 [0,2,0,0,0,0|2,0,0]=4 1882 B10R1.16 CCOCc1cnc(s1)N 7a_100011997359_100000210202 [0,2,0,0,0,0|2,0,0]=4 1883 B10R1.16 CCOCc1coc(n1)C 34a_100012017233_100000210202 [0,2,0,0,0,0|2,0,0]=4 1884 B10R1.16 CCOCc1csc(n1)C 34a_100000735831_100000210202 [0,2,0,0,0,0|2,0,0]=4 1885 B10R1.16 CCOCc1csc(n1)C 34a_100121572206_100015186478 [0,2,0,0,0,0|2,0,0]=4 1886 B10R1.16 CCOCc1csc(n1)Cl 34a_100121572206_100000024076 [0,2,0,0,0,0|2,0,0]=4 1887 B10R1.16 CCOCc1nc(cs1)Br 7a_100012000107_100000210202 [0,2,0,0,0,0|0,0,0]=2 1888 B10R1.16 CCOCc1nc(no1)C 270196a_100000212224_100000211967 [0,2,0,0,0,0|1,1,0]=4 1889 B10R1.16 CCOCc1nc(no1)C 34a_100000749583_100000210202 [0,2,0,0,0,0|1,1,0]=4 1890 B10R1.16 CCOCc1nc(no1)C 34a_100121572206_100000735555 [0,2,0,0,0,0|1,1,0]=4 1891 B10R1.16 CCOCc1ncn(n1)C 34a_100121572206_100016995526 [0,2,0,0,0,0|2,0,0]=4 1892 B10R1.16 CCOCc1nnc(o1)C 34a_100000749586_100000210202 [0,2,0,0,0,0|1,1,0]=4 1893 B10R1.16 CCOCc1nnc(s1)C 34a_100121572206_100000688753 [0,2,0,0,0,0|1,0,0]=3 1894 B10R1.16 CCOCc1nnc(s1)N 7a_100000691500_100000210202 [0,2,0,0,0,0|1,0,0]=3 1895 B10R1.16 CCOCc1noc(n1)C 34a_100121572206_100000231061 [0,2,0,0,0,0|2,0,0]=4 1896 B10R1.16 CCOCc1nsc(n1)Cl 34a_100121572206_100000043760 [0,2,0,0,0,0|2,0,0]=4 1897 B10R1.16 CCOCn1cc(cn1)Cl 34a_100000732729_100000210202 [0,2,0,0,0,0|2,0,0]=4 1898 B10R1.16 CCSCc1cc(cs1)Br 62a_100000210202_100000746031 [0,2,0,0,0,0|1,1,0]=4 1899 B10R1.16 CCSCc1cc(cs1)Br 62a_100000746031_100000210202 [0,2,0,0,0,0|1,1,0]=4 1900 B10R1.16 CCSCc1ccc(s1)Br 62a_100000210202_100000708592 [0,2,0,0,0,0|1,1,0]=4 1901 B10R1.16 CCSCc1ccc(s1)Br 62a_100000708592_100000210202 [0,2,0,0,0,0|1,1,0]=4 1902 B10R1.16 CCSCc1ccc(s1)Cl 62a_100000185097_100000210202 [0,2,0,0,0,0|1,1,0]=4 1903 B10R1.16 CCSCc1ccc(s1)Cl 62a_100000210202_100000185097 [0,2,0,0,0,0|1,1,0]=4 1904 B10R1.16 CCSCc1nnc(s1)C 62a_100000210202_100000688753 [0,2,0,0,0,0|1,1,0]=4 1905 B10R1.16 CCSCc1nnc(s1)C 62a_100000688753_100000210202 [0,2,0,0,0,0|1,1,0]=4 1906 B10R1.16 CNCCc1ccc(s1)Br 2230a_100000217605_200000210301 [0,2,0,0,0,0|2,0,0]=4 1907 B10R1.16 CNCCc1nc(cs1)C 2230a_100000736835_200000210301 [0,2,0,0,0,0|1,0,0]=3 1908 B10R1.16 CNCCc1nnc(s1)C 2230a_100000733084_200000210301 [0,2,0,0,0,0|2,0,0]=4 1909 B10R1.16 COCSc1cc(cs1)C 62a_100000766300_100009876951 [0,2,0,0,0,0|1,1,0]=4 1910 B10R1.16 COCSc1cc(cs1)C 62a_100009876951_100000766300 [0,2,0,0,0,0|1,1,0]=4 1911 B10R1.16 COCSc1ccc(s1)Br 62a_100000766300_100010197418 [0,2,0,0,0,0|1,1,0]=4 1912 B10R1.16 COCSc1ccc(s1)Br 62a_100010197418_100000766300 [0,2,0,0,0,0|1,1,0]=4 1913 B10R1.16 COCSc1ccc(s1)C 62a_100000031368_100000766300 [0,2,0,0,0,0|1,1,0]=4 1914 B10R1.16 COCSc1ccc(s1)C 62a_100000766300_100000031368 [0,2,0,0,0,0|1,1,0]=4 1915 B10R1.16 COCSc1nc(c[nH]1)C 62a_100000766300_100161115468 [0,2,0,0,0,0|1,1,0]=4 1916 B10R1.16 COCSc1nc(c[nH]1)C 62a_100161115468_100000766300 [0,2,0,0,0,0|1,1,0]=4 1917 B10R1.16 COCSc1nc(cs1)Br 62a_100000766300_200016082925 [0,2,0,0,0,0|0,1,0]=3 1918 B10R1.16 COCSc1nc(cs1)Br 62a_200016082925_100000766300 [0,2,0,0,0,0|0,1,0]=3 1919 B10R1.16 COCSc1nc(cs1)C 62a_100000766300_100011291629 [0,2,0,0,0,0|0,1,0]=3 1920 B10R1.16 COCSc1nc(cs1)C 62a_100011291629_100000766300 [0,2,0,0,0,0|0,1,0]=3 1921 B10R1.16 COCSc1nc(cs1)N 62a_100000766300_200015188442 [0,2,0,0,0,0|0,1,0]=3 1922 B10R1.16 COCSc1nc(cs1)N 62a_200015188442_100000766300 [0,2,0,0,0,0|0,1,0]=3 1923 B10R1.16 COCSc1nc(ns1)C 62a_100000709739_100000766300 [0,2,0,0,0,0|1,1,0]=4 1924 B10R1.16 COCSc1nc(ns1)C 62a_100000766300_100000709739 [0,2,0,0,0,0|1,1,0]=4 1925 B10R1.16 COCSc1ncc(s1)C 62a_100000690809_100000766300 [0,2,0,0,0,0|0,1,0]=3 1926 B10R1.16 COCSc1ncc(s1)C 62a_100000766300_100000690809 [0,2,0,0,0,0|0,1,0]=3 1927 B10R1.16 COCSc1nnc(s1)C 62a_100000686958_100000766300 [0,2,0,0,0,0|1,1,0]=4 1928 B10R1.16 COCSc1nnc(s1)C 62a_100000766300_100000686958 [0,2,0,0,0,0|1,1,0]=4 1929 B10R1.16 COCSc1nnc(s1)N 62a_100000738278_100000766300 [0,2,0,0,0,0|1,1,0]=4 1930 B10R1.16 COCSc1nnc(s1)N 62a_100000766300_100000738278 [0,2,0,0,0,0|1,1,0]=4 1931 B10R1.16 CSCOc1ccn(n1)C 34a_100012642153_100011218213 [0,2,0,0,0,0|2,0,0]=4 1932 B10R1.16 CSCSc1cc(cs1)C 62a_100009876951_100011218213 [0,2,0,0,0,0|1,1,0]=4 1933 B10R1.16 CSCSc1cc(cs1)C 62a_100011218213_100009876951 [0,2,0,0,0,0|1,1,0]=4 1934 B10R1.16 CSCSc1ccc(s1)Br 62a_100010197418_100011218213 [0,2,0,0,0,0|1,1,0]=4 1935 B10R1.16 CSCSc1ccc(s1)Br 62a_100011218213_100010197418 [0,2,0,0,0,0|1,1,0]=4 1936 B10R1.16 CSCSc1ccc(s1)C 62a_100000031368_100011218213 [0,2,0,0,0,0|1,1,0]=4 1937 B10R1.16 CSCSc1ccc(s1)C 62a_100011218213_100000031368 [0,2,0,0,0,0|1,1,0]=4 1938 B10R1.16 CSCSc1nc(c[nH]1)C 62a_100011218213_100161115468 [0,2,0,0,0,0|1,1,0]=4 1939 B10R1.16 CSCSc1nc(c[nH]1)C 62a_100161115468_100011218213 [0,2,0,0,0,0|1,1,0]=4 1940 B10R1.16 CSCSc1nc(cs1)Br 62a_100011218213_200016082925 [0,2,0,0,0,0|0,1,0]=3 1941 B10R1.16 CSCSc1nc(cs1)Br 62a_200016082925_100011218213 [0,2,0,0,0,0|0,1,0]=3 1942 B10R1.16 CSCSc1nc(cs1)C 62a_100011218213_100011291629 [0,2,0,0,0,0|0,1,0]=3 1943 B10R1.16 CSCSc1nc(cs1)C 62a_100011291629_100011218213 [0,2,0,0,0,0|0,1,0]=3 1944 B10R1.16 CSCSc1nc(cs1)N 62a_100011218213_200015188442 [0,2,0,0,0,0|0,1,0]=3 1945 B10R1.16 CSCSc1nc(cs1)N 62a_200015188442_100011218213 [0,2,0,0,0,0|0,1,0]=3 1946 B10R1.16 CSCSc1nc(ns1)C 62a_100000709739_100011218213 [0,2,0,0,0,0|1,1,0]=4 1947 B10R1.16 CSCSc1nc(ns1)C 62a_100011218213_100000709739 [0,2,0,0,0,0|1,1,0]=4 1948 B10R1.16 CSCSc1ncc(s1)C 62a_100000690809_100011218213 [0,2,0,0,0,0|0,1,0]=3 1949 B10R1.16 CSCSc1ncc(s1)C 62a_100011218213_100000690809 [0,2,0,0,0,0|0,1,0]=3 1950 B10R1.16 CSCSc1nnc(s1)C 62a_100000686958_100011218213 [0,2,0,0,0,0|1,1,0]=4 1951 B10R1.16 CSCSc1nnc(s1)C 62a_100011218213_100000686958 [0,2,0,0,0,0|1,1,0]=4 1952 B10R1.16 CSCSc1nnc(s1)N 62a_100000738278_100011218213 [0,2,0,0,0,0|1,1,0]=4 1953 B10R1.16 CSCSc1nnc(s1)N 62a_100011218213_100000738278 [0,2,0,0,0,0|1,1,0]=4 1954 B10R1.16 Cc1c[nH]c(n1)SCCF 62a_100011217306_100161115468 [0,2,0,0,0,0|1,1,0]=4 1955 B10R1.16 Cc1c[nH]c(n1)SCCF 62a_100161115468_100011217306 [0,2,0,0,0,0|1,1,0]=4 1956 B10R1.16 Cc1c[nH]c(n1)SCCO 62a_100000211926_100161115468 [0,2,0,0,0,0|1,1,0]=4 1957 B10R1.16 Cc1c[nH]c(n1)SCCO 62a_100161115468_100000211926 [0,2,0,0,0,0|1,1,0]=4 1958 B10R1.16 Cc1ccc(s1)COCF 34a_100000238367_100015361967 [0,2,0,0,0,0|2,0,0]=4 1959 B10R1.16 Cc1ccc(s1)SCCF 62a_100000031368_100011217306 [0,2,0,0,0,0|1,1,0]=4 1960 B10R1.16 Cc1ccc(s1)SCCF 62a_100011217306_100000031368 [0,2,0,0,0,0|1,1,0]=4 1961 B10R1.16 Cc1ccc(s1)SCCO 62a_100000031368_100000211926 [0,2,0,0,0,0|1,1,0]=4 1962 B10R1.16 Cc1ccc(s1)SCCO 62a_100000211926_100000031368 [0,2,0,0,0,0|1,1,0]=4 1963 B10R1.16 Cc1cnc(s1)SCC#N 62a_100000690809_100011215382 [0,2,0,0,0,0|0,1,1]=4 1964 B10R1.16 Cc1cnc(s1)SCC#N 62a_100011215382_100000690809 [0,2,0,0,0,0|0,1,1]=4 1965 B10R1.16 Cc1cnc(s1)SCC=O 62a_100000690809_200015260668 [0,2,0,0,0,0|0,1,1]=4 1966 B10R1.16 Cc1cnc(s1)SCC=O 62a_200015260668_100000690809 [0,2,0,0,0,0|0,1,1]=4 1967 B10R1.16 Cc1cnc(s1)SCCF 62a_100000690809_100011217306 [0,2,0,0,0,0|0,1,0]=3 1968 B10R1.16 Cc1cnc(s1)SCCF 62a_100011217306_100000690809 [0,2,0,0,0,0|0,1,0]=3 1969 B10R1.16 Cc1cnc(s1)SCCO 62a_100000211926_100000690809 [0,2,0,0,0,0|0,1,0]=3 1970 B10R1.16 Cc1cnc(s1)SCCO 62a_100000690809_100000211926 [0,2,0,0,0,0|0,1,0]=3 1971 B10R1.16 Cc1csc(c1)COCF 34a_200000068372_100015361967 [0,2,0,0,0,0|2,0,0]=4 1972 B10R1.16 Cc1csc(c1)COCF 7a_200000068372_100015361967 [0,2,0,0,0,0|2,0,0]=4 1973 B10R1.16 Cc1csc(c1)SCCF 62a_100009876951_100011217306 [0,2,0,0,0,0|1,1,0]=4 1974 B10R1.16 Cc1csc(c1)SCCF 62a_100011217306_100009876951 [0,2,0,0,0,0|1,1,0]=4 1975 B10R1.16 Cc1csc(c1)SCCO 62a_100000211926_100009876951 [0,2,0,0,0,0|1,1,0]=4 1976 B10R1.16 Cc1csc(c1)SCCO 62a_100009876951_100000211926 [0,2,0,0,0,0|1,1,0]=4 1977 B10R1.16 Cc1csc(n1)CCN[13CH3] 2230a_100000736835_200025704644 [0,2,0,0,0,0|1,0,0]=3 1978 B10R1.16 Cc1csc(n1)SCC#N 62a_100011215382_100011291629 [0,2,0,0,0,0|0,1,1]=4 1979 B10R1.16 Cc1csc(n1)SCC#N 62a_100011291629_100011215382 [0,2,0,0,0,0|0,1,1]=4 1980 B10R1.16 Cc1csc(n1)SCC=O 62a_100011291629_200015260668 [0,2,0,0,0,0|0,1,1]=4 1981 B10R1.16 Cc1csc(n1)SCC=O 62a_200015260668_100011291629 [0,2,0,0,0,0|0,1,1]=4 1982 B10R1.16 Cc1csc(n1)SCCF 62a_100011217306_100011291629 [0,2,0,0,0,0|0,1,0]=3 1983 B10R1.16 Cc1csc(n1)SCCF 62a_100011291629_100011217306 [0,2,0,0,0,0|0,1,0]=3 1984 B10R1.16 Cc1csc(n1)SCCO 62a_100000211926_100011291629 [0,2,0,0,0,0|0,1,0]=3 1985 B10R1.16 Cc1csc(n1)SCCO 62a_100011291629_100000211926 [0,2,0,0,0,0|0,1,0]=3 1986 B10R1.16 Cc1nnc(s1)CCN[13CH3] 2230a_100000733084_200025704644 [0,2,0,0,0,0|2,0,0]=4 1987 B10R1.16 Cc1nnc(s1)NCCO 27a_100000210304_100000686958 [0,2,0,0,0,0|2,0,0]=4 1988 B10R1.16 Cc1nnc(s1)SCCF 62a_100000686958_100011217306 [0,2,0,0,0,0|1,1,0]=4 1989 B10R1.16 Cc1nnc(s1)SCCF 62a_100011217306_100000686958 [0,2,0,0,0,0|1,1,0]=4 1990 B10R1.16 Cc1nnc(s1)SCCO 62a_100000211926_100000686958 [0,2,0,0,0,0|1,1,0]=4 1991 B10R1.16 Cc1nnc(s1)SCCO 62a_100000686958_100000211926 [0,2,0,0,0,0|1,1,0]=4 1992 B10R1.16 Cc1nsc(n1)NCCO 27a_100000210304_100000709739 [0,2,0,0,0,0|2,0,0]=4 1993 B10R1.16 Cc1nsc(n1)SCCF 62a_100000709739_100011217306 [0,2,0,0,0,0|1,1,0]=4 1994 B10R1.16 Cc1nsc(n1)SCCF 62a_100011217306_100000709739 [0,2,0,0,0,0|1,1,0]=4 1995 B10R1.16 Cc1nsc(n1)SCCO 62a_100000211926_100000709739 [0,2,0,0,0,0|1,1,0]=4 1996 B10R1.16 Cc1nsc(n1)SCCO 62a_100000709739_100000211926 [0,2,0,0,0,0|1,1,0]=4 1997 B10R1.16 Cn1ccc(n1)OCCF 34a_100012642153_100011217306 [0,2,0,0,0,0|2,0,0]=4 1998 B10R1.16 Cn1ccc(n1)OCCO 34a_100012642153_100000211926 [0,2,0,0,0,0|2,0,0]=4 1999 B10R1.16 FCCSc1ccc(s1)Br 62a_100010197418_100011217306 [0,2,0,0,0,0|1,1,0]=4 2000 B10R1.16 FCCSc1ccc(s1)Br 62a_100011217306_100010197418 [0,2,0,0,0,0|1,1,0]=4 2001 B10R1.16 FCCSc1nc(cs1)Br 62a_100011217306_200016082925 [0,2,0,0,0,0|0,1,0]=3 2002 B10R1.16 FCCSc1nc(cs1)Br 62a_200016082925_100011217306 [0,2,0,0,0,0|0,1,0]=3 2003 B10R1.16 FCOCc1cc(cs1)Br 34a_100000238369_100015361967 [0,2,0,0,0,0|2,0,0]=4 2004 B10R1.16 FCOCc1cc(cs1)Br 7a_100000238369_100015361967 [0,2,0,0,0,0|2,0,0]=4 2005 B10R1.16 FCOCc1nc(cs1)Br 7a_100012000107_100015361967 [0,2,0,0,0,0|1,0,0]=3 2006 B10R1.16 N#CCSc1nc(cs1)Br 62a_100011215382_200016082925 [0,2,0,0,0,0|0,1,1]=4 2007 B10R1.16 N#CCSc1nc(cs1)Br 62a_200016082925_100011215382 [0,2,0,0,0,0|0,1,1]=4 2008 B10R1.16 N#CCSc1nc(cs1)N 62a_100011215382_200015188442 [0,2,0,0,0,0|0,1,1]=4 2009 B10R1.16 N#CCSc1nc(cs1)N 62a_200015188442_100011215382 [0,2,0,0,0,0|0,1,1]=4 2010 B10R1.16 Nc1csc(n1)SCC=O 62a_200015188442_200015260668 [0,2,0,0,0,0|0,1,1]=4 2011 B10R1.16 Nc1csc(n1)SCC=O 62a_200015260668_200015188442 [0,2,0,0,0,0|0,1,1]=4 2012 B10R1.16 Nc1csc(n1)SCCF 62a_100011217306_200015188442 [0,2,0,0,0,0|0,1,0]=3 2013 B10R1.16 Nc1csc(n1)SCCF 62a_200015188442_100011217306 [0,2,0,0,0,0|0,1,0]=3 2014 B10R1.16 Nc1csc(n1)SCCO 62a_100000211926_200015188442 [0,2,0,0,0,0|0,1,0]=3 2015 B10R1.16 Nc1csc(n1)SCCO 62a_200015188442_100000211926 [0,2,0,0,0,0|0,1,0]=3 2016 B10R1.16 Nc1nnc(s1)COCF 7a_100000691500_100015361967 [0,2,0,0,0,0|2,0,0]=4 2017 B10R1.16 Nc1nnc(s1)NCCO 27a_100000210304_100000738278 [0,2,0,0,0,0|2,0,0]=4 2018 B10R1.16 Nc1nnc(s1)SCCF 62a_100000738278_100011217306 [0,2,0,0,0,0|1,1,0]=4 2019 B10R1.16 Nc1nnc(s1)SCCF 62a_100011217306_100000738278 [0,2,0,0,0,0|1,1,0]=4 2020 B10R1.16 Nc1nnc(s1)SCCO 62a_100000211926_100000738278 [0,2,0,0,0,0|1,1,0]=4 2021 B10R1.16 Nc1nnc(s1)SCCO 62a_100000738278_100000211926 [0,2,0,0,0,0|1,1,0]=4 2022 B10R1.16 O=CCSc1nc(cs1)Br 62a_200015260668_200016082925 [0,2,0,0,0,0|0,1,1]=4 2023 B10R1.16 O=CCSc1nc(cs1)Br 62a_200016082925_200015260668 [0,2,0,0,0,0|0,1,1]=4 2024 B10R1.16 OCCSc1ccc(s1)Br 62a_100000211926_100010197418 [0,2,0,0,0,0|1,1,0]=4 2025 B10R1.16 OCCSc1ccc(s1)Br 62a_100010197418_100000211926 [0,2,0,0,0,0|1,1,0]=4 2026 B10R1.16 OCCSc1nc(cs1)Br 62a_100000211926_200016082925 [0,2,0,0,0,0|0,1,0]=3 2027 B10R1.16 OCCSc1nc(cs1)Br 62a_200016082925_100000211926 [0,2,0,0,0,0|0,1,0]=3 2028 B10R1.16 [13CH3]NCCc1ccc(s1)Br 2230a_100000217605_200025704644 [0,2,0,0,0,0|2,0,0]=4 2029 B10R1.54 CC(=Cc1nc(cs1)Br)C 271570a_100102525489_200016082925 [0,2,0,0,0,0|1,0,1]=4 2030 B10R1.54 CC(=Cc1nc(cs1)C)C 271570a_100102525489_100011291629 [0,2,0,0,0,0|1,0,1]=4 2031 B10R1.54 CC(=Cc1nc(cs1)N)C 271570a_100102525489_200015188442 [0,2,0,0,0,0|1,0,1]=4 2032 B10R1.54 CC(=Cc1ncc(s1)C)C 271570a_100102525489_100000690809 [0,2,0,0,0,0|1,0,1]=4 2033 B10R1.54 CC(=O)Nc1ncc(s1)O 271570a_203496583355_100000050200 [0,2,0,0,0,0|1,0,1]=4 2034 B10R1.54 CC(C)Nc1nnc(s1)N 27a_100138425928_100000738278 [0,2,0,0,0,0|2,0,0]=4 2035 B10R1.54 CC(C)Oc1ccn(n1)C 34a_100012642153_100000210206 [0,2,0,0,0,0|2,0,0]=4 2036 B10R1.54 CC(C)Oc1ncc(s1)O 271570a_203496583355_100010238083 [0,2,0,0,0,0|0,0,0]=2 2037 B10R1.54 CC(C)Sc1ccc(s1)Br 62a_100000210206_100010197418 [0,2,0,0,0,0|1,1,0]=4 2038 B10R1.54 CC(C)Sc1ccc(s1)Br 62a_100010197418_100000210206 [0,2,0,0,0,0|1,1,0]=4 2039 B10R1.54 CC(C)Sc1nc(cs1)Br 62a_100000210206_200016082925 [0,2,0,0,0,0|0,1,0]=3 2040 B10R1.54 CC(C)Sc1nc(cs1)Br 62a_200016082925_100000210206 [0,2,0,0,0,0|0,1,0]=3 2041 B10R1.54 CC(C)Sc1nc(cs1)N 62a_100000210206_200015188442 [0,2,0,0,0,0|0,1,0]=3 2042 B10R1.54 CC(C)Sc1nc(cs1)N 62a_200015188442_100000210206 [0,2,0,0,0,0|0,1,0]=3 2043 B10R1.54 CC(C)Sc1nnc(s1)N 62a_100000210206_100000738278 [0,2,0,0,0,0|1,1,0]=4 2044 B10R1.54 CC(C)Sc1nnc(s1)N 62a_100000738278_100000210206 [0,2,0,0,0,0|1,1,0]=4 2045 B10R1.54 CN(C)Cc1nc(cs1)Br 270004a_100102631434_100009816814 [0,2,0,0,0,0|2,0,0]=4 2046 B10R1.54 CN(C)Cc1ncc(s1)Br 270004a_100102631434_100000699580 [0,2,0,0,0,0|2,0,0]=4 2047 B10R1.54 CN(C)Cc1ncc(s1)Cl 270004a_100102631434_100000699884 [0,2,0,0,0,0|2,0,0]=4 2048 B10R1.54 Cc1c[nH]c(n1)SC(C)C 62a_100000210206_100161115468 [0,2,0,0,0,0|1,1,0]=4 2049 B10R1.54 Cc1c[nH]c(n1)SC(C)C 62a_100161115468_100000210206 [0,2,0,0,0,0|1,1,0]=4 2050 B10R1.54 Cc1ccc(s1)SC(C)C 62a_100000031368_100000210206 [0,2,0,0,0,0|1,1,0]=4 2051 B10R1.54 Cc1ccc(s1)SC(C)C 62a_100000210206_100000031368 [0,2,0,0,0,0|1,1,0]=4 2052 B10R1.54 Cc1cnc(s1)CN(C)C 270004a_100102631434_100011361622 [0,2,0,0,0,0|2,0,0]=4 2053 B10R1.54 Cc1cnc(s1)SC(C)C 62a_100000210206_100000690809 [0,2,0,0,0,0|0,1,0]=3 2054 B10R1.54 Cc1cnc(s1)SC(C)C 62a_100000690809_100000210206 [0,2,0,0,0,0|0,1,0]=3 2055 B10R1.54 Cc1csc(c1)SC(C)C 62a_100000210206_100009876951 [0,2,0,0,0,0|1,1,0]=4 2056 B10R1.54 Cc1csc(c1)SC(C)C 62a_100009876951_100000210206 [0,2,0,0,0,0|1,1,0]=4 2057 B10R1.54 Cc1csc(n1)CN(C)C 2230a_100000757614_200000210301 [0,2,0,0,0,0|2,0,0]=4 2058 B10R1.54 Cc1csc(n1)CN(C)C 269982a_100000757614_200000210301 [0,2,0,0,0,0|2,0,0]=4 2059 B10R1.54 Cc1csc(n1)CN(C)C 270004a_100102631434_100000756994 [0,2,0,0,0,0|2,0,0]=4 2060 B10R1.54 Cc1csc(n1)CN(C)[13CH3] 2230a_100000757614_200025704644 [0,2,0,0,0,0|2,0,0]=4 2061 B10R1.54 Cc1csc(n1)CN(C)[13CH3] 269982a_100000757614_200025704644 [0,2,0,0,0,0|2,0,0]=4 2062 B10R1.54 Cc1csc(n1)SC(C)C 62a_100000210206_100011291629 [0,2,0,0,0,0|0,1,0]=3 2063 B10R1.54 Cc1csc(n1)SC(C)C 62a_100011291629_100000210206 [0,2,0,0,0,0|0,1,0]=3 2064 B10R1.54 Cc1nnc(s1)NC(C)C 27a_100138425928_100000686958 [0,2,0,0,0,0|2,0,0]=4 2065 B10R1.54 Cc1nnc(s1)SC(C)C 62a_100000210206_100000686958 [0,2,0,0,0,0|1,1,0]=4 2066 B10R1.54 Cc1nnc(s1)SC(C)C 62a_100000686958_100000210206 [0,2,0,0,0,0|1,1,0]=4 2067 B10R1.54 Cc1nsc(n1)NC(C)C 27a_100138425928_100000709739 [0,2,0,0,0,0|2,0,0]=4 2068 B10R1.54 Cc1nsc(n1)SC(C)C 62a_100000210206_100000709739 [0,2,0,0,0,0|1,1,0]=4 2069 B10R1.54 Cc1nsc(n1)SC(C)C 62a_100000709739_100000210206 [0,2,0,0,0,0|1,1,0]=4 2070 B10R1.94 CCOc1noc(c1Br)C 34a_100010730664_100000210202 [0,2,0,0,0,0|2,0,0]=4 2071 B10R1.94 CCSc1ncc(n1C)C 62a_100000210202_100009816807 [0,2,0,0,0,0|1,1,0]=4 2072 B10R1.94 CCSc1ncc(n1C)C 62a_100009816807_100000210202 [0,2,0,0,0,0|1,1,0]=4 2073 B10R1.96 C=Cc1ccc(s1)CCC 271570a_100011290941_100010157708 [0,2,0,0,0,0|2,0,0]=4 2074 B10R1.96 C=Cc1cnc([nH]1)CCC 271570a_100011290941_200009820212 [0,2,0,0,0,0|2,0,0]=4 2075 B10R1.96 C=Cc1csc(n1)OCC 271570a_100011290941_100011934640 [0,2,0,0,0,0|0,0,0]=2 2076 B10R1.96 CC=Cc1nc(cs1)C#N 271570a_100016259895_100009819631 [0,2,0,0,0,0|1,0,1]=4 2077 B10R1.96 CC=Cc1nc(cs1)C=O 271570a_100016259895_100009816748 [0,2,0,0,0,0|1,0,1]=4 2078 B10R1.96 CC=Cc1nc(cs1)CO 271570a_100016259895_100009816749 [0,2,0,0,0,0|1,0,1]=4 2079 B10R1.96 CC=Cc1ncc(s1)C#N 271570a_100016259895_100009819632 [0,2,0,0,0,0|1,0,1]=4 2080 B10R1.96 CC=Cc1ncc(s1)C=O 271570a_100016259895_100009814069 [0,2,0,0,0,0|1,0,1]=4 2081 B10R1.96 CC=Cc1ncc(s1)CN 271570a_100016259895_100000726991 [0,2,0,0,0,0|1,0,1]=4 2082 B10R1.96 CC=Cc1ncc(s1)CO 271570a_100016259895_100009816753 [0,2,0,0,0,0|1,0,1]=4 2083 B10R1.96 CCCc1ccc(s1)SC 62a_100010157708_200000210301 [0,2,0,0,0,0|2,0,0]=4 2084 B10R1.96 CCCc1ccc(s1)SC 62a_200000210301_100010157708 [0,2,0,0,0,0|2,0,0]=4 2085 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_100010157708_200025704644 [0,2,0,0,0,0|2,0,0]=4 2086 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_200025704644_100010157708 [0,2,0,0,0,0|2,0,0]=4 2087 B10R1.96 CCCc1ncc([nH]1)SC 62a_200000210301_200009820212 [0,2,0,0,0,0|2,0,0]=4 2088 B10R1.96 CCCc1ncc([nH]1)SC 62a_200009820212_200000210301 [0,2,0,0,0,0|2,0,0]=4 2089 B10R1.96 CCCc1ncc([nH]1)S[13CH3] 62a_200009820212_200025704644 [0,2,0,0,0,0|2,0,0]=4 2090 B10R1.96 CCCc1ncc([nH]1)S[13CH3] 62a_200025704644_200009820212 [0,2,0,0,0,0|2,0,0]=4 2091 B10R1.96 CCNc1nc(cs1)C#N 27a_100015525214_100009819631 [0,2,0,0,0,0|1,0,0]=3 2092 B10R1.96 CCNc1ncc(s1)C#N 27a_100015525214_100009819632 [0,2,0,0,0,0|1,0,0]=3 2093 B10R1.96 CCNc1ncc(s1)C=O 27a_100015525214_100009814069 [0,2,0,0,0,0|1,0,0]=3 2094 B10R1.96 CCNc1nnc(s1)NC 27a_100015525214_200012111945 [0,2,0,0,0,0|2,0,0]=4 2095 B10R1.96 CCOc1cc(on1)CC 34a_200009875660_100000210202 [0,2,0,0,0,0|2,0,0]=4 2096 B10R1.96 CCOc1nc(cs1)SC 62a_100011934640_200000210301 [0,2,0,0,0,0|0,0,0]=2 2097 B10R1.96 CCOc1nc(cs1)SC 62a_200000210301_100011934640 [0,2,0,0,0,0|0,0,0]=2 2098 B10R1.96 CCOc1nc(cs1)S[13CH3] 62a_100011934640_200025704644 [0,2,0,0,0,0|0,0,0]=2 2099 B10R1.96 CCOc1nc(cs1)S[13CH3] 62a_200025704644_100011934640 [0,2,0,0,0,0|0,0,0]=2 2100 B10R1.96 CCSc1cc(cs1)C=O 62a_100000210202_100000737087 [0,2,0,0,0,0|1,1,0]=4 2101 B10R1.96 CCSc1cc(cs1)C=O 62a_100000737087_100000210202 [0,2,0,0,0,0|1,1,0]=4 2102 B10R1.96 CCSc1ccc(s1)C#N 62a_100000210202_100000737243 [0,2,0,0,0,0|1,1,0]=4 2103 B10R1.96 CCSc1ccc(s1)C=O 62a_100000179771_100000210202 [0,2,0,0,0,0|1,1,0]=4 2104 B10R1.96 CCSc1ccc(s1)C=O 62a_100000210202_100000179771 [0,2,0,0,0,0|1,1,0]=4 2105 B10R1.96 CCSc1ccc(s1)CC 62a_100000210202_100009844052 [0,2,0,0,0,0|1,1,0]=4 2106 B10R1.96 CCSc1ccc(s1)CC 62a_100009844052_100000210202 [0,2,0,0,0,0|1,1,0]=4 2107 B10R1.96 CCSc1ccc(s1)CN 62a_100000210202_100000737305 [0,2,0,0,0,0|1,1,0]=4 2108 B10R1.96 CCSc1ccc(s1)CN 62a_100000737305_100000210202 [0,2,0,0,0,0|1,1,0]=4 2109 B10R1.96 CCSc1ccc(s1)CO 62a_100000210202_100000246291 [0,2,0,0,0,0|1,1,0]=4 2110 B10R1.96 CCSc1ccc(s1)CO 62a_100000246291_100000210202 [0,2,0,0,0,0|1,1,0]=4 2111 B10R1.96 CCSc1nc(cs1)C#N 62a_100000210202_100009819631 [0,2,0,0,0,0|0,1,0]=3 2112 B10R1.96 CCSc1nc(cs1)C=O 62a_100000210202_100009816748 [0,2,0,0,0,0|0,1,0]=3 2113 B10R1.96 CCSc1nc(cs1)C=O 62a_100009816748_100000210202 [0,2,0,0,0,0|0,1,0]=3 2114 B10R1.96 CCSc1nc(cs1)CO 62a_100000210202_100009816749 [0,2,0,0,0,0|0,1,0]=3 2115 B10R1.96 CCSc1nc(cs1)CO 62a_100009816749_100000210202 [0,2,0,0,0,0|0,1,0]=3 2116 B10R1.96 CCSc1ncc(s1)C#N 62a_100000210202_100009819632 [0,2,0,0,0,0|0,1,0]=3 2117 B10R1.96 CCSc1ncc(s1)C=O 62a_100000210202_100009814069 [0,2,0,0,0,0|0,1,0]=3 2118 B10R1.96 CCSc1ncc(s1)C=O 62a_100009814069_100000210202 [0,2,0,0,0,0|0,1,0]=3 2119 B10R1.96 CCSc1ncc(s1)CN 62a_100000210202_100000726991 [0,2,0,0,0,0|0,1,0]=3 2120 B10R1.96 CCSc1ncc(s1)CN 62a_100000726991_100000210202 [0,2,0,0,0,0|0,1,0]=3 2121 B10R1.96 CCSc1ncc(s1)CO 62a_100000210202_100009816753 [0,2,0,0,0,0|0,1,0]=3 2122 B10R1.96 CCSc1ncc(s1)CO 62a_100009816753_100000210202 [0,2,0,0,0,0|0,1,0]=3 2123 B10R1.96 CCSc1nnc(s1)NC 62a_100000210202_200012111945 [0,2,0,0,0,0|1,1,0]=4 2124 B10R1.96 CCSc1nnc(s1)NC 62a_200012111945_100000210202 [0,2,0,0,0,0|1,1,0]=4 2125 B10R1.96 CCc1csc(n1)CNC 2230a_100011595562_200000210301 [0,2,0,0,0,0|2,0,0]=4 2126 B10R1.96 CCc1csc(n1)CN[13CH3] 2230a_100011595562_200025704644 [0,2,0,0,0,0|2,0,0]=4 2127 B10R1.96 N#Cc1cnc(s1)SCF 62a_100015361967_100009819632 [0,2,0,0,0,0|1,1,0]=4 2128 B10R1.96 N#Cc1csc(n1)SCF 62a_100015361967_100009819631 [0,2,0,0,0,0|1,1,0]=4 2129 B10R1.96 NCc1cnc(s1)SCF 62a_100000726991_100015361967 [0,2,0,0,0,0|1,1,0]=4 2130 B10R1.96 NCc1cnc(s1)SCF 62a_100015361967_100000726991 [0,2,0,0,0,0|1,1,0]=4 2131 B10R1.96 O=Cc1cnc(s1)SCF 62a_100009814069_100015361967 [0,2,0,0,0,0|1,1,0]=4 2132 B10R1.96 O=Cc1cnc(s1)SCF 62a_100015361967_100009814069 [0,2,0,0,0,0|1,1,0]=4 2133 B10R1.96 O=Cc1csc(n1)SCF 62a_100009816748_100015361967 [0,2,0,0,0,0|1,1,0]=4 2134 B10R1.96 O=Cc1csc(n1)SCF 62a_100015361967_100009816748 [0,2,0,0,0,0|1,1,0]=4 2135 B10R1.96 OCc1cnc(s1)SCF 62a_100009816753_100015361967 [0,2,0,0,0,0|1,1,0]=4 2136 B10R1.96 OCc1cnc(s1)SCF 62a_100015361967_100009816753 [0,2,0,0,0,0|1,1,0]=4 2137 B10R1.96 OCc1csc(n1)SCF 62a_100009816749_100015361967 [0,2,0,0,0,0|1,1,0]=4 2138 B10R1.96 OCc1csc(n1)SCF 62a_100015361967_100009816749 [0,2,0,0,0,0|1,1,0]=4 2139 B10R1.130 CCSc1nc(cn1C)C 62a_100000210202_100009816808 [0,2,0,0,0,0|1,1,0]=4 2140 B10R1.130 CCSc1nc(cn1C)C 62a_100009816808_100000210202 [0,2,0,0,0,0|1,1,0]=4 2141 B10R1.130 CCSc1sc(cc1C)C 62a_100000210202_100000689295 [0,2,0,0,0,0|1,1,0]=4 2142 B10R1.130 CCSc1sc(cc1C)C 62a_100000689295_100000210202 [0,2,0,0,0,0|1,1,0]=4 2143 B10R1.131 CC=Cc1nc(c(s1)C)C 271570a_100016259895_100000765934 [0,2,0,0,0,0|1,0,1]=4 2144 B10R1.131 CCNc1nc(c(s1)C)C 27a_100015525214_100000765934 [0,2,0,0,0,0|1,0,0]=3 2145 B10R1.131 CCSc1cc(c(s1)C)C 62a_100000210202_100009850898 [0,2,0,0,0,0|1,1,0]=4 2146 B10R1.131 CCSc1cc(c(s1)C)C 62a_100009850898_100000210202 [0,2,0,0,0,0|1,1,0]=4 2147 B10R1.131 CCSc1nc(c(s1)C)C 62a_100000210202_100000765934 [0,2,0,0,0,0|0,1,0]=3 2148 B10R1.131 CCSc1nc(c(s1)C)C 62a_100000765934_100000210202 [0,2,0,0,0,0|0,1,0]=3 2149 B10R1.131 CNCc1nc(c(s1)C)C 207a_100102657272_100011775437 [0,2,0,0,0,0|2,0,0]=4 2150 B10R1.131 CNCc1nc(c(s1)C)C 2230a_106832991635_100012347604 [0,2,0,0,0,0|2,0,0]=4 2151 B10R1.131 CNCc1nc(c(s1)C)C 270004a_106832991635_100011775437 [0,2,0,0,0,0|2,0,0]=4 2152 B10R1.131 CNCc1nc(c(s1)C)C 34a_100102657272_100012347604 [0,2,0,0,0,0|2,0,0]=4 2153 B10R1.131 CNCc1nc(c(s1)C)C 7a_106832991635_100012347604 [0,2,0,0,0,0|2,0,0]=4 2154 B10R1.131 COCc1nc(c(s1)C)C 34a_100138415774_100012347604 [0,2,0,0,0,0|2,0,0]=4 2155 B10R1.131 COCc1nc(c(s1)C)C 7a_100000760949_200000210301 [0,2,0,0,0,0|2,0,0]=4 2156 B10R1.131 CSCc1nc(c(s1)C)C 62a_100000763442_200000210301 [0,2,0,0,0,0|2,0,0]=4 2157 B10R1.131 CSCc1nc(c(s1)C)C 62a_200000210301_100012347604 [0,2,0,0,0,0|2,0,0]=4 2158 B10R1.131 Cc1nc(sc1C)CO[13CH3] 7a_100000760949_200025704644 [0,2,0,0,0,0|2,0,0]=4 2159 B10R1.131 Cc1nc(sc1C)CS[13CH3] 62a_100000763442_200025704644 [0,2,0,0,0,0|2,0,0]=4 2160 B10R1.131 Cc1nc(sc1C)CS[13CH3] 62a_200025704644_100012347604 [0,2,0,0,0,0|2,0,0]=4 2161 B10R1.131 Cc1nc(sc1C)SCF 62a_100000765934_100015361967 [0,2,0,0,0,0|1,1,0]=4 2162 B10R1.131 Cc1nc(sc1C)SCF 62a_100015361967_100000765934 [0,2,0,0,0,0|1,1,0]=4 2163 B10R1.6 CC(C)(O[13CH3])c1nccs1 7a_200009882240_200025704644 [0,2,0,0,0,0|2,0,0]=4 2164 B10R1.6 COC(C)(C)c1nccs1 7a_200009882240_200000210301 [0,2,0,0,0,0|2,0,0]=4 2165 B10R1.9 CCC(NC)c1cccs1 2230a_100000743277_200000210301 [0,2,0,0,0,0|2,0,0]=4 2166 B10R1.9 CCC(NC)c1cccs1 269862a_106832991636_100000211688 [0,2,0,0,0,0|2,0,0]=4 2167 B10R1.9 CCC(NC)c1nccs1 2230a_103436540099_200000210301 [0,2,0,0,0,0|1,0,0]=3 2168 B10R1.9 CCC(NC)c1nccs1 269862a_106832991636_100000031915 [0,2,0,0,0,0|1,0,0]=3 2169 B10R1.9 CCC(N[13CH3])c1cccs1 2230a_100000743277_200025704644 [0,2,0,0,0,0|2,0,0]=4 2170 B10R1.9 CCC(N[13CH3])c1nccs1 2230a_103436540099_200025704644 [0,2,0,0,0,0|1,0,0]=3 2171 B10R1.9 CCN(CC)c1ncns1 27a_100000724800_100000693119 [0,2,0,0,0,0|2,0,0]=4 2172 B10R1.9 CCN(CC)c1nncs1 27a_100000724800_100000739804 [0,2,0,0,0,0|2,0,0]=4 2173 B10R1.9 CN[C@@H](CO)c1nccs1 2230a_202495363701_200000210301 [0,2,0,0,0,0|2,0,0]=4 2174 B10R1.9 [13CH3]N[C@@H](CO)c1nccs1 2230a_202495363701_200025704644 [0,2,0,0,0,0|2,0,0]=4 2175 B10R1.11 CC(OCF)c1nccs1 7a_100000751044_100015361967 [0,2,0,0,0,0|1,0,0]=3 2176 B10R1.11 CCCN(C)c1ncns1 27a_100000747261_100000693119 [0,2,0,0,0,0|2,0,0]=4 2177 B10R1.11 CCCN(C)c1nncs1 27a_100000747261_100000739804 [0,2,0,0,0,0|2,0,0]=4 2178 B10R1.11 CCNC(C)c1cccs1 2230a_100000703493_100000210202 [0,2,0,0,0,0|2,0,0]=4 2179 B10R1.11 CCNC(C)c1cccs1 269862a_100015525214_100000185736 [0,2,0,0,0,0|2,0,0]=4 2180 B10R1.11 CCNC(C)c1ncc[nH]1 269862a_100015525214_100000718901 [0,2,0,0,0,0|2,0,0]=4 2181 B10R1.11 CCNC(C)c1nccs1 2230a_100000725601_100000210202 [0,2,0,0,0,0|1,0,0]=3 2182 B10R1.11 CCOC(C)c1nccs1 7a_100000751044_100000210202 [0,2,0,0,0,0|0,0,0]=2 2183 B10R1.11 CCO[C@@H](C)c1ccco1 34a_100000755270_100000210202 [0,2,0,0,0,0|1,1,0]=4 2184 B10R1.11 CCO[C@@H](C)c1ccco1 7a_100000755270_100000210202 [0,2,0,0,0,0|1,1,0]=4 2185 B10R1.11 CCO[C@H](C)c1cccs1 7a_100000750433_100000210202 [0,2,0,0,0,0|1,0,0]=3 2186 B10R1.11 CN(CCO)c1ncns1 27a_100000210263_100000693119 [0,2,0,0,0,0|2,0,0]=4 2187 B10R1.11 CN(CCO)c1nncs1 27a_100000210263_100000739804 [0,2,0,0,0,0|2,0,0]=4 2188 B10R1.11 CNCC(=O)c1cccs1 2230a_106832991635_100000211436 [0,2,0,0,0,0|2,0,0]=4 2189 B10R1.11 CNCC(=O)c1cccs1 7a_106832991635_100000211436 [0,2,0,0,0,0|2,0,0]=4 2190 B10R1.11 CNCC(=O)c1nccs1 7a_106832991635_100000718653 [0,2,0,0,0,0|1,0,0]=3 2191 B10R1.11 COCC(N)c1cccs1 34a_100102422791_200000210301 [0,2,0,0,0,0|2,0,0]=4 2192 B10R1.11 CSCC(=O)c1cccs1 62a_100000211436_200000210301 [0,2,0,0,0,0|2,0,0]=4 2193 B10R1.11 CSCC(=O)c1cccs1 62a_200000210301_100000211436 [0,2,0,0,0,0|2,0,0]=4 2194 B10R1.11 CSCC(=O)c1nccs1 62a_100000718653_200000210301 [0,2,0,0,0,0|1,0,0]=3 2195 B10R1.11 CSCC(=O)c1nccs1 62a_200000210301_100000718653 [0,2,0,0,0,0|1,0,0]=3 2196 B10R1.11 C[C@@H](OCF)c1cccs1 7a_100000750433_100015361967 [0,2,0,0,0,0|2,0,0]=4 2197 B10R1.11 [13CH3]OCC(N)c1cccs1 34a_100102422791_200025704644 [0,2,0,0,0,0|2,0,0]=4 2198 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_100000211436_200025704644 [0,2,0,0,0,0|2,0,0]=4 2199 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_200025704644_100000211436 [0,2,0,0,0,0|2,0,0]=4 2200 B10R1.11 [13CH3]SCC(=O)c1nccs1 62a_100000718653_200025704644 [0,2,0,0,0,0|1,0,0]=3 2201 B10R1.11 [13CH3]SCC(=O)c1nccs1 62a_200025704644_100000718653 [0,2,0,0,0,0|1,0,0]=3 2202 B10R1.23 CC(=C(C)c1nccs1)C 271570a_200000049429_100000211983 [0,2,0,0,0,0|1,0,1]=4 2203 B10R1.23 CC(C)N(C)c1ncns1 27a_200000211004_100000693119 [0,2,0,0,0,0|2,0,0]=4 2204 B10R1.23 CC(C)N(C)c1nncs1 27a_200000211004_100000739804 [0,2,0,0,0,0|2,0,0]=4 2205 B10R1.23 CC(c1nccs1)N(C)C 2230a_103437849288_200000210301 [0,2,0,0,0,0|2,0,0]=4 2206 B10R1.23 CC(c1nccs1)N(C)C 269982a_103437849288_200000210301 [0,2,0,0,0,0|2,0,0]=4 2207 B10R1.23 CC(c1nccs1)N(C)[13CH3] 2230a_103437849288_200025704644 [0,2,0,0,0,0|2,0,0]=4 2208 B10R1.23 CC(c1nccs1)N(C)[13CH3] 269982a_103437849288_200025704644 [0,2,0,0,0,0|2,0,0]=4 2209 B10R1.21 BrCCOCc1c[nH]cn1 34a_100000211926_100000707719 [0,2,0,0,0,0|2,0,0]=4 2210 B10R1.21 BrCCOCc1ccon1 34a_100000211926_100000234950 [0,2,0,0,0,0|2,0,0]=4 2211 B10R1.21 BrCCOCc1cncs1 34a_100000211926_100015185245 [0,2,0,0,0,0|2,0,0]=4 2212 B10R1.21 BrCCOCc1cscn1 34a_100000211926_100000205941 [0,2,0,0,0,0|2,0,0]=4 2213 B10R1.21 BrCCOCc1ncc[nH]1 34a_100000211926_100016991755 [0,2,0,0,0,0|1,0,0]=3 2214 B10R1.21 BrCCOCc1ncco1 34a_100000211926_103436540062 [0,2,0,0,0,0|0,1,0]=3 2215 B10R1.21 BrCCOCc1nccs1 34a_100000211926_100015184050 [0,2,0,0,0,0|0,0,0]=2 2216 B10R1.21 BrCCOCc1ncon1 34a_100000211926_100000233494 [0,2,0,0,0,0|2,0,0]=4 2217 B10R1.21 C#CCCNc1ncns1 27a_100000755551_100000693119 [0,2,0,0,0,0|2,0,0]=4 2218 B10R1.21 C#CCCNc1nncs1 27a_100000755551_100000739804 [0,2,0,0,0,0|2,0,0]=4 2219 B10R1.21 C#CCCSc1cccs1 62a_100000688953_100011215356 [0,2,0,0,0,0|1,1,0]=4 2220 B10R1.21 C#CCCSc1cccs1 62a_100011215356_100000688953 [0,2,0,0,0,0|1,1,0]=4 2221 B10R1.21 C#CCCSc1ncc[nH]1 62a_100000688953_100025796157 [0,2,0,0,0,0|1,1,0]=4 2222 B10R1.21 C#CCCSc1ncc[nH]1 62a_100025796157_100000688953 [0,2,0,0,0,0|1,1,0]=4 2223 B10R1.21 C#CCCSc1ncco1 62a_100000688953_100011787736 [0,2,0,0,0,0|0,2,0]=4 2224 B10R1.21 C#CCCSc1ncco1 62a_100011787736_100000688953 [0,2,0,0,0,0|0,2,0]=4 2225 B10R1.21 C#CCCSc1nccs1 62a_100000211983_100000688953 [0,2,0,0,0,0|0,1,0]=3 2226 B10R1.21 C#CCCSc1nccs1 62a_100000688953_100000211983 [0,2,0,0,0,0|0,1,0]=3 2227 B10R1.21 C#CCCSc1ncns1 62a_100000688953_100000693119 [0,2,0,0,0,0|1,1,0]=4 2228 B10R1.21 C#CCCSc1ncns1 62a_100000693119_100000688953 [0,2,0,0,0,0|1,1,0]=4 2229 B10R1.21 C#CCCSc1nncs1 62a_100000688953_100000739804 [0,2,0,0,0,0|1,1,0]=4 2230 B10R1.21 C#CCCSc1nncs1 62a_100000739804_100000688953 [0,2,0,0,0,0|1,1,0]=4 2231 B10R1.21 C#CCNCc1nccs1 2230a_100000740555_100000038162 [0,2,0,0,0,0|1,0,1]=4 2232 B10R1.21 C#CCNCc1nccs1 34a_100000212058_100015184050 [0,2,0,0,0,0|1,0,1]=4 2233 B10R1.21 C#CCOCc1cccs1 34a_100000211240_100000184674 [0,2,0,0,0,0|1,0,1]=4 2234 B10R1.21 C#CCOCc1ncc[nH]1 34a_100000210247_100016991755 [0,2,0,0,0,0|1,0,1]=4 2235 B10R1.21 C#CCOCc1ncco1 34a_100000062594_100000184674 [0,2,0,0,0,0|0,1,1]=4 2236 B10R1.21 C#CCOCc1ncco1 34a_100000210247_103436540062 [0,2,0,0,0,0|0,1,1]=4 2237 B10R1.21 C#CCOCc1nccs1 34a_100000210247_100015184050 [0,2,0,0,0,0|0,0,1]=3 2238 B10R1.21 C#CCSCc1nccs1 62a_100000038162_100015184050 [0,2,0,0,0,0|0,1,1]=4 2239 B10R1.21 C/C=C/CSc1cccs1 62a_100011215356_100102629194 [0,2,0,0,0,0|1,1,0]=4 2240 B10R1.21 C/C=C/CSc1cccs1 62a_100102629194_100011215356 [0,2,0,0,0,0|1,1,0]=4 2241 B10R1.21 C/C=C/CSc1ncc[nH]1 62a_100025796157_100102629194 [0,2,0,0,0,0|1,1,0]=4 2242 B10R1.21 C/C=C/CSc1ncc[nH]1 62a_100102629194_100025796157 [0,2,0,0,0,0|1,1,0]=4 2243 B10R1.21 C/C=C/CSc1ncco1 62a_100011787736_100102629194 [0,2,0,0,0,0|0,2,0]=4 2244 B10R1.21 C/C=C/CSc1ncco1 62a_100102629194_100011787736 [0,2,0,0,0,0|0,2,0]=4 2245 B10R1.21 C/C=C/CSc1nccs1 62a_100000211983_100102629194 [0,2,0,0,0,0|0,1,0]=3 2246 B10R1.21 C/C=C/CSc1nccs1 62a_100102629194_100000211983 [0,2,0,0,0,0|0,1,0]=3 2247 B10R1.21 C/C=C/CSc1ncns1 62a_100000693119_100102629194 [0,2,0,0,0,0|1,1,0]=4 2248 B10R1.21 C/C=C/CSc1ncns1 62a_100102629194_100000693119 [0,2,0,0,0,0|1,1,0]=4 2249 B10R1.21 C/C=C/CSc1nncs1 62a_100000739804_100102629194 [0,2,0,0,0,0|1,1,0]=4 2250 B10R1.21 C/C=C/CSc1nncs1 62a_100102629194_100000739804 [0,2,0,0,0,0|1,1,0]=4 2251 B10R1.21 C=CCCNc1ncns1 27a_100015191253_100000693119 [0,2,0,0,0,0|2,0,0]=4 2252 B10R1.21 C=CCCNc1nncs1 27a_100015191253_100000739804 [0,2,0,0,0,0|2,0,0]=4 2253 B10R1.21 C=CCCSc1cccs1 62a_100000754431_100011215356 [0,2,0,0,0,0|1,1,0]=4 2254 B10R1.21 C=CCCSc1cccs1 62a_100011215356_100000754431 [0,2,0,0,0,0|1,1,0]=4 2255 B10R1.21 C=CCCSc1ncc[nH]1 62a_100000754431_100025796157 [0,2,0,0,0,0|1,1,0]=4 2256 B10R1.21 C=CCCSc1ncc[nH]1 62a_100025796157_100000754431 [0,2,0,0,0,0|1,1,0]=4 2257 B10R1.21 C=CCCSc1ncco1 62a_100000754431_100011787736 [0,2,0,0,0,0|0,2,0]=4 2258 B10R1.21 C=CCCSc1ncco1 62a_100011787736_100000754431 [0,2,0,0,0,0|0,2,0]=4 2259 B10R1.21 C=CCCSc1nccs1 62a_100000211983_100000754431 [0,2,0,0,0,0|0,1,0]=3 2260 B10R1.21 C=CCCSc1nccs1 62a_100000754431_100000211983 [0,2,0,0,0,0|0,1,0]=3 2261 B10R1.21 C=CCCSc1ncns1 62a_100000693119_100000754431 [0,2,0,0,0,0|1,1,0]=4 2262 B10R1.21 C=CCCSc1ncns1 62a_100000754431_100000693119 [0,2,0,0,0,0|1,1,0]=4 2263 B10R1.21 C=CCCSc1nncs1 62a_100000739804_100000754431 [0,2,0,0,0,0|1,1,0]=4 2264 B10R1.21 C=CCCSc1nncs1 62a_100000754431_100000739804 [0,2,0,0,0,0|1,1,0]=4 2265 B10R1.21 C=CCNCc1nccs1 2230a_100000740555_100000210623 [0,2,0,0,0,0|1,0,1]=4 2266 B10R1.21 C=CCNCc1nccs1 2230a_100020586998_100015184050 [0,2,0,0,0,0|1,0,1]=4 2267 B10R1.21 C=CCNCc1nccs1 270004a_100020586998_100000750902 [0,2,0,0,0,0|1,0,1]=4 2268 B10R1.21 C=CCOCc1cccs1 34a_100000211240_100015514636 [0,2,0,0,0,0|1,0,1]=4 2269 B10R1.21 C=CCOCc1ncc[nH]1 34a_200000210373_100016991755 [0,2,0,0,0,0|1,0,1]=4 2270 B10R1.21 C=CCOCc1ncco1 34a_100000062594_100015514636 [0,2,0,0,0,0|0,1,1]=4 2271 B10R1.21 C=CCOCc1ncco1 34a_200000210373_103436540062 [0,2,0,0,0,0|0,1,1]=4 2272 B10R1.21 C=CCOCc1nccs1 34a_200000210373_100015184050 [0,2,0,0,0,0|0,0,1]=3 2273 B10R1.21 C=CCSCc1nccs1 62a_100000210623_100015184050 [0,2,0,0,0,0|0,1,1]=4 2274 B10R1.21 C=CCSCc1nccs1 62a_100015184050_100000210623 [0,2,0,0,0,0|0,1,1]=4 2275 B10R1.21 CC#CCNc1ncns1 27a_100000685387_100000693119 [0,2,0,0,0,0|2,0,0]=4 2276 B10R1.21 CC#CCNc1nncs1 27a_100000685387_100000739804 [0,2,0,0,0,0|2,0,0]=4 2277 B10R1.21 CC#CCSc1cccs1 62a_100000748600_100011215356 [0,2,0,0,0,0|1,1,0]=4 2278 B10R1.21 CC#CCSc1cccs1 62a_100011215356_100000748600 [0,2,0,0,0,0|1,1,0]=4 2279 B10R1.21 CC#CCSc1ncc[nH]1 62a_100000748600_100025796157 [0,2,0,0,0,0|1,1,0]=4 2280 B10R1.21 CC#CCSc1ncc[nH]1 62a_100025796157_100000748600 [0,2,0,0,0,0|1,1,0]=4 2281 B10R1.21 CC#CCSc1ncco1 62a_100000748600_100011787736 [0,2,0,0,0,0|0,2,0]=4 2282 B10R1.21 CC#CCSc1ncco1 62a_100011787736_100000748600 [0,2,0,0,0,0|0,2,0]=4 2283 B10R1.21 CC#CCSc1nccs1 62a_100000211983_100000748600 [0,2,0,0,0,0|0,1,0]=3 2284 B10R1.21 CC#CCSc1nccs1 62a_100000748600_100000211983 [0,2,0,0,0,0|0,1,0]=3 2285 B10R1.21 CC#CCSc1ncns1 62a_100000693119_100000748600 [0,2,0,0,0,0|1,1,0]=4 2286 B10R1.21 CC#CCSc1ncns1 62a_100000748600_100000693119 [0,2,0,0,0,0|1,1,0]=4 2287 B10R1.21 CC#CCSc1nncs1 62a_100000739804_100000748600 [0,2,0,0,0,0|1,1,0]=4 2288 B10R1.21 CC#CCSc1nncs1 62a_100000748600_100000739804 [0,2,0,0,0,0|1,1,0]=4 2289 B10R1.21 CC=CCSc1cccs1 62a_100000070051_100011215356 [0,2,0,0,0,0|1,1,0]=4 2290 B10R1.21 CC=CCSc1cccs1 62a_100011215356_100000070051 [0,2,0,0,0,0|1,1,0]=4 2291 B10R1.21 CC=CCSc1ncc[nH]1 62a_100000070051_100025796157 [0,2,0,0,0,0|1,1,0]=4 2292 B10R1.21 CC=CCSc1ncc[nH]1 62a_100025796157_100000070051 [0,2,0,0,0,0|1,1,0]=4 2293 B10R1.21 CC=CCSc1ncco1 62a_100000070051_100011787736 [0,2,0,0,0,0|0,2,0]=4 2294 B10R1.21 CC=CCSc1ncco1 62a_100011787736_100000070051 [0,2,0,0,0,0|0,2,0]=4 2295 B10R1.21 CC=CCSc1nccs1 62a_100000070051_100000211983 [0,2,0,0,0,0|0,1,0]=3 2296 B10R1.21 CC=CCSc1nccs1 62a_100000211983_100000070051 [0,2,0,0,0,0|0,1,0]=3 2297 B10R1.21 CC=CCSc1ncns1 62a_100000070051_100000693119 [0,2,0,0,0,0|1,1,0]=4 2298 B10R1.21 CC=CCSc1ncns1 62a_100000693119_100000070051 [0,2,0,0,0,0|1,1,0]=4 2299 B10R1.21 CC=CCSc1nncs1 62a_100000070051_100000739804 [0,2,0,0,0,0|1,1,0]=4 2300 B10R1.21 CC=CCSc1nncs1 62a_100000739804_100000070051 [0,2,0,0,0,0|1,1,0]=4 2301 B10R1.21 CCC=NNc1nccs1 4a_100011198208_100000210100 [0,2,0,0,0,0|1,0,0]=3 2302 B10R1.21 CCCC=Cc1cccs1 271570a_100016258520_100011215356 [0,2,0,0,0,0|2,0,0]=4 2303 B10R1.21 CCCC=Cc1ncc[nH]1 271570a_100016258520_100025796157 [0,2,0,0,0,0|2,0,0]=4 2304 B10R1.21 CCCC=Cc1ncco1 271570a_100016258520_100011787736 [0,2,0,0,0,0|1,1,0]=4 2305 B10R1.21 CCCC=Cc1nccs1 271570a_100016258520_100000211983 [0,2,0,0,0,0|1,0,0]=3 2306 B10R1.21 CCCC=Cc1ncns1 271570a_100016258520_100000693119 [0,2,0,0,0,0|2,0,0]=4 2307 B10R1.21 CCCC=Cc1nncs1 271570a_100016258520_100000739804 [0,2,0,0,0,0|2,0,0]=4 2308 B10R1.21 CCCCNc1ncns1 27a_100000102301_100000693119 [0,2,0,0,0,0|2,0,0]=4 2309 B10R1.21 CCCCNc1nncs1 27a_100000102301_100000739804 [0,2,0,0,0,0|2,0,0]=4 2310 B10R1.21 CCCCSc1cccs1 62a_100000210211_100011215356 [0,2,0,0,0,0|1,1,0]=4 2311 B10R1.21 CCCCSc1cccs1 62a_100011215356_100000210210 [0,2,0,0,0,0|1,1,0]=4 2312 B10R1.21 CCCCSc1ncc[nH]1 62a_100000210211_100025796157 [0,2,0,0,0,0|1,1,0]=4 2313 B10R1.21 CCCCSc1ncc[nH]1 62a_100025796157_100000210210 [0,2,0,0,0,0|1,1,0]=4 2314 B10R1.21 CCCCSc1ncco1 62a_100000210211_100011787736 [0,2,0,0,0,0|0,2,0]=4 2315 B10R1.21 CCCCSc1ncco1 62a_100011787736_100000210210 [0,2,0,0,0,0|0,2,0]=4 2316 B10R1.21 CCCCSc1nccs1 62a_100000210211_100000211983 [0,2,0,0,0,0|0,1,0]=3 2317 B10R1.21 CCCCSc1nccs1 62a_100000211983_100000210210 [0,2,0,0,0,0|0,1,0]=3 2318 B10R1.21 CCCCSc1ncns1 62a_100000210211_100000693119 [0,2,0,0,0,0|1,1,0]=4 2319 B10R1.21 CCCCSc1ncns1 62a_100000693119_100000210210 [0,2,0,0,0,0|1,1,0]=4 2320 B10R1.21 CCCCSc1nncs1 62a_100000210211_100000739804 [0,2,0,0,0,0|1,1,0]=4 2321 B10R1.21 CCCCSc1nncs1 62a_100000739804_100000210210 [0,2,0,0,0,0|1,1,0]=4 2322 B10R1.21 CCCNCc1cccs1 207a_100020643023_100000209959 [0,2,0,0,0,0|2,0,0]=4 2323 B10R1.21 CCCNCc1cccs1 2230a_100000211653_100000210303 [0,2,0,0,0,0|2,0,0]=4 2324 B10R1.21 CCCNCc1cccs1 270004a_100020643023_100000209959 [0,2,0,0,0,0|2,0,0]=4 2325 B10R1.21 CCCNCc1ncc[nH]1 207a_100020643023_100000743867 [0,2,0,0,0,0|2,0,0]=4 2326 B10R1.21 CCCNCc1ncco1 2230a_100016994969_100000210303 [0,2,0,0,0,0|1,1,0]=4 2327 B10R1.21 CCCNCc1ncco1 270004a_100020643023_100000064290 [0,2,0,0,0,0|1,1,0]=4 2328 B10R1.21 CCCNCc1nccs1 207a_100020643023_100000750902 [0,2,0,0,0,0|1,0,0]=3 2329 B10R1.21 CCCNCc1nccs1 2230a_100000740555_100000210303 [0,2,0,0,0,0|1,0,0]=3 2330 B10R1.21 CCCNCc1nccs1 270004a_100020643023_100000750902 [0,2,0,0,0,0|1,0,0]=3 2331 B10R1.21 CCCOCc1c[nH]cn1 34a_100000210258_100000707719 [0,2,0,0,0,0|2,0,0]=4 2332 B10R1.21 CCCOCc1ccco1 34a_100000210059_100000210303 [0,2,0,0,0,0|1,1,0]=4 2333 B10R1.21 CCCOCc1cccs1 34a_100000211240_100000210303 [0,2,0,0,0,0|1,0,0]=3 2334 B10R1.21 CCCOCc1ccon1 34a_100000210258_100000234950 [0,2,0,0,0,0|2,0,0]=4 2335 B10R1.21 CCCOCc1cncs1 34a_100000210258_100015185245 [0,2,0,0,0,0|2,0,0]=4 2336 B10R1.21 CCCOCc1cscn1 34a_100000210258_100000205941 [0,2,0,0,0,0|2,0,0]=4 2337 B10R1.21 CCCOCc1ncc[nH]1 34a_100000210258_100016991755 [0,2,0,0,0,0|1,0,0]=3 2338 B10R1.21 CCCOCc1ncco1 34a_100000062594_100000210303 [0,2,0,0,0,0|0,1,0]=3 2339 B10R1.21 CCCOCc1ncco1 34a_100000210258_103436540062 [0,2,0,0,0,0|0,1,0]=3 2340 B10R1.21 CCCOCc1nccs1 34a_100000210258_100015184050 [0,2,0,0,0,0|0,0,0]=2 2341 B10R1.21 CCCOCc1ncon1 34a_100000210258_100000233494 [0,2,0,0,0,0|2,0,0]=4 2342 B10R1.21 CCCOCn1cccn1 34a_100000731028_100000210303 [0,2,0,0,0,0|2,0,0]=4 2343 B10R1.21 CCCSCc1ncc[nH]1 62a_100000210303_100016991755 [0,2,0,0,0,0|1,1,0]=4 2344 B10R1.21 CCCSCc1ncc[nH]1 62a_100016991755_100000210303 [0,2,0,0,0,0|1,1,0]=4 2345 B10R1.21 CCCSCc1ncco1 62a_100000210303_103436540062 [0,2,0,0,0,0|0,2,0]=4 2346 B10R1.21 CCCSCc1ncco1 62a_103436540062_100000210303 [0,2,0,0,0,0|0,2,0]=4 2347 B10R1.21 CCCSCc1nccs1 62a_100000210303_100015184050 [0,2,0,0,0,0|0,1,0]=3 2348 B10R1.21 CCCSCc1nccs1 62a_100015184050_100000210303 [0,2,0,0,0,0|0,1,0]=3 2349 B10R1.21 CCNCCc1cccs1 2230a_100000203755_100000210202 [0,2,0,0,0,0|2,0,0]=4 2350 B10R1.21 CCNCCc1cccs1 2230a_100015525214_100000748579 [0,2,0,0,0,0|2,0,0]=4 2351 B10R1.21 CCNCCc1cccs1 34a_100000203755_100000210202 [0,2,0,0,0,0|2,0,0]=4 2352 B10R1.21 CCNCCc1nccs1 2230a_100015186391_100000210202 [0,2,0,0,0,0|1,0,0]=3 2353 B10R1.21 CCNN=Cc1cccs1 4a_100000756455_100000209959 [0,2,0,0,0,0|2,0,0]=4 2354 B10R1.21 CCNN=Cc1ncc[nH]1 4a_100000756455_100000743867 [0,2,0,0,0,0|2,0,0]=4 2355 B10R1.21 CCNN=Cc1ncco1 4a_100000756455_100000064290 [0,2,0,0,0,0|1,1,0]=4 2356 B10R1.21 CCNN=Cc1nccs1 4a_100000756455_100000750902 [0,2,0,0,0,0|1,0,0]=3 2357 B10R1.21 CCOC=Cc1c[nH]cn1 271570a_100016256518_100000756875 [0,2,0,0,0,0|2,0,0]=4 2358 B10R1.21 CCOC=Cc1cc[nH]n1 271570a_100016256518_100000062575 [0,2,0,0,0,0|2,0,0]=4 2359 B10R1.21 CCOC=Cc1ccco1 271570a_100016256518_100009814098 [0,2,0,0,0,0|1,1,0]=4 2360 B10R1.21 CCOC=Cc1cccs1 271570a_100016256518_100011215356 [0,2,0,0,0,0|1,0,0]=3 2361 B10R1.21 CCOC=Cc1ccsn1 271570a_100016256518_100009818082 [0,2,0,0,0,0|2,0,0]=4 2362 B10R1.21 CCOC=Cc1cncs1 271570a_100016256518_100011934649 [0,2,0,0,0,0|2,0,0]=4 2363 B10R1.21 CCOC=Cc1cscn1 271570a_100016256518_100000751502 [0,2,0,0,0,0|2,0,0]=4 2364 B10R1.21 CCOC=Cc1nc[nH]n1 271570a_100016256518_100000761765 [0,2,0,0,0,0|2,0,0]=4 2365 B10R1.21 CCOC=Cc1ncc[nH]1 271570a_100016256518_100025796157 [0,2,0,0,0,0|1,0,0]=3 2366 B10R1.21 CCOC=Cc1ncco1 271570a_100016256518_100011787736 [0,2,0,0,0,0|0,1,0]=3 2367 B10R1.21 CCOC=Cc1nccs1 271570a_100016256518_100000211983 [0,2,0,0,0,0|0,0,0]=2 2368 B10R1.21 CCOC=Cc1ncns1 271570a_100016256518_100000693119 [0,2,0,0,0,0|1,0,0]=3 2369 B10R1.21 CCOC=Cc1nncs1 271570a_100016256518_100000739804 [0,2,0,0,0,0|1,0,0]=3 2370 B10R1.21 CCOCCc1cccs1 34a_100011216825_100000210202 [0,2,0,0,0,0|1,0,0]=3 2371 B10R1.21 CCOCCc1cccs1 34a_100121572206_100000748579 [0,2,0,0,0,0|1,0,0]=3 2372 B10R1.21 CCOCCc1cccs1 7a_100011216825_100000210202 [0,2,0,0,0,0|1,0,0]=3 2373 B10R1.21 CCOCCc1ncc[nH]1 34a_103549771195_100000210202 [0,2,0,0,0,0|1,0,0]=3 2374 B10R1.21 CCOCCn1cccn1 34a_100000743371_100000210202 [0,2,0,0,0,0|2,0,0]=4 2375 B10R1.21 CCOCCn1cccn1 34a_100121572206_100015204718 [0,2,0,0,0,0|2,0,0]=4 2376 B10R1.21 CCOCSc1c[nH]cn1 62a_100000739092_100000756875 [0,2,0,0,0,0|2,0,0]=4 2377 B10R1.21 CCOCSc1c[nH]cn1 62a_100000756875_100000739092 [0,2,0,0,0,0|2,0,0]=4 2378 B10R1.21 CCOCSc1cc[nH]n1 62a_100000062575_100000739092 [0,2,0,0,0,0|2,0,0]=4 2379 B10R1.21 CCOCSc1cc[nH]n1 62a_100000739092_100000062575 [0,2,0,0,0,0|2,0,0]=4 2380 B10R1.21 CCOCSc1ccco1 62a_100000739092_100009814098 [0,2,0,0,0,0|1,1,0]=4 2381 B10R1.21 CCOCSc1ccco1 62a_100009814098_100000739092 [0,2,0,0,0,0|1,1,0]=4 2382 B10R1.21 CCOCSc1cccs1 62a_100000739092_100011215356 [0,2,0,0,0,0|1,0,0]=3 2383 B10R1.21 CCOCSc1cccs1 62a_100011215356_100000739092 [0,2,0,0,0,0|1,0,0]=3 2384 B10R1.21 CCOCSc1ccon1 62a_100000739092_100009818083 [0,2,0,0,0,0|2,0,0]=4 2385 B10R1.21 CCOCSc1ccon1 62a_100009818083_100000739092 [0,2,0,0,0,0|2,0,0]=4 2386 B10R1.21 CCOCSc1ccsn1 62a_100000739092_100009818082 [0,2,0,0,0,0|2,0,0]=4 2387 B10R1.21 CCOCSc1ccsn1 62a_100009818082_100000739092 [0,2,0,0,0,0|2,0,0]=4 2388 B10R1.21 CCOCSc1cncs1 62a_100000739092_100011934649 [0,2,0,0,0,0|2,0,0]=4 2389 B10R1.21 CCOCSc1cncs1 62a_100011934649_100000739092 [0,2,0,0,0,0|2,0,0]=4 2390 B10R1.21 CCOCSc1cscn1 62a_100000739092_100000751502 [0,2,0,0,0,0|2,0,0]=4 2391 B10R1.21 CCOCSc1cscn1 62a_100000751502_100000739092 [0,2,0,0,0,0|2,0,0]=4 2392 B10R1.21 CCOCSc1nc[nH]n1 62a_100000739092_100000761765 [0,2,0,0,0,0|2,0,0]=4 2393 B10R1.21 CCOCSc1nc[nH]n1 62a_100000761765_100000739092 [0,2,0,0,0,0|2,0,0]=4 2394 B10R1.21 CCOCSc1ncc[nH]1 62a_100000739092_100025796157 [0,2,0,0,0,0|1,0,0]=3 2395 B10R1.21 CCOCSc1ncc[nH]1 62a_100025796157_100000739092 [0,2,0,0,0,0|1,0,0]=3 2396 B10R1.21 CCOCSc1ncco1 62a_100000739092_100011787736 [0,2,0,0,0,0|0,1,0]=3 2397 B10R1.21 CCOCSc1ncco1 62a_100011787736_100000739092 [0,2,0,0,0,0|0,1,0]=3 2398 B10R1.21 CCOCSc1nccs1 62a_100000211983_100000739092 [0,2,0,0,0,0|0,0,0]=2 2399 B10R1.21 CCOCSc1nccs1 62a_100000739092_100000211983 [0,2,0,0,0,0|0,0,0]=2 2400 B10R1.21 CCOCSc1ncns1 62a_100000693119_100000739092 [0,2,0,0,0,0|1,0,0]=3 2401 B10R1.21 CCOCSc1ncns1 62a_100000739092_100000693119 [0,2,0,0,0,0|1,0,0]=3 2402 B10R1.21 CCOCSc1nncs1 62a_100000739092_100000739804 [0,2,0,0,0,0|1,0,0]=3 2403 B10R1.21 CCOCSc1nncs1 62a_100000739804_100000739092 [0,2,0,0,0,0|1,0,0]=3 2404 B10R1.21 CCSCCc1cccs1 62a_100000210202_100000748579 [0,2,0,0,0,0|1,1,0]=4 2405 B10R1.21 CCSCCc1cccs1 62a_100000748579_100000210202 [0,2,0,0,0,0|1,1,0]=4 2406 B10R1.21 CNCCCc1cccs1 2230a_106832991635_100010992444 [0,2,0,0,0,0|2,0,0]=4 2407 B10R1.21 CNCCCc1cccs1 34a_100102657272_100010992444 [0,2,0,0,0,0|2,0,0]=4 2408 B10R1.21 CNCCCc1cccs1 7a_106832991635_100010992444 [0,2,0,0,0,0|2,0,0]=4 2409 B10R1.21 COCC=Cc1cccs1 271570a_100016286323_100011215356 [0,2,0,0,0,0|2,0,0]=4 2410 B10R1.21 COCC=Cc1ncc[nH]1 271570a_100016286323_100025796157 [0,2,0,0,0,0|2,0,0]=4 2411 B10R1.21 COCC=Cc1ncco1 271570a_100016286323_100011787736 [0,2,0,0,0,0|1,1,0]=4 2412 B10R1.21 COCC=Cc1nccs1 271570a_100016286323_100000211983 [0,2,0,0,0,0|1,0,0]=3 2413 B10R1.21 COCC=Cc1ncns1 271570a_100016286323_100000693119 [0,2,0,0,0,0|2,0,0]=4 2414 B10R1.21 COCC=Cc1nncs1 271570a_100016286323_100000739804 [0,2,0,0,0,0|2,0,0]=4 2415 B10R1.21 COCCCc1cccs1 34a_100011713143_200000210301 [0,2,0,0,0,0|2,0,0]=4 2416 B10R1.21 COCCCc1cccs1 34a_100138415774_100010992444 [0,2,0,0,0,0|2,0,0]=4 2417 B10R1.21 COCCCc1cccs1 7a_100011713143_200000210301 [0,2,0,0,0,0|2,0,0]=4 2418 B10R1.21 COCCNc1ncns1 27a_100000209980_100000693119 [0,2,0,0,0,0|2,0,0]=4 2419 B10R1.21 COCCNc1nncs1 27a_100000209980_100000739804 [0,2,0,0,0,0|2,0,0]=4 2420 B10R1.21 COCCSc1cccs1 62a_100000233755_100011215356 [0,2,0,0,0,0|1,1,0]=4 2421 B10R1.21 COCCSc1cccs1 62a_100011215356_100000233755 [0,2,0,0,0,0|1,1,0]=4 2422 B10R1.21 COCCSc1ncc[nH]1 62a_100000233755_100025796157 [0,2,0,0,0,0|1,1,0]=4 2423 B10R1.21 COCCSc1ncc[nH]1 62a_100025796157_100000233755 [0,2,0,0,0,0|1,1,0]=4 2424 B10R1.21 COCCSc1ncco1 62a_100000233755_100011787736 [0,2,0,0,0,0|0,2,0]=4 2425 B10R1.21 COCCSc1ncco1 62a_100011787736_100000233755 [0,2,0,0,0,0|0,2,0]=4 2426 B10R1.21 COCCSc1nccs1 62a_100000211983_100000233755 [0,2,0,0,0,0|0,1,0]=3 2427 B10R1.21 COCCSc1nccs1 62a_100000233755_100000211983 [0,2,0,0,0,0|0,1,0]=3 2428 B10R1.21 COCCSc1ncns1 62a_100000233755_100000693119 [0,2,0,0,0,0|1,1,0]=4 2429 B10R1.21 COCCSc1ncns1 62a_100000693119_100000233755 [0,2,0,0,0,0|1,1,0]=4 2430 B10R1.21 COCCSc1nncs1 62a_100000233755_100000739804 [0,2,0,0,0,0|1,1,0]=4 2431 B10R1.21 COCCSc1nncs1 62a_100000739804_100000233755 [0,2,0,0,0,0|1,1,0]=4 2432 B10R1.21 COCNCc1cccs1 2230a_100000211653_100000766300 [0,2,0,0,0,0|2,0,0]=4 2433 B10R1.21 COCNCc1ncco1 2230a_100016994969_100000766300 [0,2,0,0,0,0|1,1,0]=4 2434 B10R1.21 COCNCc1nccs1 2230a_100000740555_100000766300 [0,2,0,0,0,0|1,0,0]=3 2435 B10R1.21 COCSCc1ncc[nH]1 62a_100000766300_100016991755 [0,2,0,0,0,0|1,1,0]=4 2436 B10R1.21 COCSCc1ncc[nH]1 62a_100016991755_100000766300 [0,2,0,0,0,0|1,1,0]=4 2437 B10R1.21 COCSCc1ncco1 62a_100000766300_103436540062 [0,2,0,0,0,0|0,2,0]=4 2438 B10R1.21 COCSCc1ncco1 62a_103436540062_100000766300 [0,2,0,0,0,0|0,2,0]=4 2439 B10R1.21 COCSCc1nccs1 62a_100000766300_100015184050 [0,2,0,0,0,0|0,1,0]=3 2440 B10R1.21 COCSCc1nccs1 62a_100015184050_100000766300 [0,2,0,0,0,0|0,1,0]=3 2441 B10R1.21 CSCCCc1cccs1 62a_100010992444_200000210301 [0,2,0,0,0,0|2,0,0]=4 2442 B10R1.21 CSCCCc1cccs1 62a_200000210301_100010992444 [0,2,0,0,0,0|2,0,0]=4 2443 B10R1.21 CSCCNc1ncns1 27a_100020590264_100000693119 [0,2,0,0,0,0|2,0,0]=4 2444 B10R1.21 CSCCNc1nncs1 27a_100020590264_100000739804 [0,2,0,0,0,0|2,0,0]=4 2445 B10R1.21 CSCCSc1cccs1 62a_100000212216_100011215356 [0,2,0,0,0,0|1,1,0]=4 2446 B10R1.21 CSCCSc1cccs1 62a_100011215356_100000751147 [0,2,0,0,0,0|1,1,0]=4 2447 B10R1.21 CSCCSc1ncc[nH]1 62a_100000212216_100025796157 [0,2,0,0,0,0|1,1,0]=4 2448 B10R1.21 CSCCSc1ncc[nH]1 62a_100025796157_100000751147 [0,2,0,0,0,0|1,1,0]=4 2449 B10R1.21 CSCCSc1ncco1 62a_100000212216_100011787736 [0,2,0,0,0,0|0,2,0]=4 2450 B10R1.21 CSCCSc1ncco1 62a_100011787736_100000751147 [0,2,0,0,0,0|0,2,0]=4 2451 B10R1.21 CSCCSc1nccs1 62a_100000211983_100000751147 [0,2,0,0,0,0|0,1,0]=3 2452 B10R1.21 CSCCSc1nccs1 62a_100000212216_100000211983 [0,2,0,0,0,0|0,1,0]=3 2453 B10R1.21 CSCCSc1ncns1 62a_100000212216_100000693119 [0,2,0,0,0,0|1,1,0]=4 2454 B10R1.21 CSCCSc1ncns1 62a_100000693119_100000751147 [0,2,0,0,0,0|1,1,0]=4 2455 B10R1.21 CSCCSc1nncs1 62a_100000212216_100000739804 [0,2,0,0,0,0|1,1,0]=4 2456 B10R1.21 CSCCSc1nncs1 62a_100000739804_100000751147 [0,2,0,0,0,0|1,1,0]=4 2457 B10R1.21 CSCNCc1cccs1 2230a_100000211653_100011218213 [0,2,0,0,0,0|2,0,0]=4 2458 B10R1.21 CSCNCc1ncco1 2230a_100016994969_100011218213 [0,2,0,0,0,0|1,1,0]=4 2459 B10R1.21 CSCNCc1nccs1 2230a_100000740555_100011218213 [0,2,0,0,0,0|1,0,0]=3 2460 B10R1.21 CSCOCc1ccco1 34a_100000210059_100011218213 [0,2,0,0,0,0|1,1,0]=4 2461 B10R1.21 CSCOCc1cccs1 34a_100000211240_100011218213 [0,2,0,0,0,0|1,0,0]=3 2462 B10R1.21 CSCOCc1ncco1 34a_100000062594_100011218213 [0,2,0,0,0,0|0,1,0]=3 2463 B10R1.21 CSCOCn1cccn1 34a_100000731028_100011218213 [0,2,0,0,0,0|2,0,0]=4 2464 B10R1.21 CSCSCc1ncc[nH]1 62a_100011218213_100016991755 [0,2,0,0,0,0|1,1,0]=4 2465 B10R1.21 CSCSCc1ncc[nH]1 62a_100016991755_100011218213 [0,2,0,0,0,0|1,1,0]=4 2466 B10R1.21 CSCSCc1ncco1 62a_100011218213_103436540062 [0,2,0,0,0,0|0,2,0]=4 2467 B10R1.21 CSCSCc1ncco1 62a_103436540062_100011218213 [0,2,0,0,0,0|0,2,0]=4 2468 B10R1.21 CSCSCc1nccs1 62a_100011218213_100015184050 [0,2,0,0,0,0|0,1,0]=3 2469 B10R1.21 CSCSCc1nccs1 62a_100015184050_100011218213 [0,2,0,0,0,0|0,1,0]=3 2470 B10R1.21 FCCCNc1ncns1 27a_100015189416_100000693119 [0,2,0,0,0,0|2,0,0]=4 2471 B10R1.21 FCCCNc1nncs1 27a_100015189416_100000739804 [0,2,0,0,0,0|2,0,0]=4 2472 B10R1.21 FCCCSc1cccs1 62a_100011215356_100011934791 [0,2,0,0,0,0|1,1,0]=4 2473 B10R1.21 FCCCSc1cccs1 62a_100011934791_100011215356 [0,2,0,0,0,0|1,1,0]=4 2474 B10R1.21 FCCCSc1ncc[nH]1 62a_100011934791_100025796157 [0,2,0,0,0,0|1,1,0]=4 2475 B10R1.21 FCCCSc1ncc[nH]1 62a_100025796157_100011934791 [0,2,0,0,0,0|1,1,0]=4 2476 B10R1.21 FCCCSc1ncco1 62a_100011787736_100011934791 [0,2,0,0,0,0|0,2,0]=4 2477 B10R1.21 FCCCSc1ncco1 62a_100011934791_100011787736 [0,2,0,0,0,0|0,2,0]=4 2478 B10R1.21 FCCCSc1nccs1 62a_100000211983_100011934791 [0,2,0,0,0,0|0,1,0]=3 2479 B10R1.21 FCCCSc1nccs1 62a_100011934791_100000211983 [0,2,0,0,0,0|0,1,0]=3 2480 B10R1.21 FCCCSc1ncns1 62a_100000693119_100011934791 [0,2,0,0,0,0|1,1,0]=4 2481 B10R1.21 FCCCSc1ncns1 62a_100011934791_100000693119 [0,2,0,0,0,0|1,1,0]=4 2482 B10R1.21 FCCCSc1nncs1 62a_100000739804_100011934791 [0,2,0,0,0,0|1,1,0]=4 2483 B10R1.21 FCCCSc1nncs1 62a_100011934791_100000739804 [0,2,0,0,0,0|1,1,0]=4 2484 B10R1.21 FCCNCc1cccs1 2230a_100000211653_100011217306 [0,2,0,0,0,0|2,0,0]=4 2485 B10R1.21 FCCNCc1ncc[nH]1 34a_100000724931_100016991755 [0,2,0,0,0,0|2,0,0]=4 2486 B10R1.21 FCCNCc1ncco1 2230a_100016994969_100011217306 [0,2,0,0,0,0|1,1,0]=4 2487 B10R1.21 FCCNCc1ncco1 34a_100000724931_103436540062 [0,2,0,0,0,0|1,1,0]=4 2488 B10R1.21 FCCNCc1nccs1 2230a_100000740555_100011217306 [0,2,0,0,0,0|1,0,0]=3 2489 B10R1.21 FCCNCc1nccs1 34a_100000724931_100015184050 [0,2,0,0,0,0|1,0,0]=3 2490 B10R1.21 FCCOCc1ccco1 34a_100000210059_100011217306 [0,2,0,0,0,0|1,1,0]=4 2491 B10R1.21 FCCOCc1cccs1 34a_100000211240_100011217306 [0,2,0,0,0,0|1,0,0]=3 2492 B10R1.21 FCCOCc1ncco1 34a_100000062594_100011217306 [0,2,0,0,0,0|0,1,0]=3 2493 B10R1.21 FCCOCn1cccn1 34a_100000731028_100011217306 [0,2,0,0,0,0|2,0,0]=4 2494 B10R1.21 FCCSCc1ncc[nH]1 62a_100011217306_100016991755 [0,2,0,0,0,0|1,1,0]=4 2495 B10R1.21 FCCSCc1ncc[nH]1 62a_100016991755_100011217306 [0,2,0,0,0,0|1,1,0]=4 2496 B10R1.21 FCCSCc1ncco1 62a_100011217306_103436540062 [0,2,0,0,0,0|0,2,0]=4 2497 B10R1.21 FCCSCc1ncco1 62a_103436540062_100011217306 [0,2,0,0,0,0|0,2,0]=4 2498 B10R1.21 FCCSCc1nccs1 62a_100011217306_100015184050 [0,2,0,0,0,0|0,1,0]=3 2499 B10R1.21 FCCSCc1nccs1 62a_100015184050_100011217306 [0,2,0,0,0,0|0,1,0]=3 2500 B10R1.21 FCNCCc1cccs1 34a_100000203755_100015361967 [0,2,0,0,0,0|2,0,0]=4 2501 B10R1.21 FCOCCc1cccs1 34a_100011216825_100015361967 [0,2,0,0,0,0|2,0,0]=4 2502 B10R1.21 FCOCCc1cccs1 7a_100011216825_100015361967 [0,2,0,0,0,0|2,0,0]=4 2503 B10R1.21 FCOCCc1ncc[nH]1 34a_103549771195_100015361967 [0,2,0,0,0,0|2,0,0]=4 2504 B10R1.21 FCSCCc1cccs1 62a_100000748579_100015361967 [0,2,0,0,0,0|2,0,0]=4 2505 B10R1.21 FCSCCc1cccs1 62a_100015361967_100000748579 [0,2,0,0,0,0|2,0,0]=4 2506 B10R1.21 N#CCCNc1ncns1 27a_100000720768_100000693119 [0,2,0,0,0,0|2,0,0]=4 2507 B10R1.21 N#CCCNc1nncs1 27a_100000720768_100000739804 [0,2,0,0,0,0|2,0,0]=4 2508 B10R1.21 N#CCCSc1cccs1 62a_100011215226_100011215356 [0,2,0,0,0,0|1,1,0]=4 2509 B10R1.21 N#CCCSc1cccs1 62a_100011215356_100011215226 [0,2,0,0,0,0|1,1,0]=4 2510 B10R1.21 N#CCCSc1ncc[nH]1 62a_100011215226_100025796157 [0,2,0,0,0,0|1,1,0]=4 2511 B10R1.21 N#CCCSc1ncc[nH]1 62a_100025796157_100011215226 [0,2,0,0,0,0|1,1,0]=4 2512 B10R1.21 N#CCCSc1ncco1 62a_100011215226_100011787736 [0,2,0,0,0,0|0,2,0]=4 2513 B10R1.21 N#CCCSc1ncco1 62a_100011787736_100011215226 [0,2,0,0,0,0|0,2,0]=4 2514 B10R1.21 N#CCCSc1nccs1 62a_100000211983_100011215226 [0,2,0,0,0,0|0,1,0]=3 2515 B10R1.21 N#CCCSc1nccs1 62a_100011215226_100000211983 [0,2,0,0,0,0|0,1,0]=3 2516 B10R1.21 N#CCCSc1ncns1 62a_100000693119_100011215226 [0,2,0,0,0,0|1,1,0]=4 2517 B10R1.21 N#CCCSc1ncns1 62a_100011215226_100000693119 [0,2,0,0,0,0|1,1,0]=4 2518 B10R1.21 N#CCCSc1nncs1 62a_100000739804_100011215226 [0,2,0,0,0,0|1,1,0]=4 2519 B10R1.21 N#CCCSc1nncs1 62a_100011215226_100000739804 [0,2,0,0,0,0|1,1,0]=4 2520 B10R1.21 N#CCNCc1nccs1 2230a_100000740555_100011215382 [0,2,0,0,0,0|1,0,1]=4 2521 B10R1.21 N#CCSCc1nccs1 62a_100011215382_100015184050 [0,2,0,0,0,0|0,1,1]=4 2522 B10R1.21 N#CCSCc1nccs1 62a_100015184050_100011215382 [0,2,0,0,0,0|0,1,1]=4 2523 B10R1.21 N#CSCSc1nccs1 62a_100000211825_100000211983 [0,2,0,0,0,0|0,1,1]=4 2524 B10R1.21 N#CSCSc1nccs1 62a_100000211983_100000211825 [0,2,0,0,0,0|0,1,1]=4 2525 B10R1.21 NCCOCc1c[nH]cn1 34a_100000210304_100000707719 [0,2,0,0,0,0|2,0,0]=4 2526 B10R1.21 NCCOCc1ccon1 34a_100000210304_100000234950 [0,2,0,0,0,0|2,0,0]=4 2527 B10R1.21 NCCOCc1cncs1 34a_100000210304_100015185245 [0,2,0,0,0,0|2,0,0]=4 2528 B10R1.21 NCCOCc1cscn1 34a_100000210304_100000205941 [0,2,0,0,0,0|2,0,0]=4 2529 B10R1.21 NCCOCc1ncc[nH]1 34a_100000210304_100016991755 [0,2,0,0,0,0|1,0,0]=3 2530 B10R1.21 NCCOCc1ncco1 34a_100000210304_103436540062 [0,2,0,0,0,0|0,1,0]=3 2531 B10R1.21 NCCOCc1nccs1 34a_100000210304_100015184050 [0,2,0,0,0,0|0,0,0]=2 2532 B10R1.21 NCCOCc1ncon1 34a_100000210304_100000233494 [0,2,0,0,0,0|2,0,0]=4 2533 B10R1.21 O=CCNCc1nccs1 2230a_100000740555_200015260668 [0,2,0,0,0,0|1,0,1]=4 2534 B10R1.21 O=CCOCc1cccs1 34a_100000211240_200009817547 [0,2,0,0,0,0|1,0,1]=4 2535 B10R1.21 O=CCOCc1ncco1 34a_100000062594_200009817547 [0,2,0,0,0,0|0,1,1]=4 2536 B10R1.21 O=CCSCc1nccs1 62a_100015184050_200015260668 [0,2,0,0,0,0|0,1,1]=4 2537 B10R1.21 O=CCSCc1nccs1 62a_200015260668_100015184050 [0,2,0,0,0,0|0,1,1]=4 2538 B10R1.21 OCCCNc1ncns1 27a_100000182051_100000693119 [0,2,0,0,0,0|2,0,0]=4 2539 B10R1.21 OCCCNc1nncs1 27a_100000182051_100000739804 [0,2,0,0,0,0|2,0,0]=4 2540 B10R1.21 OCCCSc1cccs1 62a_100011215043_100011215356 [0,2,0,0,0,0|1,1,0]=4 2541 B10R1.21 OCCCSc1cccs1 62a_100011215356_100011215043 [0,2,0,0,0,0|1,1,0]=4 2542 B10R1.21 OCCCSc1ncc[nH]1 62a_100011215043_100025796157 [0,2,0,0,0,0|1,1,0]=4 2543 B10R1.21 OCCCSc1ncc[nH]1 62a_100025796157_100011215043 [0,2,0,0,0,0|1,1,0]=4 2544 B10R1.21 OCCCSc1ncco1 62a_100011215043_100011787736 [0,2,0,0,0,0|0,2,0]=4 2545 B10R1.21 OCCCSc1ncco1 62a_100011787736_100011215043 [0,2,0,0,0,0|0,2,0]=4 2546 B10R1.21 OCCCSc1nccs1 62a_100000211983_100011215043 [0,2,0,0,0,0|0,1,0]=3 2547 B10R1.21 OCCCSc1nccs1 62a_100011215043_100000211983 [0,2,0,0,0,0|0,1,0]=3 2548 B10R1.21 OCCCSc1ncns1 62a_100000693119_100011215043 [0,2,0,0,0,0|1,1,0]=4 2549 B10R1.21 OCCCSc1ncns1 62a_100011215043_100000693119 [0,2,0,0,0,0|1,1,0]=4 2550 B10R1.21 OCCCSc1nncs1 62a_100000739804_100011215043 [0,2,0,0,0,0|1,1,0]=4 2551 B10R1.21 OCCCSc1nncs1 62a_100011215043_100000739804 [0,2,0,0,0,0|1,1,0]=4 2552 B10R1.21 OCCNCc1cccs1 207a_100000210304_100000209959 [0,2,0,0,0,0|2,0,0]=4 2553 B10R1.21 OCCNCc1cccs1 2230a_100000211653_100000211926 [0,2,0,0,0,0|2,0,0]=4 2554 B10R1.21 OCCNCc1cccs1 270004a_100000210304_100000209959 [0,2,0,0,0,0|2,0,0]=4 2555 B10R1.21 OCCNCc1ncc[nH]1 207a_100000210304_100000743867 [0,2,0,0,0,0|2,0,0]=4 2556 B10R1.21 OCCNCc1ncc[nH]1 2230a_100016997473_100016991755 [0,2,0,0,0,0|2,0,0]=4 2557 B10R1.21 OCCNCc1ncc[nH]1 34a_100016990907_100016991755 [0,2,0,0,0,0|2,0,0]=4 2558 B10R1.21 OCCNCc1ncco1 2230a_100016994969_100000211926 [0,2,0,0,0,0|1,1,0]=4 2559 B10R1.21 OCCNCc1ncco1 2230a_100016997473_103436540062 [0,2,0,0,0,0|1,1,0]=4 2560 B10R1.21 OCCNCc1ncco1 270004a_100000210304_100000064290 [0,2,0,0,0,0|1,1,0]=4 2561 B10R1.21 OCCNCc1ncco1 34a_100016990907_103436540062 [0,2,0,0,0,0|1,1,0]=4 2562 B10R1.21 OCCNCc1nccs1 207a_100000210304_100000750902 [0,2,0,0,0,0|1,0,0]=3 2563 B10R1.21 OCCNCc1nccs1 2230a_100000740555_100000211926 [0,2,0,0,0,0|1,0,0]=3 2564 B10R1.21 OCCNCc1nccs1 2230a_100016997473_100015184050 [0,2,0,0,0,0|1,0,0]=3 2565 B10R1.21 OCCNCc1nccs1 270004a_100000210304_100000750902 [0,2,0,0,0,0|1,0,0]=3 2566 B10R1.21 OCCNCc1nccs1 34a_100016990907_100015184050 [0,2,0,0,0,0|1,0,0]=3 2567 B10R1.21 OCCOCc1ccco1 34a_100000210059_100000211926 [0,2,0,0,0,0|1,1,0]=4 2568 B10R1.21 OCCOCc1cccs1 34a_100000211240_100000211926 [0,2,0,0,0,0|1,0,0]=3 2569 B10R1.21 OCCOCc1ncco1 34a_100000062594_100000211926 [0,2,0,0,0,0|0,1,0]=3 2570 B10R1.21 OCCOCn1cccn1 34a_100000731028_100000211926 [0,2,0,0,0,0|2,0,0]=4 2571 B10R1.21 OCCSCc1ncc[nH]1 62a_100000211926_100016991755 [0,2,0,0,0,0|1,1,0]=4 2572 B10R1.21 OCCSCc1ncc[nH]1 62a_100016991755_100000211926 [0,2,0,0,0,0|1,1,0]=4 2573 B10R1.21 OCCSCc1ncco1 62a_100000211926_103436540062 [0,2,0,0,0,0|0,2,0]=4 2574 B10R1.21 OCCSCc1ncco1 62a_103436540062_100000211926 [0,2,0,0,0,0|0,2,0]=4 2575 B10R1.21 OCCSCc1nccs1 62a_100000211926_100015184050 [0,2,0,0,0,0|0,1,0]=3 2576 B10R1.21 OCCSCc1nccs1 62a_100015184050_100000211926 [0,2,0,0,0,0|0,1,0]=3 2577 B10R1.21 [13CH3]OCCCc1cccs1 34a_100011713143_200025704644 [0,2,0,0,0,0|2,0,0]=4 2578 B10R1.21 [13CH3]OCCCc1cccs1 7a_100011713143_200025704644 [0,2,0,0,0,0|2,0,0]=4 2579 B10R1.21 [13CH3]SCCCc1cccs1 62a_100010992444_200025704644 [0,2,0,0,0,0|2,0,0]=4 2580 B10R1.21 [13CH3]SCCCc1cccs1 62a_200025704644_100010992444 [0,2,0,0,0,0|2,0,0]=4 2581 B10R1.27 C#CC(C)Nc1ncns1 27a_100000707721_100000693119 [0,2,0,0,0,0|2,0,0]=4 2582 B10R1.27 C#CC(C)Nc1nncs1 27a_100000707721_100000739804 [0,2,0,0,0,0|2,0,0]=4 2583 B10R1.27 C#CC(C)Sc1cccs1 62a_200000035995_100011215356 [0,2,0,0,0,0|1,1,0]=4 2584 B10R1.27 C#CC(C)Sc1ncc[nH]1 62a_200000035995_100025796157 [0,2,0,0,0,0|1,1,0]=4 2585 B10R1.27 C#CC(C)Sc1ncco1 62a_200000035995_100011787736 [0,2,0,0,0,0|0,2,0]=4 2586 B10R1.27 C#CC(C)Sc1nccs1 62a_200000035995_100000211983 [0,2,0,0,0,0|0,1,0]=3 2587 B10R1.27 C#CC(C)Sc1ncns1 62a_200000035995_100000693119 [0,2,0,0,0,0|1,1,0]=4 2588 B10R1.27 C#CC(C)Sc1nncs1 62a_200000035995_100000739804 [0,2,0,0,0,0|1,1,0]=4 2589 B10R1.27 C=CC(C)Sc1cccs1 62a_100011215867_100011215356 [0,2,0,0,0,0|1,1,0]=4 2590 B10R1.27 C=CC(C)Sc1ncc[nH]1 62a_100011215867_100025796157 [0,2,0,0,0,0|1,1,0]=4 2591 B10R1.27 C=CC(C)Sc1ncco1 62a_100011215867_100011787736 [0,2,0,0,0,0|0,2,0]=4 2592 B10R1.27 C=CC(C)Sc1nccs1 62a_100011215867_100000211983 [0,2,0,0,0,0|0,1,0]=3 2593 B10R1.27 C=CC(C)Sc1ncns1 62a_100011215867_100000693119 [0,2,0,0,0,0|1,1,0]=4 2594 B10R1.27 C=CC(C)Sc1nncs1 62a_100011215867_100000739804 [0,2,0,0,0,0|1,1,0]=4 2595 B10R1.27 CC(=Cc1nccs1)C#N 6a_100000750902_200000212204 [0,2,0,0,0,0|1,0,1]=4 2596 B10R1.27 CC(C#N)Sc1cccs1 62a_100000703298_100011215356 [0,2,0,0,0,0|1,1,0]=4 2597 B10R1.27 CC(C#N)Sc1cccs1 62a_100011215356_100000703298 [0,2,0,0,0,0|1,1,0]=4 2598 B10R1.27 CC(C#N)Sc1ncc[nH]1 62a_100000703298_100025796157 [0,2,0,0,0,0|1,1,0]=4 2599 B10R1.27 CC(C#N)Sc1ncc[nH]1 62a_100025796157_100000703298 [0,2,0,0,0,0|1,1,0]=4 2600 B10R1.27 CC(C#N)Sc1ncco1 62a_100000703298_100011787736 [0,2,0,0,0,0|0,2,0]=4 2601 B10R1.27 CC(C#N)Sc1ncco1 62a_100011787736_100000703298 [0,2,0,0,0,0|0,2,0]=4 2602 B10R1.27 CC(C#N)Sc1nccs1 62a_100000211983_100000703298 [0,2,0,0,0,0|0,1,0]=3 2603 B10R1.27 CC(C#N)Sc1nccs1 62a_100000703298_100000211983 [0,2,0,0,0,0|0,1,0]=3 2604 B10R1.27 CC(C#N)Sc1ncns1 62a_100000693119_100000703298 [0,2,0,0,0,0|1,1,0]=4 2605 B10R1.27 CC(C#N)Sc1ncns1 62a_100000703298_100000693119 [0,2,0,0,0,0|1,1,0]=4 2606 B10R1.27 CC(C#N)Sc1nncs1 62a_100000703298_100000739804 [0,2,0,0,0,0|1,1,0]=4 2607 B10R1.27 CC(C#N)Sc1nncs1 62a_100000739804_100000703298 [0,2,0,0,0,0|1,1,0]=4 2608 B10R1.27 CC(CO)Sc1cccs1 62a_100012180447_100011215356 [0,2,0,0,0,0|1,1,0]=4 2609 B10R1.27 CC(CO)Sc1ncc[nH]1 62a_100012180447_100025796157 [0,2,0,0,0,0|1,1,0]=4 2610 B10R1.27 CC(CO)Sc1ncco1 62a_100012180447_100011787736 [0,2,0,0,0,0|0,2,0]=4 2611 B10R1.27 CC(CO)Sc1nccs1 62a_100012180447_100000211983 [0,2,0,0,0,0|0,1,0]=3 2612 B10R1.27 CC(CO)Sc1ncns1 62a_100012180447_100000693119 [0,2,0,0,0,0|1,1,0]=4 2613 B10R1.27 CC(CO)Sc1nncs1 62a_100012180447_100000739804 [0,2,0,0,0,0|1,1,0]=4 2614 B10R1.27 CC(Cc1cccs1)N[13CH3] 2230a_100000751415_200025704644 [0,2,0,0,0,0|2,0,0]=4 2615 B10R1.27 CCC(=O)Cc1cccs1 1458a_100000210189_100000210202 [0,2,0,0,0,0|2,0,0]=4 2616 B10R1.27 CCC(=O)Cc1ncco1 1458a_100000210414_103436540062 [0,2,0,0,0,0|1,1,0]=4 2617 B10R1.27 CCC(=O)Cc1nccs1 1458a_100000210414_100015184050 [0,2,0,0,0,0|1,0,0]=3 2618 B10R1.27 CCC(C)Sc1cccs1 62a_100000758301_100011215356 [0,2,0,0,0,0|1,1,0]=4 2619 B10R1.27 CCC(C)Sc1cccs1 62a_100011215356_100000758301 [0,2,0,0,0,0|1,1,0]=4 2620 B10R1.27 CCC(C)Sc1ncc[nH]1 62a_100000758301_100025796157 [0,2,0,0,0,0|1,1,0]=4 2621 B10R1.27 CCC(C)Sc1ncc[nH]1 62a_100025796157_100000758301 [0,2,0,0,0,0|1,1,0]=4 2622 B10R1.27 CCC(C)Sc1ncco1 62a_100000758301_100011787736 [0,2,0,0,0,0|0,2,0]=4 2623 B10R1.27 CCC(C)Sc1ncco1 62a_100011787736_100000758301 [0,2,0,0,0,0|0,2,0]=4 2624 B10R1.27 CCC(C)Sc1nccs1 62a_100000211983_100000758301 [0,2,0,0,0,0|0,1,0]=3 2625 B10R1.27 CCC(C)Sc1nccs1 62a_100000758301_100000211983 [0,2,0,0,0,0|0,1,0]=3 2626 B10R1.27 CCC(C)Sc1ncns1 62a_100000693119_100000758301 [0,2,0,0,0,0|1,1,0]=4 2627 B10R1.27 CCC(C)Sc1ncns1 62a_100000758301_100000693119 [0,2,0,0,0,0|1,1,0]=4 2628 B10R1.27 CCC(C)Sc1nncs1 62a_100000739804_100000758301 [0,2,0,0,0,0|1,1,0]=4 2629 B10R1.27 CCC(C)Sc1nncs1 62a_100000758301_100000739804 [0,2,0,0,0,0|1,1,0]=4 2630 B10R1.27 CCN(C)Cc1cccs1 2230a_100000184426_100000210202 [0,2,0,0,0,0|2,0,0]=4 2631 B10R1.27 CCN(C)Cc1cccs1 2230a_100025770963_200000210301 [0,2,0,0,0,0|2,0,0]=4 2632 B10R1.27 CCN(C)Cc1cccs1 269982a_100000184426_100000204670 [0,2,0,0,0,0|2,0,0]=4 2633 B10R1.27 CCN(C)Cc1cccs1 269982a_100025770963_200000210301 [0,2,0,0,0,0|2,0,0]=4 2634 B10R1.27 CCN(C)Cc1ncc[nH]1 2230a_100000225621_100016991755 [0,2,0,0,0,0|2,0,0]=4 2635 B10R1.27 CCN(C)Cc1ncc[nH]1 2230a_100015184136_100000210202 [0,2,0,0,0,0|2,0,0]=4 2636 B10R1.27 CCN(C)Cc1ncc[nH]1 269982a_100000225621_100016991755 [0,2,0,0,0,0|2,0,0]=4 2637 B10R1.27 CCN(C)Cc1ncc[nH]1 269982a_100015184136_100000204670 [0,2,0,0,0,0|2,0,0]=4 2638 B10R1.27 CCN(C)Cc1ncco1 2230a_100000225621_103436540062 [0,2,0,0,0,0|1,1,0]=4 2639 B10R1.27 CCN(C)Cc1ncco1 269982a_100000225621_103436540062 [0,2,0,0,0,0|1,1,0]=4 2640 B10R1.27 CCN(C)Cc1nccs1 2230a_100000225621_100015184050 [0,2,0,0,0,0|1,0,0]=3 2641 B10R1.27 CCN(C)Cc1nccs1 2230a_100000765864_100000210202 [0,2,0,0,0,0|1,0,0]=3 2642 B10R1.27 CCN(C)Cc1nccs1 269982a_100000225621_100015184050 [0,2,0,0,0,0|1,0,0]=3 2643 B10R1.27 CCN(C)Cc1nccs1 269982a_100000765864_100000204670 [0,2,0,0,0,0|1,0,0]=3 2644 B10R1.27 CCN([13CH3])Cc1cccs1 2230a_100025770963_200025704644 [0,2,0,0,0,0|2,0,0]=4 2645 B10R1.27 CCN([13CH3])Cc1cccs1 269982a_100025770963_200025704644 [0,2,0,0,0,0|2,0,0]=4 2646 B10R1.27 CN(CF)Cc1nccs1 269982a_100000765864_100015361967 [0,2,0,0,0,0|2,0,0]=4 2647 B10R1.27 CNC(C)Cc1cccs1 2230a_100000751415_200000210301 [0,2,0,0,0,0|2,0,0]=4 2648 B10R1.27 COC(C)Sc1cccs1 62a_100009879195_100011215356 [0,2,0,0,0,0|1,1,0]=4 2649 B10R1.27 COC(C)Sc1cccs1 62a_100011215356_100009879195 [0,2,0,0,0,0|1,1,0]=4 2650 B10R1.27 COC(C)Sc1ncc[nH]1 62a_100009879195_100025796157 [0,2,0,0,0,0|1,1,0]=4 2651 B10R1.27 COC(C)Sc1ncc[nH]1 62a_100025796157_100009879195 [0,2,0,0,0,0|1,1,0]=4 2652 B10R1.27 COC(C)Sc1ncco1 62a_100009879195_100011787736 [0,2,0,0,0,0|0,2,0]=4 2653 B10R1.27 COC(C)Sc1ncco1 62a_100011787736_100009879195 [0,2,0,0,0,0|0,2,0]=4 2654 B10R1.27 COC(C)Sc1nccs1 62a_100000211983_100009879195 [0,2,0,0,0,0|0,1,0]=3 2655 B10R1.27 COC(C)Sc1nccs1 62a_100009879195_100000211983 [0,2,0,0,0,0|0,1,0]=3 2656 B10R1.27 COC(C)Sc1ncns1 62a_100000693119_100009879195 [0,2,0,0,0,0|1,1,0]=4 2657 B10R1.27 COC(C)Sc1ncns1 62a_100009879195_100000693119 [0,2,0,0,0,0|1,1,0]=4 2658 B10R1.27 COC(C)Sc1nncs1 62a_100000739804_100009879195 [0,2,0,0,0,0|1,1,0]=4 2659 B10R1.27 COC(C)Sc1nncs1 62a_100009879195_100000739804 [0,2,0,0,0,0|1,1,0]=4 2660 B10R1.27 C[C@H](CF)Nc1ncns1 27a_100102880703_100000693119 [0,2,0,0,0,0|2,0,0]=4 2661 B10R1.27 C[C@H](CF)Nc1nncs1 27a_100102880703_100000739804 [0,2,0,0,0,0|2,0,0]=4 2662 B10R1.27 C[C@H](CO)Nc1ncns1 27a_100000737577_100000693119 [0,2,0,0,0,0|2,0,0]=4 2663 B10R1.27 C[C@H](CO)Nc1nncs1 27a_100000737577_100000739804 [0,2,0,0,0,0|2,0,0]=4 2664 B10R1.27 C[C@H](CO)Sc1cccs1 62a_100011215356_100016084084 [0,2,0,0,0,0|1,1,0]=4 2665 B10R1.27 C[C@H](CO)Sc1cccs1 62a_100016084084_100011215356 [0,2,0,0,0,0|1,1,0]=4 2666 B10R1.27 C[C@H](CO)Sc1ncc[nH]1 62a_100016084084_100025796157 [0,2,0,0,0,0|1,1,0]=4 2667 B10R1.27 C[C@H](CO)Sc1ncc[nH]1 62a_100025796157_100016084084 [0,2,0,0,0,0|1,1,0]=4 2668 B10R1.27 C[C@H](CO)Sc1ncco1 62a_100011787736_100016084084 [0,2,0,0,0,0|0,2,0]=4 2669 B10R1.27 C[C@H](CO)Sc1ncco1 62a_100016084084_100011787736 [0,2,0,0,0,0|0,2,0]=4 2670 B10R1.27 C[C@H](CO)Sc1nccs1 62a_100000211983_100016084084 [0,2,0,0,0,0|0,1,0]=3 2671 B10R1.27 C[C@H](CO)Sc1nccs1 62a_100016084084_100000211983 [0,2,0,0,0,0|0,1,0]=3 2672 B10R1.27 C[C@H](CO)Sc1ncns1 62a_100000693119_100016084084 [0,2,0,0,0,0|1,1,0]=4 2673 B10R1.27 C[C@H](CO)Sc1ncns1 62a_100016084084_100000693119 [0,2,0,0,0,0|1,1,0]=4 2674 B10R1.27 C[C@H](CO)Sc1nncs1 62a_100000739804_100016084084 [0,2,0,0,0,0|1,1,0]=4 2675 B10R1.27 C[C@H](CO)Sc1nncs1 62a_100016084084_100000739804 [0,2,0,0,0,0|1,1,0]=4 2676 B10R1.27 N#CC(F)Sc1nccs1 62a_100000211983_200000117898 [0,2,0,0,0,0|0,1,1]=4 2677 B10R1.27 N#CC(F)Sc1nccs1 62a_200000117898_100000211983 [0,2,0,0,0,0|0,1,1]=4 2678 B10R1.27 O=C(CO)Cc1nccs1 1458a_100000210174_100015184050 [0,2,0,0,0,0|1,0,1]=4 2679 B10R1.29 CCCCc1nccn1C 271570a_100020621405_100000707724 [0,2,0,0,0,0|2,0,0]=4 2680 B10R1.29 CCCCc1sccc1Br 271570a_100020621405_100012361411 [0,2,0,0,0,0|2,0,0]=4 2681 B10R1.29 CCCCc1sccc1C 271570a_100020621405_100000742657 [0,2,0,0,0,0|2,0,0]=4 2682 B10R1.29 CCCSc1nccn1C 62a_100000210303_100000707724 [0,2,0,0,0,0|1,1,0]=4 2683 B10R1.29 CCCSc1nccn1C 62a_100000707724_100000210303 [0,2,0,0,0,0|1,1,0]=4 2684 B10R1.29 CCCSc1sccc1Br 62a_100000210303_100012361411 [0,2,0,0,0,0|1,1,0]=4 2685 B10R1.29 CCCSc1sccc1Br 62a_100012361411_100000210303 [0,2,0,0,0,0|1,1,0]=4 2686 B10R1.29 CCCSc1sccc1C 62a_100000210303_100010247149 [0,2,0,0,0,0|1,1,0]=4 2687 B10R1.29 CCCSc1sccc1C 62a_100010247149_100000210303 [0,2,0,0,0,0|1,1,0]=4 2688 B10R1.29 CCNCc1nccn1C 207a_100015525214_100000748660 [0,2,0,0,0,0|2,0,0]=4 2689 B10R1.29 CCNCc1nccn1C 2230a_100015186572_100000210202 [0,2,0,0,0,0|2,0,0]=4 2690 B10R1.29 CCNCc1nccn1C 2230a_100015525214_100000700302 [0,2,0,0,0,0|2,0,0]=4 2691 B10R1.29 CCNCc1nccn1C 270004a_100015525214_100000748660 [0,2,0,0,0,0|2,0,0]=4 2692 B10R1.29 CCNCc1sccc1Br 207a_100015525214_100000766043 [0,2,0,0,0,0|2,0,0]=4 2693 B10R1.29 CCNCc1sccc1Br 270004a_100015525214_100000766043 [0,2,0,0,0,0|2,0,0]=4 2694 B10R1.29 CCNCc1sccc1C 207a_100015525214_100000210881 [0,2,0,0,0,0|2,0,0]=4 2695 B10R1.29 CCNCc1sccc1C 2230a_100000238519_100000210202 [0,2,0,0,0,0|2,0,0]=4 2696 B10R1.29 CCNCc1sccc1C 270004a_100015525214_100000210881 [0,2,0,0,0,0|2,0,0]=4 2697 B10R1.29 CCNCc1sccc1C 34a_100000238519_100000210202 [0,2,0,0,0,0|2,0,0]=4 2698 B10R1.29 CCNCc1sccc1Cl 207a_100015525214_100000722334 [0,2,0,0,0,0|2,0,0]=4 2699 B10R1.29 CCNCc1sccc1Cl 2230a_100011934584_100000210202 [0,2,0,0,0,0|2,0,0]=4 2700 B10R1.29 CCNCc1sccc1Cl 270004a_100015525214_100000722334 [0,2,0,0,0,0|2,0,0]=4 2701 B10R1.29 CCNCc1sccc1Cl 34a_100011934584_100000210202 [0,2,0,0,0,0|2,0,0]=4 2702 B10R1.29 CCOCc1nccn1C 34a_100121572206_100000700302 [0,2,0,0,0,0|1,0,0]=3 2703 B10R1.29 CCOCc1nccn1C 7a_100000691215_100000210202 [0,2,0,0,0,0|1,0,0]=3 2704 B10R1.29 CCOCc1ncnn1C 7a_100000688323_100000210202 [0,2,0,0,0,0|2,0,0]=4 2705 B10R1.29 CCOCc1ncoc1C 34a_100012017639_100000210202 [0,2,0,0,0,0|2,0,0]=4 2706 B10R1.29 CCOCc1ncoc1C 34a_100121572206_200000693990 [0,2,0,0,0,0|2,0,0]=4 2707 B10R1.29 CCOCc1occc1C 34a_100011273948_100000210202 [0,2,0,0,0,0|1,1,0]=4 2708 B10R1.29 CCOCc1occc1C 7a_100011273948_100000210202 [0,2,0,0,0,0|1,1,0]=4 2709 B10R1.29 CCOCc1sccc1Br 34a_100000702026_100000210202 [0,2,0,0,0,0|1,0,0]=3 2710 B10R1.29 CCOCc1sccc1C 34a_100000238368_100000210202 [0,2,0,0,0,0|1,0,0]=3 2711 B10R1.29 CCOCc1sccc1C 7a_100000238368_100000210202 [0,2,0,0,0,0|1,0,0]=3 2712 B10R1.29 CCOCc1sccc1Cl 34a_100000722387_100000210202 [0,2,0,0,0,0|1,0,0]=3 2713 B10R1.29 CCOCc1sccc1Cl 7a_100000722387_100000210202 [0,2,0,0,0,0|1,0,0]=3 2714 B10R1.29 CCOCc1scnc1Br 7a_100012000948_100000210202 [0,2,0,0,0,0|2,0,0]=4 2715 B10R1.29 CCOCc1scnc1C 34a_100000750112_100000210202 [0,2,0,0,0,0|2,0,0]=4 2716 B10R1.29 CCOCc1scnc1C 7a_100000750112_100000210202 [0,2,0,0,0,0|2,0,0]=4 2717 B10R1.29 CCSCc1nccn1C 62a_100000210202_100000700302 [0,2,0,0,0,0|1,1,0]=4 2718 B10R1.29 CCSCc1nccn1C 62a_100000700302_100000210202 [0,2,0,0,0,0|1,1,0]=4 2719 B10R1.29 COCSc1nccn1C 62a_100000707724_100000766300 [0,2,0,0,0,0|1,1,0]=4 2720 B10R1.29 COCSc1nccn1C 62a_100000766300_100000707724 [0,2,0,0,0,0|1,1,0]=4 2721 B10R1.29 COCSc1sccc1Br 62a_100000766300_100012361411 [0,2,0,0,0,0|1,1,0]=4 2722 B10R1.29 COCSc1sccc1Br 62a_100012361411_100000766300 [0,2,0,0,0,0|1,1,0]=4 2723 B10R1.29 COCSc1sccc1C 62a_100000766300_100010247149 [0,2,0,0,0,0|1,1,0]=4 2724 B10R1.29 COCSc1sccc1C 62a_100010247149_100000766300 [0,2,0,0,0,0|1,1,0]=4 2725 B10R1.29 CSCSc1nccn1C 62a_100000707724_100011218213 [0,2,0,0,0,0|1,1,0]=4 2726 B10R1.29 CSCSc1nccn1C 62a_100011218213_100000707724 [0,2,0,0,0,0|1,1,0]=4 2727 B10R1.29 CSCSc1sccc1Br 62a_100011218213_100012361411 [0,2,0,0,0,0|1,1,0]=4 2728 B10R1.29 CSCSc1sccc1Br 62a_100012361411_100011218213 [0,2,0,0,0,0|1,1,0]=4 2729 B10R1.29 CSCSc1sccc1C 62a_100010247149_100011218213 [0,2,0,0,0,0|1,1,0]=4 2730 B10R1.29 CSCSc1sccc1C 62a_100011218213_100010247149 [0,2,0,0,0,0|1,1,0]=4 2731 B10R1.29 Cc1ccsc1COCF 34a_100000238368_100015361967 [0,2,0,0,0,0|2,0,0]=4 2732 B10R1.29 Cc1ccsc1COCF 7a_100000238368_100015361967 [0,2,0,0,0,0|2,0,0]=4 2733 B10R1.29 Cc1ccsc1SCCF 62a_100010247149_100011217306 [0,2,0,0,0,0|1,1,0]=4 2734 B10R1.29 Cc1ccsc1SCCF 62a_100011217306_100010247149 [0,2,0,0,0,0|1,1,0]=4 2735 B10R1.29 Cc1ccsc1SCCO 62a_100000211926_100010247149 [0,2,0,0,0,0|1,1,0]=4 2736 B10R1.29 Cc1ccsc1SCCO 62a_100010247149_100000211926 [0,2,0,0,0,0|1,1,0]=4 2737 B10R1.29 Cn1ccnc1COCF 7a_100000691215_100015361967 [0,2,0,0,0,0|2,0,0]=4 2738 B10R1.29 Cn1ccnc1SCCF 62a_100000707724_100011217306 [0,2,0,0,0,0|1,1,0]=4 2739 B10R1.29 Cn1ccnc1SCCF 62a_100011217306_100000707724 [0,2,0,0,0,0|1,1,0]=4 2740 B10R1.29 Cn1ccnc1SCCO 62a_100000211926_100000707724 [0,2,0,0,0,0|1,1,0]=4 2741 B10R1.29 Cn1ccnc1SCCO 62a_100000707724_100000211926 [0,2,0,0,0,0|1,1,0]=4 2742 B10R1.29 FCCSc1sccc1Br 62a_100011217306_100012361411 [0,2,0,0,0,0|1,1,0]=4 2743 B10R1.29 FCCSc1sccc1Br 62a_100012361411_100011217306 [0,2,0,0,0,0|1,1,0]=4 2744 B10R1.29 FCOCc1sccc1Br 34a_100000702026_100015361967 [0,2,0,0,0,0|2,0,0]=4 2745 B10R1.29 FCOCc1sccc1Cl 34a_100000722387_100015361967 [0,2,0,0,0,0|2,0,0]=4 2746 B10R1.29 FCOCc1sccc1Cl 7a_100000722387_100015361967 [0,2,0,0,0,0|2,0,0]=4 2747 B10R1.29 OCCSc1sccc1Br 62a_100000211926_100012361411 [0,2,0,0,0,0|1,1,0]=4 2748 B10R1.29 OCCSc1sccc1Br 62a_100012361411_100000211926 [0,2,0,0,0,0|1,1,0]=4 2749 B10R1.66 C=C(C)CNc1ncns1 27a_100000765925_100000693119 [0,2,0,0,0,0|2,0,0]=4 2750 B10R1.66 C=C(C)CNc1nncs1 27a_100000765925_100000739804 [0,2,0,0,0,0|2,0,0]=4 2751 B10R1.66 C=C(C)CSc1cccs1 62a_100000748629_100011215356 [0,2,0,0,0,0|1,1,0]=4 2752 B10R1.66 C=C(C)CSc1cccs1 62a_100011215356_100000211660 [0,2,0,0,0,0|1,1,0]=4 2753 B10R1.66 C=C(C)CSc1ncc[nH]1 62a_100000748629_100025796157 [0,2,0,0,0,0|1,1,0]=4 2754 B10R1.66 C=C(C)CSc1ncc[nH]1 62a_100025796157_100000211660 [0,2,0,0,0,0|1,1,0]=4 2755 B10R1.66 C=C(C)CSc1ncco1 62a_100000748629_100011787736 [0,2,0,0,0,0|0,2,0]=4 2756 B10R1.66 C=C(C)CSc1ncco1 62a_100011787736_100000211660 [0,2,0,0,0,0|0,2,0]=4 2757 B10R1.66 C=C(C)CSc1nccs1 62a_100000211983_100000211660 [0,2,0,0,0,0|0,1,0]=3 2758 B10R1.66 C=C(C)CSc1nccs1 62a_100000748629_100000211983 [0,2,0,0,0,0|0,1,0]=3 2759 B10R1.66 C=C(C)CSc1ncns1 62a_100000693119_100000211660 [0,2,0,0,0,0|1,1,0]=4 2760 B10R1.66 C=C(C)CSc1ncns1 62a_100000748629_100000693119 [0,2,0,0,0,0|1,1,0]=4 2761 B10R1.66 C=C(C)CSc1nncs1 62a_100000739804_100000211660 [0,2,0,0,0,0|1,1,0]=4 2762 B10R1.66 C=C(C)CSc1nncs1 62a_100000748629_100000739804 [0,2,0,0,0,0|1,1,0]=4 2763 B10R1.66 C=C(F)CSc1nccs1 62a_100000042424_100000211983 [0,2,0,0,0,0|0,1,1]=4 2764 B10R1.66 C=C(F)CSc1nccs1 62a_100000211983_100000042424 [0,2,0,0,0,0|0,1,1]=4 2765 B10R1.66 CC(=O)C=Cc1nccs1 1458a_100102558208_200000210301 [0,2,0,0,0,0|1,0,1]=4 2766 B10R1.66 CC(=O)CCc1cccs1 1458a_100000070787_100000748579 [0,2,0,0,0,0|2,0,0]=4 2767 B10R1.66 CC(=O)CCc1cccs1 1458a_100000185280_200000210301 [0,2,0,0,0,0|2,0,0]=4 2768 B10R1.66 CC(=O)CCc1ncc[nH]1 1458a_100000722789_200000210301 [0,2,0,0,0,0|2,0,0]=4 2769 B10R1.66 CC(=O)CCc1nccs1 1458a_100000742873_200000210301 [0,2,0,0,0,0|1,0,0]=3 2770 B10R1.66 CC(=O)NCc1nccs1 11a_100000740555_100015343762 [0,2,0,0,0,0|1,0,1]=4 2771 B10R1.66 CC(=O)NCc1nccs1 1626a_100000740555_100015343762 [0,2,0,0,0,0|1,0,1]=4 2772 B10R1.66 CC(=O)NCc1nccs1 240690a_100000740555_100015343762 [0,2,0,0,0,0|1,0,1]=4 2773 B10R1.66 CC(=O)NCc1nccs1 527a_100000740555_100103153847 [0,2,0,0,0,0|1,0,1]=4 2774 B10R1.66 CC(=O)NNc1nccs1 22a_100011198208_100000070787 [0,2,0,0,0,0|1,0,1]=4 2775 B10R1.66 CC(C)C=Cc1cccs1 271570a_100016257149_100011215356 [0,2,0,0,0,0|2,0,0]=4 2776 B10R1.66 CC(C)C=Cc1ncc[nH]1 271570a_100016257149_100025796157 [0,2,0,0,0,0|2,0,0]=4 2777 B10R1.66 CC(C)C=Cc1ncco1 271570a_100016257149_100011787736 [0,2,0,0,0,0|1,1,0]=4 2778 B10R1.66 CC(C)C=Cc1nccs1 271570a_100016257149_100000211983 [0,2,0,0,0,0|1,0,0]=3 2779 B10R1.66 CC(C)C=Cc1ncns1 271570a_100016257149_100000693119 [0,2,0,0,0,0|2,0,0]=4 2780 B10R1.66 CC(C)C=Cc1nncs1 271570a_100016257149_100000739804 [0,2,0,0,0,0|2,0,0]=4 2781 B10R1.66 CC(C)CNc1ncns1 27a_100000210953_100000693119 [0,2,0,0,0,0|2,0,0]=4 2782 B10R1.66 CC(C)CNc1nncs1 27a_100000210953_100000739804 [0,2,0,0,0,0|2,0,0]=4 2783 B10R1.66 CC(C)CSc1cccs1 62a_100000210624_100011215356 [0,2,0,0,0,0|1,1,0]=4 2784 B10R1.66 CC(C)CSc1cccs1 62a_100011215356_100000210760 [0,2,0,0,0,0|1,1,0]=4 2785 B10R1.66 CC(C)CSc1ncc[nH]1 62a_100000210624_100025796157 [0,2,0,0,0,0|1,1,0]=4 2786 B10R1.66 CC(C)CSc1ncc[nH]1 62a_100025796157_100000210760 [0,2,0,0,0,0|1,1,0]=4 2787 B10R1.66 CC(C)CSc1ncco1 62a_100000210624_100011787736 [0,2,0,0,0,0|0,2,0]=4 2788 B10R1.66 CC(C)CSc1ncco1 62a_100011787736_100000210760 [0,2,0,0,0,0|0,2,0]=4 2789 B10R1.66 CC(C)CSc1nccs1 62a_100000210624_100000211983 [0,2,0,0,0,0|0,1,0]=3 2790 B10R1.66 CC(C)CSc1nccs1 62a_100000211983_100000210760 [0,2,0,0,0,0|0,1,0]=3 2791 B10R1.66 CC(C)CSc1ncns1 62a_100000210624_100000693119 [0,2,0,0,0,0|1,1,0]=4 2792 B10R1.66 CC(C)CSc1ncns1 62a_100000693119_100000210760 [0,2,0,0,0,0|1,1,0]=4 2793 B10R1.66 CC(C)CSc1nncs1 62a_100000210624_100000739804 [0,2,0,0,0,0|1,1,0]=4 2794 B10R1.66 CC(C)CSc1nncs1 62a_100000739804_100000210760 [0,2,0,0,0,0|1,1,0]=4 2795 B10R1.66 CC(C)NCc1cccs1 207a_100138425928_100000209959 [0,2,0,0,0,0|2,0,0]=4 2796 B10R1.66 CC(C)NCc1cccs1 2230a_100000211653_100000210206 [0,2,0,0,0,0|2,0,0]=4 2797 B10R1.66 CC(C)NCc1ncc[nH]1 207a_100138425928_100000743867 [0,2,0,0,0,0|2,0,0]=4 2798 B10R1.66 CC(C)NCc1ncc[nH]1 2230a_100138425928_100016991755 [0,2,0,0,0,0|2,0,0]=4 2799 B10R1.66 CC(C)NCc1ncc[nH]1 34a_100138425928_100016991755 [0,2,0,0,0,0|2,0,0]=4 2800 B10R1.66 CC(C)NCc1ncco1 2230a_100016994969_100000210206 [0,2,0,0,0,0|1,1,0]=4 2801 B10R1.66 CC(C)NCc1ncco1 2230a_100138425928_103436540062 [0,2,0,0,0,0|1,1,0]=4 2802 B10R1.66 CC(C)NCc1ncco1 34a_100138425928_103436540062 [0,2,0,0,0,0|1,1,0]=4 2803 B10R1.66 CC(C)NCc1nccs1 207a_100138425928_100000750902 [0,2,0,0,0,0|1,0,0]=3 2804 B10R1.66 CC(C)NCc1nccs1 2230a_100000740555_100000210206 [0,2,0,0,0,0|1,0,0]=3 2805 B10R1.66 CC(C)NCc1nccs1 2230a_100138425928_100015184050 [0,2,0,0,0,0|1,0,0]=3 2806 B10R1.66 CC(C)NCc1nccs1 34a_100138425928_100015184050 [0,2,0,0,0,0|1,0,0]=3 2807 B10R1.66 CC(C)OCc1c[nH]cn1 34a_100000212225_100000707719 [0,2,0,0,0,0|2,0,0]=4 2808 B10R1.66 CC(C)OCc1ccco1 34a_100000210059_100000210206 [0,2,0,0,0,0|1,1,0]=4 2809 B10R1.66 CC(C)OCc1cccs1 34a_100000211240_100000210206 [0,2,0,0,0,0|1,0,0]=3 2810 B10R1.66 CC(C)OCc1ccon1 34a_100000212225_100000234950 [0,2,0,0,0,0|2,0,0]=4 2811 B10R1.66 CC(C)OCc1cncs1 34a_100000212225_100015185245 [0,2,0,0,0,0|2,0,0]=4 2812 B10R1.66 CC(C)OCc1cscn1 34a_100000212225_100000205941 [0,2,0,0,0,0|2,0,0]=4 2813 B10R1.66 CC(C)OCc1ncc[nH]1 34a_100000212225_100016991755 [0,2,0,0,0,0|1,0,0]=3 2814 B10R1.66 CC(C)OCc1ncco1 34a_100000062594_100000210206 [0,2,0,0,0,0|0,1,0]=3 2815 B10R1.66 CC(C)OCc1ncco1 34a_100000212225_103436540062 [0,2,0,0,0,0|0,1,0]=3 2816 B10R1.66 CC(C)OCc1nccs1 34a_100000212225_100015184050 [0,2,0,0,0,0|0,0,0]=2 2817 B10R1.66 CC(C)OCc1ncon1 34a_100000212225_100000233494 [0,2,0,0,0,0|2,0,0]=4 2818 B10R1.66 CC(C)OCn1cccn1 34a_100000731028_100000210206 [0,2,0,0,0,0|2,0,0]=4 2819 B10R1.66 CC(C)SCc1ncc[nH]1 62a_100000210206_100016991755 [0,2,0,0,0,0|1,1,0]=4 2820 B10R1.66 CC(C)SCc1ncc[nH]1 62a_100016991755_100000210206 [0,2,0,0,0,0|1,1,0]=4 2821 B10R1.66 CC(C)SCc1ncco1 62a_100000210206_103436540062 [0,2,0,0,0,0|0,2,0]=4 2822 B10R1.66 CC(C)SCc1ncco1 62a_103436540062_100000210206 [0,2,0,0,0,0|0,2,0]=4 2823 B10R1.66 CC(C)SCc1nccs1 62a_100000210206_100015184050 [0,2,0,0,0,0|0,1,0]=3 2824 B10R1.66 CC(C)SCc1nccs1 62a_100015184050_100000210206 [0,2,0,0,0,0|0,1,0]=3 2825 B10R1.66 CC(O)C=Cc1cccs1 271570a_200011019289_100011215356 [0,2,0,0,0,0|2,0,0]=4 2826 B10R1.66 CC(O)C=Cc1ncc[nH]1 271570a_200011019289_100025796157 [0,2,0,0,0,0|2,0,0]=4 2827 B10R1.66 CC(O)C=Cc1ncco1 271570a_200011019289_100011787736 [0,2,0,0,0,0|1,1,0]=4 2828 B10R1.66 CC(O)C=Cc1nccs1 271570a_200011019289_100000211983 [0,2,0,0,0,0|1,0,0]=3 2829 B10R1.66 CC(O)C=Cc1ncns1 271570a_200011019289_100000693119 [0,2,0,0,0,0|2,0,0]=4 2830 B10R1.66 CC(O)C=Cc1nncs1 271570a_200011019289_100000739804 [0,2,0,0,0,0|2,0,0]=4 2831 B10R1.66 CC(O)CNc1ncns1 27a_100000210904_100000693119 [0,2,0,0,0,0|2,0,0]=4 2832 B10R1.66 CC(O)CNc1nncs1 27a_100000210904_100000739804 [0,2,0,0,0,0|2,0,0]=4 2833 B10R1.66 CC(O)CSc1cccs1 62a_100011215356_100011218427 [0,2,0,0,0,0|1,1,0]=4 2834 B10R1.66 CC(O)CSc1cccs1 62a_100011218427_100011215356 [0,2,0,0,0,0|1,1,0]=4 2835 B10R1.66 CC(O)CSc1ncc[nH]1 62a_100011218427_100025796157 [0,2,0,0,0,0|1,1,0]=4 2836 B10R1.66 CC(O)CSc1ncc[nH]1 62a_100025796157_100011218427 [0,2,0,0,0,0|1,1,0]=4 2837 B10R1.66 CC(O)CSc1ncco1 62a_100011218427_100011787736 [0,2,0,0,0,0|0,2,0]=4 2838 B10R1.66 CC(O)CSc1ncco1 62a_100011787736_100011218427 [0,2,0,0,0,0|0,2,0]=4 2839 B10R1.66 CC(O)CSc1nccs1 62a_100000211983_100011218427 [0,2,0,0,0,0|0,1,0]=3 2840 B10R1.66 CC(O)CSc1nccs1 62a_100011218427_100000211983 [0,2,0,0,0,0|0,1,0]=3 2841 B10R1.66 CC(O)CSc1ncns1 62a_100000693119_100011218427 [0,2,0,0,0,0|1,1,0]=4 2842 B10R1.66 CC(O)CSc1ncns1 62a_100011218427_100000693119 [0,2,0,0,0,0|1,1,0]=4 2843 B10R1.66 CC(O)CSc1nncs1 62a_100000739804_100011218427 [0,2,0,0,0,0|1,1,0]=4 2844 B10R1.66 CC(O)CSc1nncs1 62a_100011218427_100000739804 [0,2,0,0,0,0|1,1,0]=4 2845 B10R1.66 CN(C)CCc1cccs1 2230a_100102631434_100000748579 [0,2,0,0,0,0|2,0,0]=4 2846 B10R1.66 CN(C)CCc1cccs1 269982a_100102631434_100000748579 [0,2,0,0,0,0|2,0,0]=4 2847 B10R1.66 C[C@@H](O)CSc1cccs1 62a_100009817552_100011215356 [0,2,0,0,0,0|1,1,0]=4 2848 B10R1.66 C[C@@H](O)CSc1cccs1 62a_100011215356_100009817552 [0,2,0,0,0,0|1,1,0]=4 2849 B10R1.66 C[C@@H](O)CSc1ncc[nH]1 62a_100009817552_100025796157 [0,2,0,0,0,0|1,1,0]=4 2850 B10R1.66 C[C@@H](O)CSc1ncc[nH]1 62a_100025796157_100009817552 [0,2,0,0,0,0|1,1,0]=4 2851 B10R1.66 C[C@@H](O)CSc1ncco1 62a_100009817552_100011787736 [0,2,0,0,0,0|0,2,0]=4 2852 B10R1.66 C[C@@H](O)CSc1ncco1 62a_100011787736_100009817552 [0,2,0,0,0,0|0,2,0]=4 2853 B10R1.66 C[C@@H](O)CSc1nccs1 62a_100000211983_100009817552 [0,2,0,0,0,0|0,1,0]=3 2854 B10R1.66 C[C@@H](O)CSc1nccs1 62a_100009817552_100000211983 [0,2,0,0,0,0|0,1,0]=3 2855 B10R1.66 C[C@@H](O)CSc1ncns1 62a_100000693119_100009817552 [0,2,0,0,0,0|1,1,0]=4 2856 B10R1.66 C[C@@H](O)CSc1ncns1 62a_100009817552_100000693119 [0,2,0,0,0,0|1,1,0]=4 2857 B10R1.66 C[C@@H](O)CSc1nncs1 62a_100000739804_100009817552 [0,2,0,0,0,0|1,1,0]=4 2858 B10R1.66 C[C@@H](O)CSc1nncs1 62a_100009817552_100000739804 [0,2,0,0,0,0|1,1,0]=4 2859 B10R1.66 FC(F)CNc1ncns1 27a_100000765723_100000693119 [0,2,0,0,0,0|2,0,0]=4 2860 B10R1.66 FC(F)CNc1nncs1 27a_100000765723_100000739804 [0,2,0,0,0,0|2,0,0]=4 2861 B10R1.66 FC(F)CSc1cccs1 62a_100011215356_100011934356 [0,2,0,0,0,0|1,1,0]=4 2862 B10R1.66 FC(F)CSc1cccs1 62a_100011934356_100011215356 [0,2,0,0,0,0|1,1,0]=4 2863 B10R1.66 FC(F)CSc1ncc[nH]1 62a_100011934356_100025796157 [0,2,0,0,0,0|1,1,0]=4 2864 B10R1.66 FC(F)CSc1ncc[nH]1 62a_100025796157_100011934356 [0,2,0,0,0,0|1,1,0]=4 2865 B10R1.66 FC(F)CSc1ncco1 62a_100011787736_100011934356 [0,2,0,0,0,0|0,2,0]=4 2866 B10R1.66 FC(F)CSc1ncco1 62a_100011934356_100011787736 [0,2,0,0,0,0|0,2,0]=4 2867 B10R1.66 FC(F)CSc1nccs1 62a_100000211983_100011934356 [0,2,0,0,0,0|0,1,0]=3 2868 B10R1.66 FC(F)CSc1nccs1 62a_100011934356_100000211983 [0,2,0,0,0,0|0,1,0]=3 2869 B10R1.66 FC(F)CSc1ncns1 62a_100000693119_100011934356 [0,2,0,0,0,0|1,1,0]=4 2870 B10R1.66 FC(F)CSc1ncns1 62a_100011934356_100000693119 [0,2,0,0,0,0|1,1,0]=4 2871 B10R1.66 FC(F)CSc1nncs1 62a_100000739804_100011934356 [0,2,0,0,0,0|1,1,0]=4 2872 B10R1.66 FC(F)CSc1nncs1 62a_100011934356_100000739804 [0,2,0,0,0,0|1,1,0]=4 2873 B10R1.66 NC(=O)CSc1nccs1 62a_100000211983_100000747473 [0,2,0,0,0,0|0,1,1]=4 2874 B10R1.66 NC(=O)CSc1nccs1 62a_100000747473_100000211983 [0,2,0,0,0,0|0,1,1]=4 2875 B10R1.66 O=C([O-])CSc1nccs1 62a_100000211983_100020667443 [0,2,0,0,0,0|0,1,1]=4 2876 B10R1.66 O=C([O-])CSc1nccs1 62a_100020667443_100000211983 [0,2,0,0,0,0|0,1,1]=4 2877 B10R1.66 O=[N+]([O-])CSc1nccs1 62a_100000211983_100000761209 [0,2,0,0,0,0|1,1,0]=4 2878 B10R1.66 [13CH3]C(=O)C=Cc1nccs1 1458a_100102558208_200025704644 [0,2,0,0,0,0|1,0,1]=4 2879 B10R1.66 [13CH3]C(=O)CCc1cccs1 1458a_100000185280_200025704644 [0,2,0,0,0,0|2,0,0]=4 2880 B10R1.66 [13CH3]C(=O)CCc1ncc[nH]1 1458a_100000722789_200025704644 [0,2,0,0,0,0|2,0,0]=4 2881 B10R1.66 [13CH3]C(=O)CCc1nccs1 1458a_100000742873_200025704644 [0,2,0,0,0,0|1,0,0]=3 2882 B10R1.64 CC(C)Sc1nccn1C 62a_100000210206_100000707724 [0,2,0,0,0,0|1,1,0]=4 2883 B10R1.64 CC(C)Sc1nccn1C 62a_100000707724_100000210206 [0,2,0,0,0,0|1,1,0]=4 2884 B10R1.64 CC(C)Sc1sccc1Br 62a_100000210206_100012361411 [0,2,0,0,0,0|1,1,0]=4 2885 B10R1.64 CC(C)Sc1sccc1Br 62a_100012361411_100000210206 [0,2,0,0,0,0|1,1,0]=4 2886 B10R1.64 Cc1ccsc1SC(C)C 62a_100000210206_100010247149 [0,2,0,0,0,0|1,1,0]=4 2887 B10R1.64 Cc1ccsc1SC(C)C 62a_100010247149_100000210206 [0,2,0,0,0,0|1,1,0]=4 2888 B10R1.281 CC(C)(C)Sc1cccs1 62a_100000211941_100011215356 [0,2,0,0,0,0|1,1,0]=4 2889 B10R1.281 CC(C)(C)Sc1cccs1 62a_100011215356_100000211941 [0,2,0,0,0,0|1,1,0]=4 2890 B10R1.281 CC(C)(C)Sc1ncc[nH]1 62a_100000211941_100025796157 [0,2,0,0,0,0|1,1,0]=4 2891 B10R1.281 CC(C)(C)Sc1ncc[nH]1 62a_100025796157_100000211941 [0,2,0,0,0,0|1,1,0]=4 2892 B10R1.281 CC(C)(C)Sc1ncco1 62a_100000211941_100011787736 [0,2,0,0,0,0|0,2,0]=4 2893 B10R1.281 CC(C)(C)Sc1ncco1 62a_100011787736_100000211941 [0,2,0,0,0,0|0,2,0]=4 2894 B10R1.281 CC(C)(C)Sc1nccs1 62a_100000211941_100000211983 [0,2,0,0,0,0|0,1,0]=3 2895 B10R1.281 CC(C)(C)Sc1nccs1 62a_100000211983_100000211941 [0,2,0,0,0,0|0,1,0]=3 2896 B10R1.281 CC(C)(C)Sc1ncns1 62a_100000211941_100000693119 [0,2,0,0,0,0|1,1,0]=4 2897 B10R1.281 CC(C)(C)Sc1ncns1 62a_100000693119_100000211941 [0,2,0,0,0,0|1,1,0]=4 2898 B10R1.281 CC(C)(C)Sc1nncs1 62a_100000211941_100000739804 [0,2,0,0,0,0|1,1,0]=4 2899 B10R1.281 CC(C)(C)Sc1nncs1 62a_100000739804_100000211941 [0,2,0,0,0,0|1,1,0]=4 2900 B10R1.281 FC(F)(F)Sc1nccs1 62a_100000211983_200103152311 [0,2,0,0,0,0|1,1,0]=4 2901 B10R1.281 FC(F)(F)Sc1nccs1 62a_200000243211_100000211983 [0,2,0,0,0,0|1,1,0]=4 2902 B10R1.5 CCNc1sccc1C#N 27a_100015525214_100009817073 [0,2,0,0,0,0|2,0,0]=4 2903 B10R1.5 CCSc1nccn1CC 62a_100000210202_100011617267 [0,2,0,0,0,0|1,1,0]=4 2904 B10R1.5 CCSc1nccn1CC 62a_100011617267_100000210202 [0,2,0,0,0,0|1,1,0]=4 2905 B10R1.5 CCSc1sccc1C#N 62a_100000210202_100009817073 [0,2,0,0,0,0|1,1,0]=4 2906 B10R1.5 CCSc1sccc1C=O 62a_100000210202_100009816921 [0,2,0,0,0,0|1,1,0]=4 2907 B10R1.5 CCSc1sccc1C=O 62a_100009816921_100000210202 [0,2,0,0,0,0|1,1,0]=4 2908 B10R1.5 CCSc1sccc1CC 62a_100000210202_200009875468 [0,2,0,0,0,0|1,1,0]=4 2909 B10R1.5 CCSc1sccc1CC 62a_200009875468_100000210202 [0,2,0,0,0,0|1,1,0]=4 2910 B10R1.5 CCSc1sccc1CN 62a_100000210202_100000727803 [0,2,0,0,0,0|1,1,0]=4 2911 B10R1.5 CCSc1sccc1CN 62a_100000727803_100000210202 [0,2,0,0,0,0|1,1,0]=4 2912 B10R1.5 CCSc1sccc1CO 62a_100000210202_100009816922 [0,2,0,0,0,0|1,1,0]=4 2913 B10R1.5 CCSc1sccc1CO 62a_100009816922_100000210202 [0,2,0,0,0,0|1,1,0]=4 2914 B10R2.6 c1cc(ncn1)C2CC2 271570a_100011220607_100000703185 [0,0,0,1,0,1|2,0,0]=4 2915 B10R2.6 c1ccc(nc1)C2CC2 271570a_100011220607_100011216584 [0,0,0,1,0,1|2,0,0]=4 2916 B10R2.6 c1cnc(cn1)C2CC2 271570a_100011220607_100000758340 [0,0,0,1,0,1|2,0,0]=4 2917 B10R2.6 c1cnc(nc1)C2CC2 271570a_100011220607_100000211032 [0,0,0,1,0,1|2,0,0]=4 2918 B10R2.6 c1cncc(c1)C2CC2 271570a_100011220607_100000752921 [0,0,0,1,0,1|2,0,0]=4 2919 B10R2.6 c1cnnc(c1)C2CC2 271570a_100011220607_100016991348 [0,0,0,1,0,1|2,0,0]=4 2920 B10R2.2 Oc1cn2c(n1)CCC2 271570a_203496583355_100015205953 [0,1,0,1,0,0|2,0,0]=4 2921 B10R2.14 Brc1ccc(s1)C2CC2 271570a_100011220607_100010197418 [0,1,0,1,0,0|2,0,0]=4 2922 B10R2.14 Brc1csc(n1)C2CC2 271570a_100011220607_200016082925 [0,1,0,1,0,0|1,0,0]=3 2923 B10R2.14 Cc1c[nH]c(n1)C2CC2 271570a_100011220607_100161115468 [0,1,0,1,0,0|2,0,0]=4 2924 B10R2.14 Cc1ccc(s1)C2CC2 271570a_100011220607_100000761539 [0,1,0,1,0,0|2,0,0]=4 2925 B10R2.14 Cc1cnc(s1)C2CC2 271570a_100011220607_100000690809 [0,1,0,1,0,0|1,0,0]=3 2926 B10R2.14 Cc1csc(c1)C2CC2 271570a_100011220607_100009876951 [0,1,0,1,0,0|2,0,0]=4 2927 B10R2.14 Cc1csc(n1)C2CC2 271570a_100011220607_100011291629 [0,1,0,1,0,0|1,0,0]=3 2928 B10R2.14 Cc1nnc(s1)C2CC2 271570a_100011220607_100000686958 [0,1,0,1,0,0|2,0,0]=4 2929 B10R2.14 Cc1nsc(n1)C2CC2 271570a_100011220607_100000709739 [0,1,0,1,0,0|2,0,0]=4 2930 B10R2.14 Nc1csc(n1)C2CC2 271570a_100011220607_200015188442 [0,1,0,1,0,0|1,0,0]=3 2931 B10R2.14 Nc1nnc(s1)C2CC2 271570a_100011220607_100000738278 [0,1,0,1,0,0|2,0,0]=4 2932 B10R2.14 Oc1cnc([nH]1)C2CC2 271570a_203496583355_100010991395 [0,1,0,1,0,0|2,0,0]=4 2933 B10R2.14 Oc1cnc(s1)C2CC2 271570a_203496583355_100012360360 [0,1,0,1,0,0|1,0,0]=3 2934 B10R2.14 Oc1csc(n1)C2CC2 271570a_203496583355_100012360350 [0,1,0,1,0,0|1,0,0]=3 2935 B10R2.32 Oc1cnc2n1CCC2 271570a_203496583355_100000717441 [0,1,0,1,0,0|2,0,0]=4 2936 B10R2.136 c1nnc(s1)N2CCC2 27a_100000754969_100000739804 [0,1,0,1,0,0|2,0,0]=4 2937 B10R2.136 c1nsc(n1)N2CCC2 27a_100000754969_100000693119 [0,1,0,1,0,0|2,0,0]=4 2938 B10R2.193 c1c[nH]c(n1)SC2CC2 62a_100025796157_100000211595 [0,1,0,1,0,0|1,1,0]=4 2939 B10R2.193 c1coc(n1)SC2CC2 62a_100011787736_100000211595 [0,1,0,1,0,0|0,2,0]=4 2940 B10R2.193 c1csc(c1)SC2CC2 62a_100011215356_100000211595 [0,1,0,1,0,0|1,1,0]=4 2941 B10R2.193 c1csc(n1)SC2CC2 62a_100000211983_100000211595 [0,1,0,1,0,0|0,1,0]=3 2942 B10R2.193 c1nnc(s1)NC2CC2 27a_100000212008_100000739804 [0,1,0,1,0,0|2,0,0]=4 2943 B10R2.193 c1nnc(s1)SC2CC2 62a_100000739804_100000211595 [0,1,0,1,0,0|1,1,0]=4 2944 B10R2.193 c1nsc(n1)NC2CC2 27a_100000212008_100000693119 [0,1,0,1,0,0|2,0,0]=4 2945 B10R2.193 c1nsc(n1)SC2CC2 62a_100000693119_100000211595 [0,1,0,1,0,0|1,1,0]=4 2946 B10R2.21 Brc1ccsc1C2CC2 271570a_100011220607_100012361411 [0,1,0,1,0,0|2,0,0]=4 2947 B10R2.21 Cc1ccsc1C2CC2 271570a_100011220607_100000742657 [0,1,0,1,0,0|2,0,0]=4 2948 B10R2.21 Cn1ccnc1C2CC2 271570a_100011220607_100000707724 [0,1,0,1,0,0|2,0,0]=4