0 B8R1.11 C=Cc1[nH]cnc1Cl 271570a_100011290941_100010200774 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.11 C=Cc1c[nH]nc1Br 271570a_100011290941_100011012988 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.11 C=Cc1c[nH]nc1C 271570a_100011290941_100011912673 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.11 C=Cc1c[nH]nc1F 271570a_100011290941_100015597042 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.11 C=Cc1c[nH]nc1N 271570a_100011290941_100000717100 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.11 C=Cc1ccnn1C 271570a_100011290941_100000688441 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.11 C=Cc1ccsc1C 271570a_100011290941_100000684487 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.11 C=Cc1cncn1C 271570a_100011290941_100009814087 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.11 C=Cc1cnoc1C 271570a_100011290941_100009872056 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.11 C=Cc1conc1N 271570a_100011290941_100012597345 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.11 C=Cc1cscc1Br 271570a_100011290941_100010143727 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.11 C=Cc1cscc1C 271570a_100011290941_100000759966 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.11 C=Cc1n[nH]cc1Br 271570a_100011290941_100015839836 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.11 C=Cc1n[nH]cc1C 271570a_100011290941_100009871783 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.11 C=Cc1n[nH]cc1N 271570a_100011290941_100010894806 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.11 C=Cc1nc[nH]c1C 271570a_100011290941_100009816806 [0,0,0,0,0,0|1,0,1]=2 16 B8R1.11 C=Cc1nccn1C 271570a_100011290941_100000707724 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.11 C=Cc1ncnn1C 271570a_100011290941_100000732653 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.11 C=Cc1ncsc1C 271570a_100011290941_100000732656 [0,0,0,0,0,0|2,0,0]=2 19 B8R1.11 C=Cc1sccc1Br 271570a_100011290941_100012361411 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.11 C=Cc1sccc1C 271570a_100011290941_100000742657 [0,0,0,0,0,0|1,0,0]=1 21 B8R1.11 C=Cc1scnc1C 271570a_100011290941_100009817116 [0,0,0,0,0,0|0,0,0]=0 22 B8R1.11 CNc1ncnn1C 27a_100102657272_100000732653 [0,0,0,0,0,0|3,0,1]=4 23 B8R1.11 COc1ccnn1C 34a_100020632926_200000210301 [0,0,0,0,0,0|3,0,1]=4 24 B8R1.11 CSc1[nH]cnc1Cl 62a_100010200774_200000210301 [0,0,0,0,0,0|3,0,1]=4 25 B8R1.11 CSc1[nH]cnc1Cl 62a_200000210301_100010200774 [0,0,0,0,0,0|3,0,1]=4 26 B8R1.11 CSc1c[nH]nc1C 62a_100000692133_200000210301 [0,0,0,0,0,0|3,0,1]=4 27 B8R1.11 CSc1c[nH]nc1C 62a_200000210301_100000692133 [0,0,0,0,0,0|3,0,1]=4 28 B8R1.11 CSc1ccnn1C 62a_100000688441_200000210301 [0,0,0,0,0,0|3,0,1]=4 29 B8R1.11 CSc1ccnn1C 62a_200000210301_100000688441 [0,0,0,0,0,0|3,0,1]=4 30 B8R1.11 CSc1ccsc1C 62a_100000684487_200000210301 [0,0,0,0,0,0|3,0,1]=4 31 B8R1.11 CSc1ccsc1C 62a_200000210301_100000684487 [0,0,0,0,0,0|3,0,1]=4 32 B8R1.11 CSc1nc[nH]c1C 62a_100010186451_200000210301 [0,0,0,0,0,0|2,0,2]=4 33 B8R1.11 CSc1nc[nH]c1C 62a_200000210301_100010186451 [0,0,0,0,0,0|2,0,2]=4 34 B8R1.11 CSc1ncnn1C 62a_100000732653_200000210301 [0,0,0,0,0,0|3,0,1]=4 35 B8R1.11 CSc1ncnn1C 62a_200000210301_100000732653 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.11 CSc1ncsc1C 62a_100000732656_200000210301 [0,0,0,0,0,0|3,0,1]=4 37 B8R1.11 CSc1ncsc1C 62a_200000210301_100000732656 [0,0,0,0,0,0|3,0,1]=4 38 B8R1.11 CSc1sccc1Br 62a_100012361411_200000210301 [0,0,0,0,0,0|3,0,1]=4 39 B8R1.11 CSc1sccc1Br 62a_200000210301_100012361411 [0,0,0,0,0,0|3,0,1]=4 40 B8R1.11 CSc1sccc1C 62a_100010247149_200000210301 [0,0,0,0,0,0|2,0,1]=3 41 B8R1.11 CSc1sccc1C 62a_200000210301_100010247149 [0,0,0,0,0,0|2,0,1]=3 42 B8R1.11 CSc1sccc1O 271570a_203496583355_200010341309 [0,0,0,0,0,0|3,0,1]=4 43 B8R1.11 CSc1scnc1C 62a_100009817116_200000210301 [0,0,0,0,0,0|1,0,1]=2 44 B8R1.11 CSc1scnc1C 62a_200000210301_100009817116 [0,0,0,0,0,0|1,0,1]=2 45 B8R1.11 Cc1[nH]cnc1S[13CH3] 62a_100010186451_200025704644 [0,0,0,0,0,0|2,0,2]=4 46 B8R1.11 Cc1[nH]cnc1S[13CH3] 62a_200025704644_100010186451 [0,0,0,0,0,0|2,0,2]=4 47 B8R1.11 Cc1ccsc1S[13CH3] 62a_100010247149_200025704644 [0,0,0,0,0,0|2,0,1]=3 48 B8R1.11 Cc1ccsc1S[13CH3] 62a_200025704644_100010247149 [0,0,0,0,0,0|2,0,1]=3 49 B8R1.11 Cc1n[nH]cc1S[13CH3] 62a_100000692133_200025704644 [0,0,0,0,0,0|3,0,1]=4 50 B8R1.11 Cc1n[nH]cc1S[13CH3] 62a_200025704644_100000692133 [0,0,0,0,0,0|3,0,1]=4 51 B8R1.11 Cc1ncsc1S[13CH3] 62a_100009817116_200025704644 [0,0,0,0,0,0|1,0,1]=2 52 B8R1.11 Cc1ncsc1S[13CH3] 62a_200025704644_100009817116 [0,0,0,0,0,0|1,0,1]=2 53 B8R1.11 Cc1sccc1S[13CH3] 62a_100000684487_200025704644 [0,0,0,0,0,0|3,0,1]=4 54 B8R1.11 Cc1sccc1S[13CH3] 62a_200025704644_100000684487 [0,0,0,0,0,0|3,0,1]=4 55 B8R1.11 Cc1scnc1S[13CH3] 62a_100000732656_200025704644 [0,0,0,0,0,0|3,0,1]=4 56 B8R1.11 Cc1scnc1S[13CH3] 62a_200025704644_100000732656 [0,0,0,0,0,0|3,0,1]=4 57 B8R1.11 Cn1nccc1O[13CH3] 34a_100020632926_200025704644 [0,0,0,0,0,0|3,0,1]=4 58 B8R1.11 Cn1nccc1S[13CH3] 62a_100000688441_200025704644 [0,0,0,0,0,0|3,0,1]=4 59 B8R1.11 Cn1nccc1S[13CH3] 62a_200025704644_100000688441 [0,0,0,0,0,0|3,0,1]=4 60 B8R1.11 Cn1ncnc1S[13CH3] 62a_100000732653_200025704644 [0,0,0,0,0,0|3,0,1]=4 61 B8R1.11 Cn1ncnc1S[13CH3] 62a_200025704644_100000732653 [0,0,0,0,0,0|3,0,1]=4 62 B8R1.11 N#Cc1sccc1O 271570a_203496583355_100011215142 [0,0,0,0,0,0|3,0,1]=4 63 B8R1.11 O=Cc1ccsc1O 271570a_203496583355_100009816921 [0,0,0,0,0,0|4,0,0]=4 64 B8R1.11 O=Cc1occc1O 271570a_203496583355_100000756499 [0,0,0,0,0,0|3,1,0]=4 65 B8R1.11 O=Cc1sccc1O 271570a_203496583355_100000766043 [0,0,0,0,0,0|3,0,0]=3 66 B8R1.11 OCc1sccc1O 271570a_203496583355_100000702026 [0,0,0,0,0,0|3,0,1]=4 67 B8R1.11 OCc1scnc1O 271570a_203496583355_100012000948 [0,0,0,0,0,0|2,0,1]=3 68 B8R1.11 [13CH3]Sc1[nH]cnc1Cl 62a_100010200774_200025704644 [0,0,0,0,0,0|3,0,1]=4 69 B8R1.11 [13CH3]Sc1[nH]cnc1Cl 62a_200025704644_100010200774 [0,0,0,0,0,0|3,0,1]=4 70 B8R1.11 [13CH3]Sc1sccc1Br 62a_100012361411_200025704644 [0,0,0,0,0,0|3,0,1]=4 71 B8R1.11 [13CH3]Sc1sccc1Br 62a_200025704644_100012361411 [0,0,0,0,0,0|3,0,1]=4 72 B7R1.1 C=Cc1c[nH]cn1 271570a_100011290941_100000756875 [1,0,0,0,0,0|1,0,1]=3 73 B7R1.1 C=Cc1cc[nH]n1 271570a_100011290941_100000062575 [1,0,0,0,0,0|2,0,1]=4 74 B7R1.1 C=Cc1ccco1 271570a_100011290941_100009814098 [1,0,0,0,0,0|1,1,0]=3 75 B7R1.1 C=Cc1cccs1 271570a_100011290941_100011215356 [1,0,0,0,0,0|1,0,0]=2 76 B7R1.1 C=Cc1ccoc1 271570a_100011290941_100011215275 [1,0,0,0,0,0|2,0,0]=3 77 B7R1.1 C=Cc1ccsc1 271570a_100011290941_100000738268 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.1 C=Cc1ccsn1 271570a_100011290941_100009818082 [1,0,0,0,0,0|3,0,0]=4 79 B7R1.1 C=Cc1cn[nH]c1 271570a_100011290941_100000238712 [1,0,0,0,0,0|2,0,0]=3 80 B7R1.1 C=Cc1cnco1 271570a_100011290941_100020591547 [1,0,0,0,0,0|0,1,0]=2 81 B7R1.1 C=Cc1cncs1 271570a_100011290941_100011934649 [1,0,0,0,0,0|0,0,0]=1 82 B7R1.1 C=Cc1cnoc1 271570a_100011290941_100009815712 [1,0,0,0,0,0|2,0,0]=3 83 B7R1.1 C=Cc1cnsc1 271570a_100011290941_100009815736 [1,0,0,0,0,0|2,0,0]=3 84 B7R1.1 C=Cc1cscn1 271570a_100011290941_100000751502 [1,0,0,0,0,0|2,0,0]=3 85 B7R1.1 C=Cc1nc[nH]n1 271570a_100011290941_100000761765 [1,0,0,0,0,0|2,0,1]=4 86 B7R1.1 C=Cc1ncc[nH]1 271570a_100011290941_100025796157 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.1 C=Cc1ncco1 271570a_100011290941_100011787736 [1,0,0,0,0,0|2,1,0]=4 88 B7R1.1 C=Cc1nccs1 271570a_100011290941_100000211983 [1,0,0,0,0,0|2,0,0]=3 89 B7R1.1 C=Cc1ncns1 271570a_100011290941_100000693119 [1,0,0,0,0,0|2,0,0]=3 90 B7R1.1 C=Cc1nncs1 271570a_100011290941_100000739804 [1,0,0,0,0,0|1,0,0]=2 91 B7R1.1 CNc1nncs1 27a_100102657272_100000739804 [1,0,0,0,0,0|2,0,1]=4 92 B7R1.1 CSc1cccs1 62a_100011215356_200000210301 [1,0,0,0,0,0|2,0,1]=4 93 B7R1.1 CSc1cccs1 62a_200000210301_100011215356 [1,0,0,0,0,0|2,0,1]=4 94 B7R1.1 CSc1cnco1 62a_100020591547_200000210301 [1,0,0,0,0,0|1,1,1]=4 95 B7R1.1 CSc1cnco1 62a_200000210301_100020591547 [1,0,0,0,0,0|1,1,1]=4 96 B7R1.1 CSc1cncs1 62a_100011934649_200000210301 [1,0,0,0,0,0|1,0,1]=3 97 B7R1.1 CSc1cncs1 62a_200000210301_100011934649 [1,0,0,0,0,0|1,0,1]=3 98 B7R1.1 CSc1nncs1 62a_100000739804_200000210301 [1,0,0,0,0,0|2,0,1]=4 99 B7R1.1 CSc1nncs1 62a_200000210301_100000739804 [1,0,0,0,0,0|2,0,1]=4 100 B7R1.1 [13CH3]Sc1cccs1 62a_100011215356_200025704644 [1,0,0,0,0,0|2,0,1]=4 101 B7R1.1 [13CH3]Sc1cccs1 62a_200025704644_100011215356 [1,0,0,0,0,0|2,0,1]=4 102 B7R1.1 [13CH3]Sc1cnco1 62a_100020591547_200025704644 [1,0,0,0,0,0|1,1,1]=4 103 B7R1.1 [13CH3]Sc1cnco1 62a_200025704644_100020591547 [1,0,0,0,0,0|1,1,1]=4 104 B7R1.1 [13CH3]Sc1cncs1 62a_100011934649_200025704644 [1,0,0,0,0,0|1,0,1]=3 105 B7R1.1 [13CH3]Sc1cncs1 62a_200025704644_100011934649 [1,0,0,0,0,0|1,0,1]=3 106 B7R1.1 [13CH3]Sc1nncs1 62a_100000739804_200025704644 [1,0,0,0,0,0|2,0,1]=4 107 B7R1.1 [13CH3]Sc1nncs1 62a_200025704644_100000739804 [1,0,0,0,0,0|2,0,1]=4 108 B7R1.4 Cc1[nH]cnc1O 271570a_203496583355_100009816806 [1,0,0,0,0,0|2,0,1]=4 109 B7R1.4 Cc1ccsc1O 271570a_203496583355_100000742657 [1,0,0,0,0,0|2,0,0]=3 110 B7R1.4 Cc1n[nH]cc1O 271570a_203496583355_100011912673 [1,0,0,0,0,0|3,0,0]=4 111 B7R1.4 Cc1ncsc1O 271570a_203496583355_100009817116 [1,0,0,0,0,0|1,0,0]=2 112 B7R1.4 Cc1sccc1O 271570a_203496583355_100000684487 [1,0,0,0,0,0|2,0,1]=4 113 B7R1.4 Cc1scnc1O 271570a_203496583355_100000732656 [1,0,0,0,0,0|1,0,1]=3 114 B7R1.4 Cn1nccc1O 271570a_203496583355_100000688441 [1,0,0,0,0,0|3,0,0]=4 115 B7R1.4 Cn1ncnc1O 271570a_203496583355_100000732653 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.4 Oc1[nH]cnc1Cl 271570a_203496583355_100010200774 [1,0,0,0,0,0|3,0,0]=4 117 B7R1.4 Oc1sccc1Br 271570a_203496583355_100012361411 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.14 C=Cc1c[nH]nc1C#N 271570a_100011290941_100009813407 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.14 C=Cc1c[nH]nc1OC 271570a_100011290941_100010982843 [0,1,0,0,0,0|2,0,0]=3 120 B9R1.14 C=Cc1ccnn1CC 271570a_100011290941_100000728327 [0,1,0,0,0,0|2,0,0]=3 121 B9R1.14 C=Cc1ccoc1C=O 271570a_100011290941_100000756499 [0,1,0,0,0,0|2,0,1]=4 122 B9R1.14 C=Cc1ccsc1C#N 271570a_100011290941_100011215142 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.14 C=Cc1ccsc1C=O 271570a_100011290941_100000766043 [0,1,0,0,0,0|2,0,1]=4 124 B9R1.14 C=Cc1ccsc1CO 271570a_100011290941_100000702026 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.14 C=Cc1ccsc1SC 271570a_100011290941_200010341309 [0,1,0,0,0,0|2,0,0]=3 126 B9R1.14 C=Cc1cscc1CC 271570a_100011290941_100011068457 [0,1,0,0,0,0|3,0,0]=4 127 B9R1.14 C=Cc1cscc1CO 271570a_100011290941_100000724555 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.14 C=Cc1nccn1CC 271570a_100011290941_100011617267 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.14 C=Cc1ncnn1CC 271570a_100011290941_100009879425 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.14 C=Cc1ncsc1CO 271570a_100011290941_100012000948 [0,1,0,0,0,0|2,0,0]=3 131 B9R1.14 C=Cc1sccc1C#N 271570a_100011290941_100009817073 [0,1,0,0,0,0|1,0,1]=3 132 B9R1.14 C=Cc1sccc1C=O 271570a_100011290941_100009816921 [0,1,0,0,0,0|1,0,1]=3 133 B9R1.14 C=Cc1sccc1CC 271570a_100011290941_200009875468 [0,1,0,0,0,0|1,0,0]=2 134 B9R1.14 C=Cc1sccc1CN 271570a_100011290941_100000727803 [0,1,0,0,0,0|1,0,0]=2 135 B9R1.14 C=Cc1sccc1CO 271570a_100011290941_100009816922 [0,1,0,0,0,0|1,0,0]=2 136 B9R1.14 CCc1ccsc1SC 62a_200000210301_200009875468 [0,1,0,0,0,0|2,0,1]=4 137 B9R1.14 CCc1ccsc1SC 62a_200009875468_200000210301 [0,1,0,0,0,0|2,0,1]=4 138 B9R1.14 CCc1ccsc1S[13CH3] 62a_200009875468_200025704644 [0,1,0,0,0,0|2,0,1]=4 139 B9R1.14 CCc1ccsc1S[13CH3] 62a_200025704644_200009875468 [0,1,0,0,0,0|2,0,1]=4 140 B9R1.14 CSc1[nH]cnc1C=O 62a_100015192532_200000210301 [0,1,0,0,0,0|2,0,1]=4 141 B9R1.14 CSc1[nH]cnc1C=O 62a_200000210301_100015192532 [0,1,0,0,0,0|2,0,1]=4 142 B9R1.14 CSc1ccoc1C=O 62a_100000756499_200000210301 [0,1,0,0,0,0|2,1,0]=4 143 B9R1.14 CSc1ccoc1C=O 62a_200000210301_100000756499 [0,1,0,0,0,0|2,1,0]=4 144 B9R1.14 CSc1ccsc1C#N 62a_200000210301_100011215142 [0,1,0,0,0,0|2,0,1]=4 145 B9R1.14 CSc1ccsc1C=O 62a_100000766043_200000210301 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.14 CSc1ccsc1C=O 62a_200000210301_100000766043 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.14 CSc1ccsc1CO 62a_100000702026_200000210301 [0,1,0,0,0,0|2,0,1]=4 148 B9R1.14 CSc1ccsc1CO 62a_200000210301_100000702026 [0,1,0,0,0,0|2,0,1]=4 149 B9R1.14 CSc1ccsc1SC 62a_200000210301_200010341309 [0,1,0,0,0,0|2,0,1]=4 150 B9R1.14 CSc1ccsc1SC 62a_200010341309_200000210301 [0,1,0,0,0,0|2,0,1]=4 151 B9R1.14 CSc1ncsc1CO 62a_100012000948_200000210301 [0,1,0,0,0,0|1,0,1]=3 152 B9R1.14 CSc1ncsc1CO 62a_200000210301_100012000948 [0,1,0,0,0,0|1,0,1]=3 153 B9R1.14 CSc1sccc1C=O 62a_100009816921_200000210301 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.14 CSc1sccc1C=O 62a_200000210301_100009816921 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.14 CSc1sccc1CN 62a_100000727803_200000210301 [0,1,0,0,0,0|2,0,1]=4 156 B9R1.14 CSc1sccc1CN 62a_200000210301_100000727803 [0,1,0,0,0,0|2,0,1]=4 157 B9R1.14 CSc1sccc1CO 62a_100009816922_200000210301 [0,1,0,0,0,0|2,0,1]=4 158 B9R1.14 CSc1sccc1CO 62a_200000210301_100009816922 [0,1,0,0,0,0|2,0,1]=4 159 B9R1.14 CSc1sccc1S[13CH3] 62a_200010341309_200025704644 [0,1,0,0,0,0|2,0,1]=4 160 B9R1.14 CSc1sccc1S[13CH3] 62a_200025704644_200010341309 [0,1,0,0,0,0|2,0,1]=4 161 B9R1.14 [13CH3]Sc1[nH]cnc1C=O 62a_100015192532_200025704644 [0,1,0,0,0,0|2,0,1]=4 162 B9R1.14 [13CH3]Sc1[nH]cnc1C=O 62a_200025704644_100015192532 [0,1,0,0,0,0|2,0,1]=4 163 B9R1.14 [13CH3]Sc1ccoc1C=O 62a_100000756499_200025704644 [0,1,0,0,0,0|2,1,0]=4 164 B9R1.14 [13CH3]Sc1ccoc1C=O 62a_200025704644_100000756499 [0,1,0,0,0,0|2,1,0]=4 165 B9R1.14 [13CH3]Sc1ccsc1C#N 62a_200025704644_100011215142 [0,1,0,0,0,0|2,0,1]=4 166 B9R1.14 [13CH3]Sc1ccsc1C=O 62a_100000766043_200025704644 [0,1,0,0,0,0|2,0,0]=3 167 B9R1.14 [13CH3]Sc1ccsc1C=O 62a_200025704644_100000766043 [0,1,0,0,0,0|2,0,0]=3 168 B9R1.14 [13CH3]Sc1ccsc1CO 62a_100000702026_200025704644 [0,1,0,0,0,0|2,0,1]=4 169 B9R1.14 [13CH3]Sc1ccsc1CO 62a_200025704644_100000702026 [0,1,0,0,0,0|2,0,1]=4 170 B9R1.14 [13CH3]Sc1ncsc1CO 62a_100012000948_200025704644 [0,1,0,0,0,0|1,0,1]=3 171 B9R1.14 [13CH3]Sc1ncsc1CO 62a_200025704644_100012000948 [0,1,0,0,0,0|1,0,1]=3 172 B9R1.14 [13CH3]Sc1sccc1C=O 62a_100009816921_200025704644 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.14 [13CH3]Sc1sccc1C=O 62a_200025704644_100009816921 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.14 [13CH3]Sc1sccc1CN 62a_100000727803_200025704644 [0,1,0,0,0,0|2,0,1]=4 175 B9R1.14 [13CH3]Sc1sccc1CN 62a_200025704644_100000727803 [0,1,0,0,0,0|2,0,1]=4 176 B9R1.14 [13CH3]Sc1sccc1CO 62a_100009816922_200025704644 [0,1,0,0,0,0|2,0,1]=4 177 B9R1.14 [13CH3]Sc1sccc1CO 62a_200025704644_100009816922 [0,1,0,0,0,0|2,0,1]=4 178 B9R1.22 C=Cc1cc(nn1C)C 271570a_100011290941_100009818511 [0,1,0,0,0,0|2,0,0]=3 179 B9R1.22 C=Cc1cc(nn1C)N 271570a_100011290941_100116209741 [0,1,0,0,0,0|2,0,0]=3 180 B9R1.22 C=Cc1cc(sc1C)C 271570a_100011290941_100000688054 [0,1,0,0,0,0|2,0,0]=3 181 B9R1.22 C=Cc1cc(sc1Cl)Cl 271570a_100011290941_100010244177 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.22 C=Cc1cn(nc1C)C 271570a_100011290941_100011996311 [0,1,0,0,0,0|2,0,0]=3 183 B9R1.22 C=Cc1cn(nc1N)C 271570a_100011290941_100010776223 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.22 C=Cc1nc(cn1C)C 271570a_100011290941_100009816808 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.22 C=Cc1nc(sc1C)C 271570a_100011290941_100010270876 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.22 C=Cc1nc(sc1C)N 271570a_100011290941_100009817509 [0,1,0,0,0,0|2,0,0]=3 187 B9R1.22 C=Cc1nn(cc1C)C 271570a_100011290941_100012644376 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.22 C=Cc1nn(nc1C)C 271570a_100011290941_200009884731 [0,1,0,0,0,0|2,0,0]=3 189 B9R1.22 C=Cc1sc(cc1C)C 271570a_100011290941_100000689295 [0,1,0,0,0,0|1,0,0]=2 190 B9R1.22 C=Cc1sc(nc1C)C 271570a_100011290941_100009814099 [0,1,0,0,0,0|0,0,0]=1 191 B9R1.22 CSc1sc(cc1C)C 62a_100000689295_200000210301 [0,1,0,0,0,0|2,0,1]=4 192 B9R1.22 CSc1sc(cc1C)C 62a_200000210301_100000689295 [0,1,0,0,0,0|2,0,1]=4 193 B9R1.22 CSc1sc(nc1C)C 62a_100009814099_200000210301 [0,1,0,0,0,0|1,0,1]=3 194 B9R1.22 CSc1sc(nc1C)C 62a_200000210301_100009814099 [0,1,0,0,0,0|1,0,1]=3 195 B9R1.22 CSc1sc(nc1C)N 62a_100159269596_200000210301 [0,1,0,0,0,0|1,0,1]=3 196 B9R1.22 CSc1sc(nc1C)N 62a_200000210301_100159269596 [0,1,0,0,0,0|1,0,1]=3 197 B9R1.22 Cc1cc(c(s1)C=O)O 271570a_203496583355_100011361552 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_100000689295_200025704644 [0,1,0,0,0,0|2,0,1]=4 199 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_200025704644_100000689295 [0,1,0,0,0,0|2,0,1]=4 200 B9R1.22 Cc1cc(sc1C=O)O 271570a_203496583355_100010221198 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.22 Cc1nc(c(s1)S[13CH3])C 62a_100009814099_200025704644 [0,1,0,0,0,0|1,0,1]=3 202 B9R1.22 Cc1nc(c(s1)S[13CH3])C 62a_200025704644_100009814099 [0,1,0,0,0,0|1,0,1]=3 203 B9R1.22 Cc1nc(sc1C=O)O 271570a_203496583355_100010339034 [0,1,0,0,0,0|1,0,0]=2 204 B9R1.22 Cc1nc(sc1CO)O 271570a_203496583355_100010264302 [0,1,0,0,0,0|1,0,1]=3 205 B9R1.22 Cc1nc(sc1S[13CH3])N 62a_100159269596_200025704644 [0,1,0,0,0,0|1,0,1]=3 206 B9R1.22 Cc1nc(sc1S[13CH3])N 62a_200025704644_100159269596 [0,1,0,0,0,0|1,0,1]=3 207 B9R1.22 Cc1oc(nc1C=O)O 271570a_203496583355_200010262729 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.27 C=Cc1c([nH][nH]c1=O)C 271570a_100011290941_100000686169 [0,1,0,0,0,0|2,0,1]=4 209 B9R1.27 C=Cc1c(n[nH]c1C)C 271570a_100011290941_100000238710 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.27 C=Cc1c(n[nH]c1N)C 271570a_100011290941_100000182022 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.27 C=Cc1c(nnn1C)C 271570a_100011290941_100016037793 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.27 C=Cc1c(noc1C)C 271570a_100011290941_100000694658 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.27 C=Cc1c(noc1C)N 271570a_100011290941_100011216220 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.27 C=Cc1c(noc1C)O 271570a_100011290941_100010730664 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.27 C=Cc1c(noc1N)C 271570a_100011290941_100000754107 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.27 C=Cc1c(nsc1N)C 271570a_100011290941_100000701153 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.27 Cn1cnc(c1C=O)O 271570a_203496583355_200000040309 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.27 Cn1ncc(c1C=O)O 271570a_203496583355_100000763672 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.33 C=C=Cc1[nH]cnc1Cl 271570a_100015277604_100010200774 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.33 C=C=Cc1c[nH]nc1Br 271570a_100015277604_100011012988 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.33 C=C=Cc1c[nH]nc1C 271570a_100015277604_100011912673 [0,1,0,0,0,0|2,0,0]=3 222 B9R1.33 C=C=Cc1c[nH]nc1F 271570a_100015277604_100015597042 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.33 C=C=Cc1c[nH]nc1N 271570a_100015277604_100000717100 [0,1,0,0,0,0|3,0,0]=4 224 B9R1.33 C=C=Cc1ccnn1C 271570a_100015277604_100000688441 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.33 C=C=Cc1ccsc1C 271570a_100015277604_100000684487 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.33 C=C=Cc1cnoc1C 271570a_100015277604_100009872056 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.33 C=C=Cc1conc1N 271570a_100015277604_100012597345 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.33 C=C=Cc1cscc1C 271570a_100015277604_100000759966 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.33 C=C=Cc1n[nH]cc1C 271570a_100015277604_100009871783 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.33 C=C=Cc1nc[nH]c1C 271570a_100015277604_100009816806 [0,1,0,0,0,0|1,0,1]=3 231 B9R1.33 C=C=Cc1nccn1C 271570a_100015277604_100000707724 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.33 C=C=Cc1ncnn1C 271570a_100015277604_100000732653 [0,1,0,0,0,0|2,0,0]=3 233 B9R1.33 C=C=Cc1ncsc1C 271570a_100015277604_100000732656 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.33 C=C=Cc1sccc1Br 271570a_100015277604_100012361411 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.33 C=C=Cc1sccc1C 271570a_100015277604_100000742657 [0,1,0,0,0,0|1,0,0]=2 236 B9R1.33 C=C=Cc1scnc1C 271570a_100015277604_100009817116 [0,1,0,0,0,0|0,0,0]=1 237 B9R1.33 CC=Cc1[nH]cnc1Cl 271570a_100016259895_100010200774 [0,1,0,0,0,0|2,0,0]=3 238 B9R1.33 CC=Cc1c[nH]nc1Br 271570a_100016259895_100011012988 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.33 CC=Cc1c[nH]nc1C 271570a_100016259895_100011912673 [0,1,0,0,0,0|2,0,0]=3 240 B9R1.33 CC=Cc1c[nH]nc1F 271570a_100016259895_100015597042 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.33 CC=Cc1c[nH]nc1N 271570a_100016259895_100000717100 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.33 CC=Cc1ccnn1C 271570a_100016259895_100000688441 [0,1,0,0,0,0|2,0,0]=3 243 B9R1.33 CC=Cc1ccsc1C 271570a_100016259895_100000684487 [0,1,0,0,0,0|2,0,0]=3 244 B9R1.33 CC=Cc1cnoc1C 271570a_100016259895_100009872056 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.33 CC=Cc1conc1N 271570a_100016259895_100012597345 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.33 CC=Cc1cscc1C 271570a_100016259895_100000759966 [0,1,0,0,0,0|3,0,0]=4 247 B9R1.33 CC=Cc1n[nH]cc1C 271570a_100016259895_100009871783 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.33 CC=Cc1nc[nH]c1C 271570a_100016259895_100009816806 [0,1,0,0,0,0|1,0,1]=3 249 B9R1.33 CC=Cc1nccn1C 271570a_100016259895_100000707724 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.33 CC=Cc1ncnn1C 271570a_100016259895_100000732653 [0,1,0,0,0,0|2,0,0]=3 251 B9R1.33 CC=Cc1ncsc1C 271570a_100016259895_100000732656 [0,1,0,0,0,0|2,0,0]=3 252 B9R1.33 CC=Cc1sccc1Br 271570a_100016259895_100012361411 [0,1,0,0,0,0|2,0,0]=3 253 B9R1.33 CC=Cc1sccc1C 271570a_100016259895_100000742657 [0,1,0,0,0,0|1,0,0]=2 254 B9R1.33 CC=Cc1scnc1C 271570a_100016259895_100009817116 [0,1,0,0,0,0|0,0,0]=1 255 B9R1.33 CCSc1sccc1C 62a_100000210202_100010247149 [0,1,0,0,0,0|1,0,2]=4 256 B9R1.33 CCSc1sccc1C 62a_100010247149_100000210202 [0,1,0,0,0,0|1,0,2]=4 257 B9R1.33 CCSc1scnc1C 62a_100000210202_100009817116 [0,1,0,0,0,0|0,0,2]=3 258 B9R1.33 CCSc1scnc1C 62a_100009817116_100000210202 [0,1,0,0,0,0|0,0,2]=3 259 B9R1.33 CNCc1sccc1C 207a_100102657272_100000210881 [0,1,0,0,0,0|1,0,2]=4 260 B9R1.33 CNCc1sccc1C 2230a_100000238519_200000210301 [0,1,0,0,0,0|1,0,2]=4 261 B9R1.33 CNCc1sccc1C 270004a_106832991635_100000210881 [0,1,0,0,0,0|1,0,2]=4 262 B9R1.33 CNCc1sccc1C 34a_100000238519_200000210301 [0,1,0,0,0,0|1,0,2]=4 263 B9R1.33 CNCc1scnc1C 207a_100102657272_100000764165 [0,1,0,0,0,0|0,0,2]=3 264 B9R1.33 CNCc1scnc1C 2230a_100000752186_200000210301 [0,1,0,0,0,0|0,0,2]=3 265 B9R1.33 CNCc1snnc1C 2230a_100000732738_200000210301 [0,1,0,0,0,0|1,0,2]=4 266 B9R1.33 CNCc1snnc1C 2230a_106832991635_100000732739 [0,1,0,0,0,0|1,0,2]=4 267 B9R1.33 CNCc1snnc1C 270004a_106832991635_100000732746 [0,1,0,0,0,0|1,0,2]=4 268 B9R1.33 CNCc1snnc1C 34a_100102657272_100000732739 [0,1,0,0,0,0|1,0,2]=4 269 B9R1.33 CNCc1snnc1C 7a_106832991635_100000732739 [0,1,0,0,0,0|1,0,2]=4 270 B9R1.33 COCc1ocnc1C 34a_100000717716_200000210301 [0,1,0,0,0,0|0,1,2]=4 271 B9R1.33 COCc1ocnc1C 7a_100000717716_200000210301 [0,1,0,0,0,0|0,1,2]=4 272 B9R1.33 COCc1sccc1C 34a_100000238368_200000210301 [0,1,0,0,0,0|1,0,2]=4 273 B9R1.33 COCc1sccc1C 7a_100000238368_200000210301 [0,1,0,0,0,0|1,0,2]=4 274 B9R1.33 COCc1scnc1Br 7a_100012000948_200000210301 [0,1,0,0,0,0|1,0,2]=4 275 B9R1.33 COCc1scnc1C 34a_100000750112_200000210301 [0,1,0,0,0,0|0,0,2]=3 276 B9R1.33 COCc1scnc1C 7a_100000750112_200000210301 [0,1,0,0,0,0|0,0,2]=3 277 B9R1.33 COCc1snnc1C 34a_100138415774_100000732739 [0,1,0,0,0,0|1,0,2]=4 278 B9R1.33 CSCc1snnc1C 62a_100000732739_200000210301 [0,1,0,0,0,0|1,0,2]=4 279 B9R1.33 CSCc1snnc1C 62a_200000210301_100000732739 [0,1,0,0,0,0|1,0,2]=4 280 B9R1.33 Cc1ccsc1CN[13CH3] 2230a_100000238519_200025704644 [0,1,0,0,0,0|1,0,2]=4 281 B9R1.33 Cc1ccsc1CN[13CH3] 34a_100000238519_200025704644 [0,1,0,0,0,0|1,0,2]=4 282 B9R1.33 Cc1ccsc1CO[13CH3] 34a_100000238368_200025704644 [0,1,0,0,0,0|1,0,2]=4 283 B9R1.33 Cc1ccsc1CO[13CH3] 7a_100000238368_200025704644 [0,1,0,0,0,0|1,0,2]=4 284 B9R1.33 Cc1ccsc1SCF 62a_100010247149_100015361967 [0,1,0,0,0,0|2,0,1]=4 285 B9R1.33 Cc1ccsc1SCF 62a_100015361967_100010247149 [0,1,0,0,0,0|2,0,1]=4 286 B9R1.33 Cc1ncoc1CO[13CH3] 34a_100000717716_200025704644 [0,1,0,0,0,0|0,1,2]=4 287 B9R1.33 Cc1ncoc1CO[13CH3] 7a_100000717716_200025704644 [0,1,0,0,0,0|0,1,2]=4 288 B9R1.33 Cc1ncsc1CN[13CH3] 2230a_100000752186_200025704644 [0,1,0,0,0,0|0,0,2]=3 289 B9R1.33 Cc1ncsc1CO[13CH3] 34a_100000750112_200025704644 [0,1,0,0,0,0|0,0,2]=3 290 B9R1.33 Cc1ncsc1CO[13CH3] 7a_100000750112_200025704644 [0,1,0,0,0,0|0,0,2]=3 291 B9R1.33 Cc1ncsc1SCF 62a_100009817116_100015361967 [0,1,0,0,0,0|1,0,1]=3 292 B9R1.33 Cc1ncsc1SCF 62a_100015361967_100009817116 [0,1,0,0,0,0|1,0,1]=3 293 B9R1.33 Cc1nnsc1CN[13CH3] 2230a_100000732738_200025704644 [0,1,0,0,0,0|1,0,2]=4 294 B9R1.33 Cc1nnsc1CS[13CH3] 62a_100000732739_200025704644 [0,1,0,0,0,0|1,0,2]=4 295 B9R1.33 Cc1nnsc1CS[13CH3] 62a_200025704644_100000732739 [0,1,0,0,0,0|1,0,2]=4 296 B9R1.33 [13CH3]OCc1scnc1Br 7a_100012000948_200025704644 [0,1,0,0,0,0|1,0,2]=4 297 B9R1.41 C=C(C)c1[nH]cnc1Cl 271570a_100000694244_100010200774 [0,1,0,0,0,0|2,0,0]=3 298 B9R1.41 C=C(C)c1c[nH]nc1Br 271570a_100000694244_100011012988 [0,1,0,0,0,0|3,0,0]=4 299 B9R1.41 C=C(C)c1c[nH]nc1C 271570a_100000694244_100011912673 [0,1,0,0,0,0|2,0,0]=3 300 B9R1.41 C=C(C)c1c[nH]nc1F 271570a_100000694244_100015597042 [0,1,0,0,0,0|3,0,0]=4 301 B9R1.41 C=C(C)c1c[nH]nc1N 271570a_100000694244_100000717100 [0,1,0,0,0,0|3,0,0]=4 302 B9R1.41 C=C(C)c1ccnn1C 271570a_100000694244_100000688441 [0,1,0,0,0,0|2,0,0]=3 303 B9R1.41 C=C(C)c1ccsc1C 271570a_100000694244_100000684487 [0,1,0,0,0,0|2,0,0]=3 304 B9R1.41 C=C(C)c1cnoc1C 271570a_100000694244_100009872056 [0,1,0,0,0,0|3,0,0]=4 305 B9R1.41 C=C(C)c1conc1N 271570a_100000694244_100012597345 [0,1,0,0,0,0|3,0,0]=4 306 B9R1.41 C=C(C)c1cscc1C 271570a_100000694244_100000759966 [0,1,0,0,0,0|3,0,0]=4 307 B9R1.41 C=C(C)c1n[nH]cc1C 271570a_100000694244_100009871783 [0,1,0,0,0,0|3,0,0]=4 308 B9R1.41 C=C(C)c1nc[nH]c1C 271570a_100000694244_100009816806 [0,1,0,0,0,0|1,0,1]=3 309 B9R1.41 C=C(C)c1nccn1C 271570a_100000694244_100000707724 [0,1,0,0,0,0|3,0,0]=4 310 B9R1.41 C=C(C)c1ncnn1C 271570a_100000694244_100000732653 [0,1,0,0,0,0|2,0,0]=3 311 B9R1.41 C=C(C)c1ncsc1C 271570a_100000694244_100000732656 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.41 C=C(C)c1sccc1Br 271570a_100000694244_100012361411 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.41 C=C(C)c1sccc1C 271570a_100000694244_100000742657 [0,1,0,0,0,0|1,0,0]=2 314 B9R1.41 C=C(C)c1scnc1C 271570a_100000694244_100009817116 [0,1,0,0,0,0|0,0,0]=1 315 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [0,1,0,0,0,0|2,0,1]=4 316 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [0,1,0,0,0,0|1,0,1]=3 317 B9R1.132 C=Cc1cnn(c1C)C 271570a_100011290941_100000722751 [0,1,0,0,0,0|2,0,1]=4 318 B9R1.132 C=Cc1csc(c1C)C 271570a_100011290941_100009820295 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.132 C=Cc1n[nH]c(c1C)C 271570a_100011290941_100015309786 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.132 C=Cc1ncc(n1C)C 271570a_100011290941_100009816807 [0,1,0,0,0,0|3,0,0]=4 321 B7R0.1 C=CCSC/C=C/C 62a_100000210623_100102629194 [0,0,1,0,0,0|1,0,2]=4 322 B7R0.1 C=CCSC/C=C/C 62a_100102629194_100000210623 [0,0,1,0,0,0|1,0,2]=4 323 B7R0.1 C=CCSCC=CC 62a_100000070051_100000210623 [0,0,1,0,0,0|1,0,2]=4 324 B7R0.1 C=CCSCC=CC 62a_100000210623_100000070051 [0,0,1,0,0,0|1,0,2]=4 325 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [0,0,0,0,0,1|2,0,0]=3 326 B9R1.2 C=Cc1cc(ccn1)Cl 271570a_100011290941_100010167805 [0,0,0,0,0,1|3,0,0]=4 327 B9R1.2 C=Cc1cc(ccn1)F 271570a_100011290941_100009817058 [0,0,0,0,0,1|3,0,0]=4 328 B9R1.2 C=Cc1cc(ccn1)N 271570a_100011290941_100009814236 [0,0,0,0,0,1|3,0,0]=4 329 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [0,0,0,0,0,1|3,0,0]=4 330 B9R1.2 C=Cc1cc(cnn1)C 271570a_100011290941_100000070100 [0,0,0,0,0,1|3,0,0]=4 331 B9R1.2 C=Cc1cc(ncn1)C 271570a_100011290941_100000744208 [0,0,0,0,0,1|1,0,0]=2 332 B9R1.2 C=Cc1cc(ncn1)F 271570a_100011290941_200009880791 [0,0,0,0,0,1|2,0,0]=3 333 B9R1.2 C=Cc1cc(ncn1)N 271570a_100011290941_100000701291 [0,0,0,0,0,1|2,0,0]=3 334 B9R1.2 C=Cc1cc(ncn1)O 271570a_100011290941_100000765262 [0,0,0,0,0,1|2,0,0]=3 335 B9R1.2 C=Cc1cc[nH]c(=O)c1 271570a_100011290941_100009816521 [0,0,0,0,0,1|2,0,1]=4 336 B9R1.2 C=Cc1cc[nH]c(=O)n1 271570a_100011290941_200000134032 [0,0,0,0,0,1|2,0,1]=4 337 B9R1.2 C=Cc1ccc[n+](c1)C 271570a_100011290941_100009996589 [0,0,0,0,0,1|3,0,0]=4 338 B9R1.2 C=Cc1cccc(=O)[nH]1 271570a_100011290941_100000761760 [0,0,0,0,0,1|3,0,0]=4 339 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [0,0,0,0,0,1|3,0,0]=4 340 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [0,0,0,0,0,1|2,0,0]=3 341 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [0,0,0,0,0,1|3,0,0]=4 342 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [0,0,0,0,0,1|3,0,0]=4 343 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [0,0,0,0,0,1|3,0,0]=4 344 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [0,0,0,0,0,1|3,0,0]=4 345 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [0,0,0,0,0,1|3,0,0]=4 346 B9R1.2 C=Cc1cccc(n1)Br 271570a_100011290941_100000684672 [0,0,0,0,0,1|3,0,0]=4 347 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [0,0,0,0,0,1|2,0,0]=3 348 B9R1.2 C=Cc1cccc(n1)F 271570a_100011290941_100009815982 [0,0,0,0,0,1|3,0,0]=4 349 B9R1.2 C=Cc1cccc(n1)N 271570a_100011290941_100000740741 [0,0,0,0,0,1|3,0,0]=4 350 B9R1.2 C=Cc1ccnc(c1)Br 271570a_100011290941_100009814637 [0,0,0,0,0,1|2,0,0]=3 351 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [0,0,0,0,0,1|1,0,0]=2 352 B9R1.2 C=Cc1ccnc(c1)Cl 271570a_100011290941_100000035001 [0,0,0,0,0,1|2,0,0]=3 353 B9R1.2 C=Cc1ccnc(c1)F 271570a_100011290941_100009816116 [0,0,0,0,0,1|2,0,0]=3 354 B9R1.2 C=Cc1ccnc(c1)N 271570a_100011290941_100000744379 [0,0,0,0,0,1|2,0,0]=3 355 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [0,0,0,0,0,1|1,0,0]=2 356 B9R1.2 C=Cc1ccnc(n1)N 271570a_100011290941_100009820717 [0,0,0,0,0,1|2,0,0]=3 357 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [0,0,0,0,0,1|3,0,0]=4 358 B9R1.2 C=Cc1cncc(n1)C 271570a_100011290941_100009842155 [0,0,0,0,0,1|3,0,0]=4 359 B9R1.2 C=Cc1cnnc(c1)N 271570a_100011290941_100000130277 [0,0,0,0,0,1|3,0,0]=4 360 B9R1.2 C=Cc1nccc(n1)C 271570a_100011290941_100011243806 [0,0,0,0,0,1|2,0,0]=3 361 B9R1.2 C=Cc1nccc(n1)N 271570a_100011290941_100000757536 [0,0,0,0,0,1|3,0,0]=4 362 B9R1.2 C=Cc1nccc(n1)O 271570a_100011290941_100011649813 [0,0,0,0,0,1|3,0,0]=4 363 B9R1.2 C=Cc1ncnc(n1)N 271570a_100011290941_100000123831 [0,0,0,0,0,1|2,0,0]=3 364 B9R1.2 CNc1cc(ncn1)C 27a_100102657272_100000744208 [0,0,0,0,0,1|2,0,1]=4 365 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [0,0,0,0,0,1|2,0,1]=4 366 B9R1.2 CNc1ccnc(n1)C 27a_100102657272_100000749937 [0,0,0,0,0,1|2,0,1]=4 367 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [0,0,0,0,0,1|2,0,1]=4 368 B9R1.2 CSc1cc(ncn1)C 62a_100000744208_200000210301 [0,0,0,0,0,1|2,0,1]=4 369 B9R1.2 CSc1cc(ncn1)C 62a_200000210301_100000744208 [0,0,0,0,0,1|2,0,1]=4 370 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [0,0,0,0,0,1|2,0,1]=4 371 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [0,0,0,0,0,1|2,0,1]=4 372 B9R1.2 CSc1ccnc(n1)C 62a_100000749937_200000210301 [0,0,0,0,0,1|2,0,1]=4 373 B9R1.2 CSc1ccnc(n1)C 62a_200000210301_100000749937 [0,0,0,0,0,1|2,0,1]=4 374 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [0,0,0,0,0,1|2,0,1]=4 375 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [0,0,0,0,0,1|2,0,1]=4 376 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [0,0,0,0,0,1|2,0,1]=4 377 B9R1.2 Cc1cc(ncn1)S[13CH3] 62a_100000744208_200025704644 [0,0,0,0,0,1|2,0,1]=4 378 B9R1.2 Cc1cc(ncn1)S[13CH3] 62a_200025704644_100000744208 [0,0,0,0,0,1|2,0,1]=4 379 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_100000749937_200025704644 [0,0,0,0,0,1|2,0,1]=4 380 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_200025704644_100000749937 [0,0,0,0,0,1|2,0,1]=4 381 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [0,0,0,0,0,1|3,0,0]=4 382 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [0,0,0,0,0,1|3,0,0]=4 383 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [0,0,0,0,0,1|3,0,0]=4 384 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [0,0,0,0,0,1|2,0,1]=4 385 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [0,0,0,0,0,1|3,0,0]=4 386 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [0,0,0,0,0,1|3,0,0]=4 387 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [0,0,0,0,0,1|2,0,0]=3 388 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [0,0,0,0,0,1|3,0,0]=4 389 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [0,0,0,0,0,1|3,0,0]=4 390 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [0,0,0,0,0,1|3,0,0]=4 391 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [0,0,0,0,0,1|3,0,0]=4 392 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [0,0,0,0,0,1|2,0,0]=3 393 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [0,0,0,0,0,1|1,0,0]=2 394 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [0,0,0,0,0,1|2,0,0]=3 395 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [0,0,0,0,0,1|2,0,0]=3 396 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [0,0,0,0,0,1|2,0,0]=3 397 B9R1.15 C=Cc1ccn[nH]c1=O 271570a_100011290941_100000087129 [0,0,0,0,0,1|2,0,0]=3 398 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [0,0,0,0,0,1|2,0,0]=3 399 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [0,0,0,0,0,1|1,0,0]=2 400 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [0,0,0,0,0,1|2,0,0]=3 401 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [0,0,0,0,0,1|2,0,0]=3 402 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [0,0,0,0,0,1|2,0,0]=3 403 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [0,0,0,0,0,1|2,0,0]=3 404 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [0,0,0,0,0,1|3,0,0]=4 405 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [0,0,0,0,0,1|2,0,0]=3 406 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [0,0,0,0,0,1|3,0,0]=4 407 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [0,0,0,0,0,1|3,0,0]=4 408 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [0,0,0,0,0,1|3,0,0]=4 409 B9R1.15 C=Cc1cncnc1Br 271570a_100011290941_200012461658 [0,0,0,0,0,1|2,0,0]=3 410 B9R1.15 C=Cc1cncnc1C 271570a_100011290941_100009819671 [0,0,0,0,0,1|1,0,0]=2 411 B9R1.15 C=Cc1cncnc1Cl 271570a_100011290941_100000758962 [0,0,0,0,0,1|2,0,0]=3 412 B9R1.15 C=Cc1cncnc1N 271570a_100011290941_100011996079 [0,0,0,0,0,1|2,0,0]=3 413 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [0,0,0,0,0,1|2,0,0]=3 414 B9R1.15 C=Cc1cnncc1N 271570a_100011290941_100009829405 [0,0,0,0,0,1|3,0,0]=4 415 B9R1.15 C=Cc1ncc[nH]c1=O 271570a_100011290941_100000763361 [0,0,0,0,0,1|2,0,1]=4 416 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [0,0,0,0,0,1|3,0,0]=4 417 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [0,0,0,0,0,1|2,0,0]=3 418 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [0,0,0,0,0,1|3,0,0]=4 419 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [0,0,0,0,0,1|3,0,0]=4 420 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [0,0,0,0,0,1|3,0,0]=4 421 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [0,0,0,0,0,1|3,0,0]=4 422 B9R1.15 C=Cc1nccnc1C 271570a_100011290941_100011999405 [0,0,0,0,0,1|1,0,0]=2 423 B9R1.15 C=Cc1nccnc1F 271570a_100011290941_200010125657 [0,0,0,0,0,1|2,0,0]=3 424 B9R1.15 C=Cc1nccnc1N 271570a_100011290941_100000747729 [0,0,0,0,0,1|2,0,0]=3 425 B9R1.15 C=Cc1ncncc1C 271570a_100011290941_100011998708 [0,0,0,0,0,1|1,0,0]=2 426 B9R1.15 C=Cc1ncncc1F 271570a_100011290941_100000069762 [0,0,0,0,0,1|2,0,0]=3 427 B9R1.15 C=Cc1ncncc1N 271570a_100011290941_100000709731 [0,0,0,0,0,1|2,0,0]=3 428 B9R1.15 C=Cc1nnccc1C 271570a_100011290941_100000089043 [0,0,0,0,0,1|2,0,0]=3 429 B9R1.15 CNc1ccncc1C 27a_100102657272_100000765111 [0,0,0,0,0,1|2,0,1]=4 430 B9R1.15 CNc1nccnc1C 27a_100102657272_100011999405 [0,0,0,0,0,1|2,0,1]=4 431 B9R1.15 CNc1ncncc1C 27a_100102657272_100011998708 [0,0,0,0,0,1|2,0,1]=4 432 B9R1.15 COc1cccnc1C 34a_100000745507_200000210301 [0,0,0,0,0,1|2,0,1]=4 433 B9R1.15 COc1cccnc1C 7a_100000745507_200000210301 [0,0,0,0,0,1|2,0,1]=4 434 B9R1.15 COc1ccncc1C 34a_100000694293_200000210301 [0,0,0,0,0,1|2,0,1]=4 435 B9R1.15 COc1nccnc1C 34a_100000766352_200000210301 [0,0,0,0,0,1|2,0,1]=4 436 B9R1.15 CSc1cccnc1C 62a_100000751574_200000210301 [0,0,0,0,0,1|2,0,1]=4 437 B9R1.15 CSc1cccnc1C 62a_200000210301_100000751574 [0,0,0,0,0,1|2,0,1]=4 438 B9R1.15 CSc1ccncc1C 62a_100000765111_200000210301 [0,0,0,0,0,1|2,0,1]=4 439 B9R1.15 CSc1ccncc1C 62a_200000210301_100000765111 [0,0,0,0,0,1|2,0,1]=4 440 B9R1.15 CSc1cncnc1C 62a_100009819671_200000210301 [0,0,0,0,0,1|2,0,1]=4 441 B9R1.15 CSc1cncnc1C 62a_200000210301_100009819671 [0,0,0,0,0,1|2,0,1]=4 442 B9R1.15 CSc1nccnc1C 62a_100011999405_200000210301 [0,0,0,0,0,1|2,0,1]=4 443 B9R1.15 CSc1nccnc1C 62a_200000210301_100011999405 [0,0,0,0,0,1|2,0,1]=4 444 B9R1.15 CSc1ncncc1C 62a_100011998708_200000210301 [0,0,0,0,0,1|2,0,1]=4 445 B9R1.15 CSc1ncncc1C 62a_200000210301_100011998708 [0,0,0,0,0,1|2,0,1]=4 446 B9R1.15 Cc1cnccc1O[13CH3] 34a_100000694293_200025704644 [0,0,0,0,0,1|2,0,1]=4 447 B9R1.15 Cc1cnccc1S[13CH3] 62a_100000765111_200025704644 [0,0,0,0,0,1|2,0,1]=4 448 B9R1.15 Cc1cnccc1S[13CH3] 62a_200025704644_100000765111 [0,0,0,0,0,1|2,0,1]=4 449 B9R1.15 Cc1cncnc1S[13CH3] 62a_100011998708_200025704644 [0,0,0,0,0,1|2,0,1]=4 450 B9R1.15 Cc1cncnc1S[13CH3] 62a_200025704644_100011998708 [0,0,0,0,0,1|2,0,1]=4 451 B9R1.15 Cc1ncccc1O[13CH3] 34a_100000745507_200025704644 [0,0,0,0,0,1|2,0,1]=4 452 B9R1.15 Cc1ncccc1O[13CH3] 7a_100000745507_200025704644 [0,0,0,0,0,1|2,0,1]=4 453 B9R1.15 Cc1ncccc1S[13CH3] 62a_100000751574_200025704644 [0,0,0,0,0,1|2,0,1]=4 454 B9R1.15 Cc1ncccc1S[13CH3] 62a_200025704644_100000751574 [0,0,0,0,0,1|2,0,1]=4 455 B9R1.15 Cc1nccnc1O[13CH3] 34a_100000766352_200025704644 [0,0,0,0,0,1|2,0,1]=4 456 B9R1.15 Cc1nccnc1S[13CH3] 62a_100011999405_200025704644 [0,0,0,0,0,1|2,0,1]=4 457 B9R1.15 Cc1nccnc1S[13CH3] 62a_200025704644_100011999405 [0,0,0,0,0,1|2,0,1]=4 458 B9R1.15 Cc1ncncc1S[13CH3] 62a_100009819671_200025704644 [0,0,0,0,0,1|2,0,1]=4 459 B9R1.15 Cc1ncncc1S[13CH3] 62a_200025704644_100009819671 [0,0,0,0,0,1|2,0,1]=4 460 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [0,0,0,0,0,1|3,0,0]=4 461 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [0,0,0,0,0,1|3,0,0]=4 462 B6R1.2 Oc1c[nH]cn1 271570a_203496583355_100000756875 [2,0,0,0,0,0|2,0,0]=4 463 B6R1.2 Oc1cccs1 271570a_203496583355_100011215356 [2,0,0,0,0,0|2,0,0]=4 464 B6R1.2 Oc1ccsc1 271570a_203496583355_100000738268 [2,0,0,0,0,0|2,0,0]=4 465 B6R1.2 Oc1cnco1 271570a_203496583355_100020591547 [2,0,0,0,0,0|1,1,0]=4 466 B6R1.2 Oc1cncs1 271570a_203496583355_100011934649 [2,0,0,0,0,0|1,0,0]=3 467 B6R1.2 Oc1cscn1 271570a_203496583355_100000751502 [2,0,0,0,0,0|1,0,0]=3 468 B6R1.2 Oc1nncs1 271570a_203496583355_100000739804 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.1 C=Cc1c[nH]c(n1)C 271570a_100011290941_100009814057 [1,1,0,0,0,0|1,0,1]=4 470 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,1,0,0,0,0|1,0,0]=3 471 B8R1.1 C=Cc1cc(n[nH]1)Br 271570a_100011290941_100160470719 [1,1,0,0,0,0|2,0,0]=4 472 B8R1.1 C=Cc1cc(ns1)C 271570a_100011290941_100009815735 [1,1,0,0,0,0|2,0,0]=4 473 B8R1.1 C=Cc1ccc(s1)Br 271570a_100011290941_100010197418 [1,1,0,0,0,0|1,0,0]=3 474 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,1,0,0,0,0|1,0,0]=3 475 B8R1.1 C=Cc1cn(cn1)C 271570a_100011290941_100000040308 [1,1,0,0,0,0|1,0,1]=4 476 B8R1.1 C=Cc1cnc(s1)C 271570a_100011290941_100000764884 [1,1,0,0,0,0|0,0,0]=2 477 B8R1.1 C=Cc1cnn(c1)C 271570a_100011290941_100000748075 [1,1,0,0,0,0|2,0,0]=4 478 B8R1.1 C=Cc1cnn(n1)C 271570a_100011290941_100000733932 [1,1,0,0,0,0|2,0,0]=4 479 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,1,0,0,0,0|2,0,0]=4 480 B8R1.1 C=Cc1csc(n1)C 271570a_100011290941_100011934587 [1,1,0,0,0,0|2,0,0]=4 481 B8R1.1 C=Cc1csc(n1)N 271570a_100011290941_100011998049 [1,1,0,0,0,0|2,0,0]=4 482 B8R1.1 C=Cc1nc(cs1)Br 271570a_100011290941_200016082925 [1,1,0,0,0,0|2,0,0]=4 483 B8R1.1 C=Cc1nc(cs1)C 271570a_100011290941_100011291629 [1,1,0,0,0,0|2,0,0]=4 484 B8R1.1 C=Cc1nc(cs1)N 271570a_100011290941_200015188442 [1,1,0,0,0,0|2,0,0]=4 485 B8R1.1 C=Cc1nc(ns1)C 271570a_100011290941_100000709739 [1,1,0,0,0,0|2,0,0]=4 486 B8R1.1 C=Cc1ncc(s1)C 271570a_100011290941_100000690809 [1,1,0,0,0,0|2,0,0]=4 487 B8R1.1 C=Cc1nnc(o1)C 271570a_100011290941_100000708914 [1,1,0,0,0,0|1,1,0]=4 488 B8R1.1 C=Cc1nnc(s1)C 271570a_100011290941_100000686958 [1,1,0,0,0,0|1,0,0]=3 489 B8R1.1 C=Cc1nnc(s1)N 271570a_100011290941_100000738278 [1,1,0,0,0,0|1,0,0]=3 490 B8R1.1 CSc1cnc(s1)Br 62a_100012357534_200000210301 [1,1,0,0,0,0|1,0,1]=4 491 B8R1.1 CSc1cnc(s1)Br 62a_200000210301_100012357534 [1,1,0,0,0,0|1,0,1]=4 492 B8R1.1 CSc1cnc(s1)C 62a_100000764884_200000210301 [1,1,0,0,0,0|1,0,1]=4 493 B8R1.1 CSc1cnc(s1)C 62a_200000210301_100000764884 [1,1,0,0,0,0|1,0,1]=4 494 B8R1.1 CSc1cnc(s1)N 62a_100000718969_200000210301 [1,1,0,0,0,0|1,0,1]=4 495 B8R1.1 CSc1cnc(s1)N 62a_200000210301_100000718969 [1,1,0,0,0,0|1,0,1]=4 496 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_100000764884_200025704644 [1,1,0,0,0,0|1,0,1]=4 497 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_200025704644_100000764884 [1,1,0,0,0,0|1,0,1]=4 498 B8R1.1 N#Cc1cnc(s1)O 271570a_203496583355_100009819632 [1,1,0,0,0,0|1,0,1]=4 499 B8R1.1 NCc1cnc(s1)O 271570a_203496583355_100000726991 [1,1,0,0,0,0|1,0,1]=4 500 B8R1.1 O=Cc1cc(cs1)O 271570a_203496583355_100000211722 [1,1,0,0,0,0|2,0,0]=4 501 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,1,0,0,0,0|2,0,0]=4 502 B8R1.1 O=Cc1cnc(s1)O 271570a_203496583355_100009814069 [1,1,0,0,0,0|1,0,0]=3 503 B8R1.1 OCc1cnc(s1)O 271570a_203496583355_100009816753 [1,1,0,0,0,0|1,0,1]=4 504 B8R1.1 [13CH3]Sc1cnc(s1)Br 62a_100012357534_200025704644 [1,1,0,0,0,0|1,0,1]=4 505 B8R1.1 [13CH3]Sc1cnc(s1)Br 62a_200025704644_100012357534 [1,1,0,0,0,0|1,0,1]=4 506 B8R1.1 [13CH3]Sc1cnc(s1)N 62a_100000718969_200025704644 [1,1,0,0,0,0|1,0,1]=4 507 B8R1.1 [13CH3]Sc1cnc(s1)N 62a_200025704644_100000718969 [1,1,0,0,0,0|1,0,1]=4 508 B8R1.7 C=C(C)c1c[nH]cn1 271570a_100000694244_100000756875 [1,1,0,0,0,0|1,0,1]=4 509 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [1,1,0,0,0,0|1,1,0]=4 510 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,1,0,0,0,0|1,0,0]=3 511 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,1,0,0,0,0|2,0,0]=4 512 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,1,0,0,0,0|2,0,0]=4 513 B8R1.7 C=C(C)c1cn[nH]c1 271570a_100000694244_100000238712 [1,1,0,0,0,0|2,0,0]=4 514 B8R1.7 C=C(C)c1cnco1 271570a_100000694244_100020591547 [1,1,0,0,0,0|0,1,0]=3 515 B8R1.7 C=C(C)c1cncs1 271570a_100000694244_100011934649 [1,1,0,0,0,0|0,0,0]=2 516 B8R1.7 C=C(C)c1cnoc1 271570a_100000694244_100009815712 [1,1,0,0,0,0|2,0,0]=4 517 B8R1.7 C=C(C)c1cnsc1 271570a_100000694244_100009815736 [1,1,0,0,0,0|2,0,0]=4 518 B8R1.7 C=C(C)c1cscn1 271570a_100000694244_100000751502 [1,1,0,0,0,0|2,0,0]=4 519 B8R1.7 C=C(C)c1nccs1 271570a_100000694244_100000211983 [1,1,0,0,0,0|2,0,0]=4 520 B8R1.7 C=C(C)c1ncns1 271570a_100000694244_100000693119 [1,1,0,0,0,0|2,0,0]=4 521 B8R1.7 C=C(C)c1nncs1 271570a_100000694244_100000739804 [1,1,0,0,0,0|1,0,0]=3 522 B8R1.8 C=C=Cc1c[nH]cn1 271570a_100015277604_100000756875 [1,1,0,0,0,0|1,0,1]=4 523 B8R1.8 C=C=Cc1ccco1 271570a_100015277604_100009814098 [1,1,0,0,0,0|1,1,0]=4 524 B8R1.8 C=C=Cc1cccs1 271570a_100015277604_100011215356 [1,1,0,0,0,0|1,0,0]=3 525 B8R1.8 C=C=Cc1ccoc1 271570a_100015277604_100011215275 [1,1,0,0,0,0|2,0,0]=4 526 B8R1.8 C=C=Cc1ccsc1 271570a_100015277604_100000738268 [1,1,0,0,0,0|2,0,0]=4 527 B8R1.8 C=C=Cc1cn[nH]c1 271570a_100015277604_100000238712 [1,1,0,0,0,0|2,0,0]=4 528 B8R1.8 C=C=Cc1cnco1 271570a_100015277604_100020591547 [1,1,0,0,0,0|0,1,0]=3 529 B8R1.8 C=C=Cc1cncs1 271570a_100015277604_100011934649 [1,1,0,0,0,0|0,0,0]=2 530 B8R1.8 C=C=Cc1cnoc1 271570a_100015277604_100009815712 [1,1,0,0,0,0|2,0,0]=4 531 B8R1.8 C=C=Cc1cnsc1 271570a_100015277604_100009815736 [1,1,0,0,0,0|2,0,0]=4 532 B8R1.8 C=C=Cc1cscn1 271570a_100015277604_100000751502 [1,1,0,0,0,0|2,0,0]=4 533 B8R1.8 C=C=Cc1nccs1 271570a_100015277604_100000211983 [1,1,0,0,0,0|2,0,0]=4 534 B8R1.8 C=C=Cc1ncns1 271570a_100015277604_100000693119 [1,1,0,0,0,0|2,0,0]=4 535 B8R1.8 C=C=Cc1nncs1 271570a_100015277604_100000739804 [1,1,0,0,0,0|1,0,0]=3 536 B8R1.8 CC=Cc1c[nH]cn1 271570a_100016259895_100000756875 [1,1,0,0,0,0|1,0,1]=4 537 B8R1.8 CC=Cc1ccco1 271570a_100016259895_100009814098 [1,1,0,0,0,0|1,1,0]=4 538 B8R1.8 CC=Cc1cccs1 271570a_100016259895_100011215356 [1,1,0,0,0,0|1,0,0]=3 539 B8R1.8 CC=Cc1ccoc1 271570a_100016259895_100011215275 [1,1,0,0,0,0|2,0,0]=4 540 B8R1.8 CC=Cc1ccsc1 271570a_100016259895_100000738268 [1,1,0,0,0,0|2,0,0]=4 541 B8R1.8 CC=Cc1cn[nH]c1 271570a_100016259895_100000238712 [1,1,0,0,0,0|2,0,0]=4 542 B8R1.8 CC=Cc1cnco1 271570a_100016259895_100020591547 [1,1,0,0,0,0|0,1,0]=3 543 B8R1.8 CC=Cc1cncs1 271570a_100016259895_100011934649 [1,1,0,0,0,0|0,0,0]=2 544 B8R1.8 CC=Cc1cnoc1 271570a_100016259895_100009815712 [1,1,0,0,0,0|2,0,0]=4 545 B8R1.8 CC=Cc1cnsc1 271570a_100016259895_100009815736 [1,1,0,0,0,0|2,0,0]=4 546 B8R1.8 CC=Cc1cscn1 271570a_100016259895_100000751502 [1,1,0,0,0,0|2,0,0]=4 547 B8R1.8 CC=Cc1nccs1 271570a_100016259895_100000211983 [1,1,0,0,0,0|2,0,0]=4 548 B8R1.8 CC=Cc1ncns1 271570a_100016259895_100000693119 [1,1,0,0,0,0|2,0,0]=4 549 B8R1.8 CC=Cc1nncs1 271570a_100016259895_100000739804 [1,1,0,0,0,0|1,0,0]=3 550 B8R1.8 CCSc1cncs1 62a_100000210202_100011934649 [1,1,0,0,0,0|0,0,2]=4 551 B8R1.8 CCSc1cncs1 62a_100011934649_100000210202 [1,1,0,0,0,0|0,0,2]=4 552 B8R1.8 CNCc1cncs1 207a_100102657272_100000749870 [1,1,0,0,0,0|0,0,2]=4 553 B8R1.8 CNCc1cncs1 2230a_100016987365_200000210301 [1,1,0,0,0,0|0,0,2]=4 554 B8R1.8 CNCc1cncs1 2230a_106832991635_100015185245 [1,1,0,0,0,0|0,0,2]=4 555 B8R1.8 CNCc1cncs1 270004a_106832991635_100000749870 [1,1,0,0,0,0|0,0,2]=4 556 B8R1.8 CNCc1cncs1 34a_100102657272_100015185245 [1,1,0,0,0,0|0,0,2]=4 557 B8R1.8 CNCc1cncs1 7a_106832991635_100015185245 [1,1,0,0,0,0|0,0,2]=4 558 B8R1.8 COCc1cncs1 34a_100138415774_100015185245 [1,1,0,0,0,0|0,0,2]=4 559 B8R1.8 CSCc1cncs1 62a_100015185245_200000210301 [1,1,0,0,0,0|0,0,2]=4 560 B8R1.8 CSCc1cncs1 62a_200000210301_100015185245 [1,1,0,0,0,0|0,0,2]=4 561 B8R1.8 FCSc1cncs1 62a_100011934649_100015361967 [1,1,0,0,0,0|1,0,1]=4 562 B8R1.8 FCSc1cncs1 62a_100015361967_100011934649 [1,1,0,0,0,0|1,0,1]=4 563 B8R1.8 [13CH3]NCc1cncs1 2230a_100016987365_200025704644 [1,1,0,0,0,0|0,0,2]=4 564 B8R1.8 [13CH3]SCc1cncs1 62a_100015185245_200025704644 [1,1,0,0,0,0|0,0,2]=4 565 B8R1.8 [13CH3]SCc1cncs1 62a_200025704644_100015185245 [1,1,0,0,0,0|0,0,2]=4 566 B8R1.18 Cc1cc(c(s1)O)C 271570a_203496583355_100000689295 [1,1,0,0,0,0|2,0,0]=4 567 B8R1.18 Cc1cc(sc1C)O 271570a_203496583355_100009850898 [1,1,0,0,0,0|1,0,1]=4 568 B8R1.18 Cc1nc(c(s1)C)O 271570a_203496583355_100010270876 [1,1,0,0,0,0|1,0,1]=4 569 B8R1.18 Cc1nc(c(s1)O)C 271570a_203496583355_100009814099 [1,1,0,0,0,0|1,0,0]=3 570 B8R1.18 Cc1nc(sc1C)O 271570a_203496583355_100000765934 [1,1,0,0,0,0|0,0,1]=3 571 B8R1.18 Cc1sc(nc1O)N 271570a_203496583355_100009817509 [1,1,0,0,0,0|1,0,1]=4 572 B8R1.50 Cc1scc(c1C)O 271570a_203496583355_100009820295 [1,1,0,0,0,0|1,0,1]=4 573 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [0,1,0,0,0,1|2,0,0]=4 574 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [0,1,0,0,0,1|2,0,0]=4 575 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [0,1,0,0,0,1|2,0,0]=4 576 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [0,1,0,0,0,1|2,0,0]=4 577 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [0,1,0,0,0,1|2,0,0]=4 578 B10R1.2 C=Cc1ccnc(c1C)C 271570a_100011290941_100009846815 [0,1,0,0,0,1|1,0,0]=3 579 B10R1.2 C=Cc1ccnc(c1C)Cl 271570a_100011290941_100000047055 [0,1,0,0,0,1|2,0,0]=4 580 B10R1.2 C=Cc1ccnc(c1C)F 271570a_100011290941_100010006593 [0,1,0,0,0,1|2,0,0]=4 581 B10R1.2 C=Cc1ccnc(c1C)N 271570a_100011290941_100009865460 [0,1,0,0,0,1|2,0,0]=4 582 B10R1.2 C=Cc1ccnc(c1C)O 271570a_100011290941_100009858498 [0,1,0,0,0,1|2,0,0]=4 583 B10R1.2 C=Cc1ccnc(c1Cl)C 271570a_100011290941_100000698670 [0,1,0,0,0,1|1,0,0]=3 584 B10R1.2 C=Cc1ccnc(c1Cl)Cl 271570a_100011290941_100010246212 [0,1,0,0,0,1|2,0,0]=4 585 B10R1.2 C=Cc1ccnc(c1Cl)F 271570a_100011290941_100010067886 [0,1,0,0,0,1|2,0,0]=4 586 B10R1.2 C=Cc1ccnc(c1Cl)N 271570a_100011290941_100010735111 [0,1,0,0,0,1|2,0,0]=4 587 B10R1.2 C=Cc1ccnc(c1F)Br 271570a_100011290941_200015269031 [0,1,0,0,0,1|2,0,0]=4 588 B10R1.2 C=Cc1ccnc(c1F)C 271570a_100011290941_100009849794 [0,1,0,0,0,1|1,0,0]=3 589 B10R1.2 C=Cc1ccnc(c1F)Cl 271570a_100011290941_100010150473 [0,1,0,0,0,1|2,0,0]=4 590 B10R1.2 C=Cc1ccnc(c1F)F 271570a_100011290941_100010214882 [0,1,0,0,0,1|2,0,0]=4 591 B10R1.2 C=Cc1ccnc(c1F)N 271570a_100011290941_100010077785 [0,1,0,0,0,1|2,0,0]=4 592 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [0,1,0,0,0,1|1,0,0]=3 593 B10R1.2 C=Cc1ccnc(c1N)N 271570a_100011290941_100000124095 [0,1,0,0,0,1|2,0,0]=4 594 B10R1.2 C=Cc1nccc(c1C)C 271570a_100011290941_100009847204 [0,1,0,0,0,1|2,0,0]=4 595 B10R1.2 C=Cc1nccc(c1F)C 271570a_100011290941_100009817629 [0,1,0,0,0,1|2,0,0]=4 596 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [0,1,0,0,0,1|2,0,0]=4 597 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [0,1,0,0,0,1|2,0,0]=4 598 B10R1.2 C=Cc1ncnc(c1C)C 271570a_100011290941_100011438038 [0,1,0,0,0,1|1,0,0]=3 599 B10R1.2 C=Cc1ncnc(c1C)N 271570a_100011290941_100011913465 [0,1,0,0,0,1|2,0,0]=4 600 B10R1.2 C=Cc1ncnc(c1C)O 271570a_100011290941_100011912821 [0,1,0,0,0,1|2,0,0]=4 601 B10R1.2 C=Cc1ncnc(c1F)C 271570a_100011290941_100011671633 [0,1,0,0,0,1|1,0,0]=3 602 B10R1.2 C=Cc1ncnc(c1F)N 271570a_100011290941_100000126652 [0,1,0,0,0,1|2,0,0]=4 603 B10R1.2 C=Cc1ncnc(c1N)N 271570a_100011290941_100000766367 [0,1,0,0,0,1|2,0,0]=4 604 B10R1.2 C=Cc1ncnc(c1N)O 271570a_100011290941_100011795086 [0,1,0,0,0,1|2,0,0]=4 605 B10R1.8 C=Cc1cc([nH]c(=O)c1)C 271570a_100011290941_100009861981 [0,1,0,0,0,1|1,0,1]=4 606 B10R1.8 C=Cc1cc(cc(c1)C)C 271570a_100011290941_100011215608 [0,1,0,0,0,1|2,0,0]=4 607 B10R1.8 C=Cc1cc(cc(c1)Cl)C 271570a_100011290941_100010172791 [0,1,0,0,0,1|2,0,0]=4 608 B10R1.8 C=Cc1cc(cc(c1)F)C 271570a_100011290941_100011356977 [0,1,0,0,0,1|2,0,0]=4 609 B10R1.8 C=Cc1cc(cc(c1)N)C 271570a_100011290941_100000695972 [0,1,0,0,0,1|2,0,0]=4 610 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [0,1,0,0,0,1|2,0,0]=4 611 B10R1.8 C=Cc1cc(cc(n1)C)C 271570a_100011290941_100000069240 [0,1,0,0,0,1|2,0,0]=4 612 B10R1.8 C=Cc1cc(cc(n1)F)C 271570a_100011290941_100009819601 [0,1,0,0,0,1|2,0,0]=4 613 B10R1.8 C=Cc1cc(cc(n1)N)C 271570a_100011290941_100009819863 [0,1,0,0,0,1|2,0,0]=4 614 B10R1.8 C=Cc1cc(nc(c1)C)C 271570a_100011290941_100009816552 [0,1,0,0,0,1|1,0,0]=3 615 B10R1.8 C=Cc1cc(nc(c1)F)C 271570a_100011290941_100010006595 [0,1,0,0,0,1|1,0,0]=3 616 B10R1.8 C=Cc1cc(nc(c1)F)F 271570a_100011290941_100000049587 [0,1,0,0,0,1|2,0,0]=4 617 B10R1.8 C=Cc1cc(nc(c1)N)C 271570a_100011290941_100000076705 [0,1,0,0,0,1|1,0,0]=3 618 B10R1.8 C=Cc1cc(nc(c1)N)N 271570a_100011290941_100009816676 [0,1,0,0,0,1|2,0,0]=4 619 B10R1.8 C=Cc1cc(nc(n1)C)C 271570a_100011290941_100000736142 [0,1,0,0,0,1|1,0,0]=3 620 B10R1.8 C=Cc1cc(nc(n1)C)N 271570a_100011290941_100012178882 [0,1,0,0,0,1|1,0,0]=3 621 B10R1.8 C=Cc1cc(nc(n1)C)O 271570a_100011290941_106741647437 [0,1,0,0,0,1|1,0,0]=3 622 B10R1.8 C=Cc1cc(nc(n1)N)C 271570a_100011290941_100000183061 [0,1,0,0,0,1|1,0,0]=3 623 B10R1.8 C=Cc1cc(nc(n1)N)N 271570a_100011290941_100011177858 [0,1,0,0,0,1|2,0,0]=4 624 B10R1.8 C=Cc1cc(nc(n1)N)O 271570a_100011290941_100000694715 [0,1,0,0,0,1|2,0,0]=4 625 B10R1.8 C=Cc1nc(cc(n1)C)C 271570a_100011290941_100000736147 [0,1,0,0,0,1|2,0,0]=4 626 B10R1.8 C=Cc1nc(cc(n1)N)C 271570a_100011290941_100000687285 [0,1,0,0,0,1|2,0,0]=4 627 B10R1.8 C=Cc1nc(nc(n1)C)C 271570a_100011290941_100015468570 [0,1,0,0,0,1|1,0,0]=3 628 B10R1.8 C=Cc1nc(nc(n1)N)C 271570a_100011290941_200012022553 [0,1,0,0,0,1|1,0,0]=3 629 B10R1.10 C=C=Cc1cc(ccn1)C 271570a_100015277604_100000750283 [0,1,0,0,0,1|2,0,0]=4 630 B10R1.10 C=C=Cc1cc(ncn1)C 271570a_100015277604_100000744208 [0,1,0,0,0,1|1,0,0]=3 631 B10R1.10 C=C=Cc1cc(ncn1)F 271570a_100015277604_200009880791 [0,1,0,0,0,1|2,0,0]=4 632 B10R1.10 C=C=Cc1cc(ncn1)N 271570a_100015277604_100000701291 [0,1,0,0,0,1|2,0,0]=4 633 B10R1.10 C=C=Cc1cc(ncn1)O 271570a_100015277604_100000765262 [0,1,0,0,0,1|2,0,0]=4 634 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [0,1,0,0,0,1|2,0,0]=4 635 B10R1.10 C=C=Cc1cccc(n1)C 271570a_100015277604_100000742759 [0,1,0,0,0,1|2,0,0]=4 636 B10R1.10 C=C=Cc1ccnc(c1)Br 271570a_100015277604_100009814637 [0,1,0,0,0,1|2,0,0]=4 637 B10R1.10 C=C=Cc1ccnc(c1)C 271570a_100015277604_100000758586 [0,1,0,0,0,1|1,0,0]=3 638 B10R1.10 C=C=Cc1ccnc(c1)Cl 271570a_100015277604_100000035001 [0,1,0,0,0,1|2,0,0]=4 639 B10R1.10 C=C=Cc1ccnc(c1)F 271570a_100015277604_100009816116 [0,1,0,0,0,1|2,0,0]=4 640 B10R1.10 C=C=Cc1ccnc(c1)N 271570a_100015277604_100000744379 [0,1,0,0,0,1|2,0,0]=4 641 B10R1.10 C=C=Cc1ccnc(n1)C 271570a_100015277604_100000749937 [0,1,0,0,0,1|1,0,0]=3 642 B10R1.10 C=C=Cc1ccnc(n1)N 271570a_100015277604_100009820717 [0,1,0,0,0,1|2,0,0]=4 643 B10R1.10 C=C=Cc1nccc(n1)C 271570a_100015277604_100011243806 [0,1,0,0,0,1|2,0,0]=4 644 B10R1.10 C=C=Cc1ncnc(n1)N 271570a_100015277604_100000123831 [0,1,0,0,0,1|2,0,0]=4 645 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [0,1,0,0,0,1|2,0,0]=4 646 B10R1.10 CC=Cc1cc(ncn1)C 271570a_100016259895_100000744208 [0,1,0,0,0,1|1,0,0]=3 647 B10R1.10 CC=Cc1cc(ncn1)F 271570a_100016259895_200009880791 [0,1,0,0,0,1|2,0,0]=4 648 B10R1.10 CC=Cc1cc(ncn1)N 271570a_100016259895_100000701291 [0,1,0,0,0,1|2,0,0]=4 649 B10R1.10 CC=Cc1cc(ncn1)O 271570a_100016259895_100000765262 [0,1,0,0,0,1|2,0,0]=4 650 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [0,1,0,0,0,1|2,0,0]=4 651 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [0,1,0,0,0,1|2,0,0]=4 652 B10R1.10 CC=Cc1ccnc(c1)Br 271570a_100016259895_100009814637 [0,1,0,0,0,1|2,0,0]=4 653 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [0,1,0,0,0,1|1,0,0]=3 654 B10R1.10 CC=Cc1ccnc(c1)Cl 271570a_100016259895_100000035001 [0,1,0,0,0,1|2,0,0]=4 655 B10R1.10 CC=Cc1ccnc(c1)F 271570a_100016259895_100009816116 [0,1,0,0,0,1|2,0,0]=4 656 B10R1.10 CC=Cc1ccnc(c1)N 271570a_100016259895_100000744379 [0,1,0,0,0,1|2,0,0]=4 657 B10R1.10 CC=Cc1ccnc(n1)C 271570a_100016259895_100000749937 [0,1,0,0,0,1|1,0,0]=3 658 B10R1.10 CC=Cc1ccnc(n1)N 271570a_100016259895_100009820717 [0,1,0,0,0,1|2,0,0]=4 659 B10R1.10 CC=Cc1nccc(n1)C 271570a_100016259895_100011243806 [0,1,0,0,0,1|2,0,0]=4 660 B10R1.10 CC=Cc1ncnc(n1)N 271570a_100016259895_100000123831 [0,1,0,0,0,1|2,0,0]=4 661 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [0,1,0,0,0,1|2,0,0]=4 662 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [0,1,0,0,0,1|2,0,0]=4 663 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [0,1,0,0,0,1|2,0,0]=4 664 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [0,1,0,0,0,1|2,0,0]=4 665 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [0,1,0,0,0,1|2,0,0]=4 666 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [0,1,0,0,0,1|2,0,0]=4 667 B10R1.30 C=Cc1cc(n[nH]c1=O)C 271570a_100011290941_100009819039 [0,1,0,0,0,1|2,0,0]=4 668 B10R1.30 C=Cc1cc(ncc1Br)Br 271570a_100011290941_100010171693 [0,1,0,0,0,1|2,0,0]=4 669 B10R1.30 C=Cc1cc(ncc1Br)Cl 271570a_100011290941_100009815598 [0,1,0,0,0,1|2,0,0]=4 670 B10R1.30 C=Cc1cc(ncc1C)Br 271570a_100011290941_100010067628 [0,1,0,0,0,1|2,0,0]=4 671 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [0,1,0,0,0,1|1,0,0]=3 672 B10R1.30 C=Cc1cc(ncc1C)Cl 271570a_100011290941_100010068021 [0,1,0,0,0,1|2,0,0]=4 673 B10R1.30 C=Cc1cc(ncc1C)F 271570a_100011290941_100000049870 [0,1,0,0,0,1|2,0,0]=4 674 B10R1.30 C=Cc1cc(ncc1C)N 271570a_100011290941_100009819938 [0,1,0,0,0,1|2,0,0]=4 675 B10R1.30 C=Cc1cc(ncc1C)O 271570a_100011290941_100009831917 [0,1,0,0,0,1|2,0,0]=4 676 B10R1.30 C=Cc1cc(ncc1Cl)Br 271570a_100011290941_100010223331 [0,1,0,0,0,1|2,0,0]=4 677 B10R1.30 C=Cc1cc(ncc1Cl)Cl 271570a_100011290941_100010172835 [0,1,0,0,0,1|2,0,0]=4 678 B10R1.30 C=Cc1cc(ncc1Cl)F 271570a_100011290941_100009892587 [0,1,0,0,0,1|2,0,0]=4 679 B10R1.30 C=Cc1cc(ncc1Cl)N 271570a_100011290941_100010134119 [0,1,0,0,0,1|2,0,0]=4 680 B10R1.30 C=Cc1cc(ncc1F)Br 271570a_100011290941_100010193852 [0,1,0,0,0,1|2,0,0]=4 681 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [0,1,0,0,0,1|1,0,0]=3 682 B10R1.30 C=Cc1cc(ncc1F)Cl 271570a_100011290941_100000708277 [0,1,0,0,0,1|2,0,0]=4 683 B10R1.30 C=Cc1cc(ncc1F)F 271570a_100011290941_100010233071 [0,1,0,0,0,1|2,0,0]=4 684 B10R1.30 C=Cc1cc(ncc1F)N 271570a_100011290941_100015713587 [0,1,0,0,0,1|2,0,0]=4 685 B10R1.30 C=Cc1cc(ncc1N)Cl 271570a_100011290941_100000050123 [0,1,0,0,0,1|2,0,0]=4 686 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [0,1,0,0,0,1|1,0,0]=3 687 B10R1.30 C=Cc1cc(ncc1O)Cl 271570a_100011290941_100000698892 [0,1,0,0,0,1|2,0,0]=4 688 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [0,1,0,0,0,1|2,0,0]=4 689 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [0,1,0,0,0,1|2,0,0]=4 690 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [0,1,0,0,0,1|2,0,0]=4 691 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [0,1,0,0,0,1|2,0,0]=4 692 B10R1.30 C=Cc1nc(ncc1C)N 271570a_100011290941_100000016107 [0,1,0,0,0,1|2,0,0]=4 693 B10R1.30 C=Cc1nc(ncc1F)C 271570a_100011290941_100000059819 [0,1,0,0,0,1|1,0,0]=3 694 B10R1.30 C=Cc1nc(ncc1F)N 271570a_100011290941_200000093006 [0,1,0,0,0,1|2,0,0]=4 695 B10R1.30 C=Cc1nc(ncc1N)C 271570a_100011290941_100009873743 [0,1,0,0,0,1|1,0,0]=3 696 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [0,1,0,0,0,1|2,0,0]=4 697 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [0,1,0,0,0,1|1,0,0]=3 698 B10R1.113 C=C(C)c1cc(ncn1)F 271570a_100000694244_200009880791 [0,1,0,0,0,1|2,0,0]=4 699 B10R1.113 C=C(C)c1cc(ncn1)N 271570a_100000694244_100000701291 [0,1,0,0,0,1|2,0,0]=4 700 B10R1.113 C=C(C)c1cc(ncn1)O 271570a_100000694244_100000765262 [0,1,0,0,0,1|2,0,0]=4 701 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [0,1,0,0,0,1|2,0,0]=4 702 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [0,1,0,0,0,1|2,0,0]=4 703 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [0,1,0,0,0,1|2,0,0]=4 704 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [0,1,0,0,0,1|1,0,0]=3 705 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [0,1,0,0,0,1|2,0,0]=4 706 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [0,1,0,0,0,1|2,0,0]=4 707 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [0,1,0,0,0,1|2,0,0]=4 708 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [0,1,0,0,0,1|1,0,0]=3 709 B10R1.113 C=C(C)c1ccnc(n1)N 271570a_100000694244_100009820717 [0,1,0,0,0,1|2,0,0]=4 710 B10R1.113 C=C(C)c1nccc(n1)C 271570a_100000694244_100011243806 [0,1,0,0,0,1|2,0,0]=4 711 B10R1.113 C=C(C)c1ncnc(n1)N 271570a_100000694244_100000123831 [0,1,0,0,0,1|2,0,0]=4 712 B10R1.172 C=Cc1cc(ccn1)CC 271570a_100011290941_100009817561 [0,1,0,0,0,1|2,0,0]=4 713 B10R1.172 C=Cc1cc(ccn1)CO 271570a_100011290941_100009814636 [0,1,0,0,0,1|2,0,0]=4 714 B10R1.172 C=Cc1cc(ccn1)NC 271570a_100011290941_100009869472 [0,1,0,0,0,1|2,0,0]=4 715 B10R1.172 C=Cc1cc(ccn1)OC 271570a_100011290941_100011216251 [0,1,0,0,0,1|2,0,0]=4 716 B10R1.172 C=Cc1cc(ccn1)SC 271570a_100011290941_100010883326 [0,1,0,0,0,1|2,0,0]=4 717 B10R1.172 C=Cc1cc(ccn1)SC 62a_100009845566_200000210301 [0,1,0,0,0,1|2,0,0]=4 718 B10R1.172 C=Cc1cc(ccn1)SC 62a_200000210301_100009845566 [0,1,0,0,0,1|2,0,0]=4 719 B10R1.172 C=Cc1cc(ccn1)S[13CH3] 62a_100009845566_200025704644 [0,1,0,0,0,1|2,0,0]=4 720 B10R1.172 C=Cc1cc(ccn1)S[13CH3] 62a_200025704644_100009845566 [0,1,0,0,0,1|2,0,0]=4 721 B10R1.172 C=Cc1cc(ncn1)C#N 271570a_100011290941_100000092509 [0,1,0,0,0,1|1,0,1]=4 722 B10R1.172 C=Cc1cc(ncn1)CC 271570a_100011290941_100000744278 [0,1,0,0,0,1|1,0,0]=3 723 B10R1.172 C=Cc1cc(ncn1)CO 271570a_100011290941_100000731546 [0,1,0,0,0,1|1,0,0]=3 724 B10R1.172 C=Cc1cc(ncn1)NC 271570a_100011290941_100000756605 [0,1,0,0,0,1|1,0,0]=3 725 B10R1.172 C=Cc1cc(ncn1)NN 271570a_100011290941_100000242035 [0,1,0,0,0,1|2,0,0]=4 726 B10R1.172 C=Cc1cc(ncn1)OC 271570a_100011290941_100012187182 [0,1,0,0,0,1|1,0,0]=3 727 B10R1.172 C=Cc1cc(ncn1)SC 271570a_100011290941_100011443430 [0,1,0,0,0,1|1,0,0]=3 728 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [0,1,0,0,0,1|2,0,0]=4 729 B10R1.172 C=Cc1cccc(c1)CF 271570a_100011290941_100010878472 [0,1,0,0,0,1|2,0,0]=4 730 B10R1.172 C=Cc1cccc(c1)CN 271570a_100011290941_100000106179 [0,1,0,0,0,1|2,0,0]=4 731 B10R1.172 C=Cc1cccc(c1)CO 271570a_100011290941_100000687537 [0,1,0,0,0,1|2,0,0]=4 732 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [0,1,0,0,0,1|2,0,0]=4 733 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [0,1,0,0,0,1|2,0,0]=4 734 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [0,1,0,0,0,1|2,0,0]=4 735 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [0,1,0,0,0,1|2,0,0]=4 736 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [0,1,0,0,0,1|2,0,0]=4 737 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [0,1,0,0,0,1|2,0,0]=4 738 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [0,1,0,0,0,1|2,0,0]=4 739 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [0,1,0,0,0,1|2,0,0]=4 740 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [0,1,0,0,0,1|2,0,0]=4 741 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [0,1,0,0,0,1|2,0,0]=4 742 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [0,1,0,0,0,1|2,0,0]=4 743 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [0,1,0,0,0,1|2,0,0]=4 744 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [0,1,0,0,0,1|2,0,0]=4 745 B10R1.172 C=Cc1cccc(n1)CC 271570a_100011290941_100009856026 [0,1,0,0,0,1|2,0,0]=4 746 B10R1.172 C=Cc1cccc(n1)CN 271570a_100011290941_100016990191 [0,1,0,0,0,1|2,0,0]=4 747 B10R1.172 C=Cc1cccc(n1)CO 271570a_100011290941_100000694195 [0,1,0,0,0,1|2,0,0]=4 748 B10R1.172 C=Cc1cccc(n1)NC 271570a_100011290941_100000703281 [0,1,0,0,0,1|2,0,0]=4 749 B10R1.172 C=Cc1cccc(n1)OC 271570a_100011290941_100000760917 [0,1,0,0,0,1|2,0,0]=4 750 B10R1.172 C=Cc1cccc(n1)SC 271570a_100011290941_100011960944 [0,1,0,0,0,1|2,0,0]=4 751 B10R1.172 C=Cc1ccnc(c1)C#N 271570a_100011290941_100000685610 [0,1,0,0,0,1|1,0,1]=4 752 B10R1.172 C=Cc1ccnc(c1)C=O 271570a_100011290941_100011998288 [0,1,0,0,0,1|1,0,1]=4 753 B10R1.172 C=Cc1ccnc(c1)CC 271570a_100011290941_100009820011 [0,1,0,0,0,1|1,0,0]=3 754 B10R1.172 C=Cc1ccnc(c1)CN 271570a_100011290941_100000085674 [0,1,0,0,0,1|1,0,0]=3 755 B10R1.172 C=Cc1ccnc(c1)CO 271570a_100011290941_100009819072 [0,1,0,0,0,1|1,0,0]=3 756 B10R1.172 C=Cc1ccnc(c1)NC 271570a_100011290941_100009819592 [0,1,0,0,0,1|1,0,0]=3 757 B10R1.172 C=Cc1ccnc(c1)NN 271570a_100011290941_100000764631 [0,1,0,0,0,1|2,0,0]=4 758 B10R1.172 C=Cc1ccnc(c1)OC 271570a_100011290941_100000117307 [0,1,0,0,0,1|1,0,0]=3 759 B10R1.172 C=Cc1ccnc(n1)C#N 271570a_100011290941_100000092507 [0,1,0,0,0,1|1,0,1]=4 760 B10R1.172 C=Cc1ccnc(n1)NC 271570a_100011290941_100012000420 [0,1,0,0,0,1|1,0,0]=3 761 B10R1.172 C=Cc1ccnc(n1)OC 271570a_100011290941_100000069072 [0,1,0,0,0,1|1,0,0]=3 762 B10R1.172 C=Cc1ccnc(n1)SC 271570a_100011290941_100000032126 [0,1,0,0,0,1|1,0,0]=3 763 B10R1.172 C=Cc1nccc(n1)CC 271570a_100011290941_100000100215 [0,1,0,0,0,1|2,0,0]=4 764 B10R1.172 C=Cc1nccc(n1)NC 271570a_100011290941_100011649947 [0,1,0,0,0,1|2,0,0]=4 765 B10R1.172 C=Cc1nccc(n1)OC 271570a_100011290941_100000182009 [0,1,0,0,0,1|2,0,0]=4 766 B10R1.172 C=Cc1nccc(n1)SC 271570a_100011290941_100011650323 [0,1,0,0,0,1|2,0,0]=4 767 B10R1.172 C=Cc1ncnc(n1)OC 271570a_100011290941_200010750123 [0,1,0,0,0,1|1,0,0]=3 768 B10R1.172 CSc1cc(ccn1)C=O 62a_100011290808_200000210301 [0,1,0,0,0,1|2,0,0]=4 769 B10R1.172 CSc1cc(ccn1)C=O 62a_200000210301_100011290808 [0,1,0,0,0,1|2,0,0]=4 770 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_100011290808_200025704644 [0,1,0,0,0,1|2,0,0]=4 771 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_200025704644_100011290808 [0,1,0,0,0,1|2,0,0]=4 772 B10R1.176 C=Cc1cc(c(cn1)Br)C 271570a_100011290941_100012356354 [0,1,0,0,0,1|2,0,0]=4 773 B10R1.176 C=Cc1cc(c(cn1)C)C 271570a_100011290941_100009850809 [0,1,0,0,0,1|2,0,0]=4 774 B10R1.176 C=Cc1cc(c(cn1)F)C 271570a_100011290941_100009818257 [0,1,0,0,0,1|2,0,0]=4 775 B10R1.176 C=Cc1cc(c(cn1)N)C 271570a_100011290941_100000765520 [0,1,0,0,0,1|2,0,0]=4 776 B10R1.176 C=Cc1cc(c(cn1)O)C 271570a_100011290941_100000692680 [0,1,0,0,0,1|2,0,0]=4 777 B10R1.176 C=Cc1ccc(c(c1)C)Br 271570a_100011290941_100009813585 [0,1,0,0,0,1|2,0,0]=4 778 B10R1.176 C=Cc1ccc(c(c1)C)C 271570a_100011290941_100011215607 [0,1,0,0,0,1|2,0,0]=4 779 B10R1.176 C=Cc1ccc(c(c1)C)Cl 271570a_100011290941_100000049509 [0,1,0,0,0,1|2,0,0]=4 780 B10R1.176 C=Cc1ccc(c(c1)C)F 271570a_100011290941_100011218330 [0,1,0,0,0,1|2,0,0]=4 781 B10R1.176 C=Cc1ccc(c(c1)C)N 271570a_100011290941_100000211769 [0,1,0,0,0,1|2,0,0]=4 782 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [0,1,0,0,0,1|2,0,0]=4 783 B10R1.176 C=Cc1ccc(c(n1)C)Br 271570a_100011290941_100012360386 [0,1,0,0,0,1|2,0,0]=4 784 B10R1.176 C=Cc1ccc(c(n1)C)C 271570a_100011290941_100000103781 [0,1,0,0,0,1|2,0,0]=4 785 B10R1.176 C=Cc1ccc(c(n1)C)F 271570a_100011290941_100009814307 [0,1,0,0,0,1|2,0,0]=4 786 B10R1.176 C=Cc1ccc(c(n1)C)N 271570a_100011290941_100000760127 [0,1,0,0,0,1|2,0,0]=4 787 B10R1.176 C=Cc1ccc(c(n1)C)O 271570a_100011290941_100010233687 [0,1,0,0,0,1|2,0,0]=4 788 B10R1.176 C=Cc1ncc(c(n1)C)Cl 271570a_100011290941_100010174973 [0,1,0,0,0,1|2,0,0]=4 789 B10R1.176 C=Cc1ncc(c(n1)C)F 271570a_100011290941_100015641512 [0,1,0,0,0,1|2,0,0]=4 790 B10R1.176 C=Cc1ncc(c(n1)C)N 271570a_100011290941_100000123670 [0,1,0,0,0,1|2,0,0]=4 791 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [0,1,0,0,0,1|2,0,0]=4 792 B10R1.4 C=C=Cc1cccnc1Br 271570a_100015277604_100010202626 [0,1,0,0,0,1|2,0,0]=4 793 B10R1.4 C=C=Cc1cccnc1C 271570a_100015277604_100000751574 [0,1,0,0,0,1|1,0,0]=3 794 B10R1.4 C=C=Cc1cccnc1Cl 271570a_100015277604_100000036424 [0,1,0,0,0,1|2,0,0]=4 795 B10R1.4 C=C=Cc1cccnc1F 271570a_100015277604_100009816115 [0,1,0,0,0,1|2,0,0]=4 796 B10R1.4 C=C=Cc1cccnc1N 271570a_100015277604_100000045569 [0,1,0,0,0,1|2,0,0]=4 797 B10R1.4 C=C=Cc1ccn[nH]c1=O 271570a_100015277604_100000087129 [0,1,0,0,0,1|2,0,0]=4 798 B10R1.4 C=C=Cc1ccncc1Br 271570a_100015277604_100000726257 [0,1,0,0,0,1|2,0,0]=4 799 B10R1.4 C=C=Cc1ccncc1C 271570a_100015277604_100015191297 [0,1,0,0,0,1|1,0,0]=3 800 B10R1.4 C=C=Cc1ccncc1Cl 271570a_100015277604_100000708259 [0,1,0,0,0,1|2,0,0]=4 801 B10R1.4 C=C=Cc1ccncc1F 271570a_100015277604_100000047030 [0,1,0,0,0,1|2,0,0]=4 802 B10R1.4 C=C=Cc1ccncc1N 271570a_100015277604_100009815883 [0,1,0,0,0,1|2,0,0]=4 803 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [0,1,0,0,0,1|2,0,0]=4 804 B10R1.4 C=C=Cc1cnccc1C 271570a_100015277604_100000761580 [0,1,0,0,0,1|2,0,0]=4 805 B10R1.4 C=C=Cc1cncnc1Br 271570a_100015277604_200012461658 [0,1,0,0,0,1|2,0,0]=4 806 B10R1.4 C=C=Cc1cncnc1C 271570a_100015277604_100009819671 [0,1,0,0,0,1|1,0,0]=3 807 B10R1.4 C=C=Cc1cncnc1Cl 271570a_100015277604_100000758962 [0,1,0,0,0,1|2,0,0]=4 808 B10R1.4 C=C=Cc1cncnc1N 271570a_100015277604_100011996079 [0,1,0,0,0,1|2,0,0]=4 809 B10R1.4 C=C=Cc1cncnc1O 271570a_100015277604_100000751107 [0,1,0,0,0,1|2,0,0]=4 810 B10R1.4 C=C=Cc1ncccc1C 271570a_100015277604_100000751373 [0,1,0,0,0,1|2,0,0]=4 811 B10R1.4 C=C=Cc1nccnc1C 271570a_100015277604_100011999405 [0,1,0,0,0,1|1,0,0]=3 812 B10R1.4 C=C=Cc1nccnc1F 271570a_100015277604_200010125657 [0,1,0,0,0,1|2,0,0]=4 813 B10R1.4 C=C=Cc1nccnc1N 271570a_100015277604_100000747729 [0,1,0,0,0,1|2,0,0]=4 814 B10R1.4 C=C=Cc1ncncc1C 271570a_100015277604_100011998708 [0,1,0,0,0,1|1,0,0]=3 815 B10R1.4 C=C=Cc1ncncc1F 271570a_100015277604_100000069762 [0,1,0,0,0,1|2,0,0]=4 816 B10R1.4 C=C=Cc1ncncc1N 271570a_100015277604_100000709731 [0,1,0,0,0,1|2,0,0]=4 817 B10R1.4 C=C=Cc1nnccc1C 271570a_100015277604_100000089043 [0,1,0,0,0,1|2,0,0]=4 818 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,1,0,0,0,1|2,0,0]=4 819 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [0,1,0,0,0,1|2,0,0]=4 820 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [0,1,0,0,0,1|1,0,0]=3 821 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [0,1,0,0,0,1|2,0,0]=4 822 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [0,1,0,0,0,1|2,0,0]=4 823 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,1,0,0,0,1|2,0,0]=4 824 B10R1.4 CC=Cc1ccn[nH]c1=O 271570a_100016259895_100000087129 [0,1,0,0,0,1|2,0,0]=4 825 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [0,1,0,0,0,1|2,0,0]=4 826 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [0,1,0,0,0,1|1,0,0]=3 827 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [0,1,0,0,0,1|2,0,0]=4 828 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [0,1,0,0,0,1|2,0,0]=4 829 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [0,1,0,0,0,1|2,0,0]=4 830 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [0,1,0,0,0,1|2,0,0]=4 831 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [0,1,0,0,0,1|2,0,0]=4 832 B10R1.4 CC=Cc1cncnc1Br 271570a_100016259895_200012461658 [0,1,0,0,0,1|2,0,0]=4 833 B10R1.4 CC=Cc1cncnc1C 271570a_100016259895_100009819671 [0,1,0,0,0,1|1,0,0]=3 834 B10R1.4 CC=Cc1cncnc1Cl 271570a_100016259895_100000758962 [0,1,0,0,0,1|2,0,0]=4 835 B10R1.4 CC=Cc1cncnc1N 271570a_100016259895_100011996079 [0,1,0,0,0,1|2,0,0]=4 836 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [0,1,0,0,0,1|2,0,0]=4 837 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [0,1,0,0,0,1|2,0,0]=4 838 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [0,1,0,0,0,1|1,0,0]=3 839 B10R1.4 CC=Cc1nccnc1F 271570a_100016259895_200010125657 [0,1,0,0,0,1|2,0,0]=4 840 B10R1.4 CC=Cc1nccnc1N 271570a_100016259895_100000747729 [0,1,0,0,0,1|2,0,0]=4 841 B10R1.4 CC=Cc1ncncc1C 271570a_100016259895_100011998708 [0,1,0,0,0,1|1,0,0]=3 842 B10R1.4 CC=Cc1ncncc1F 271570a_100016259895_100000069762 [0,1,0,0,0,1|2,0,0]=4 843 B10R1.4 CC=Cc1ncncc1N 271570a_100016259895_100000709731 [0,1,0,0,0,1|2,0,0]=4 844 B10R1.4 CC=Cc1nnccc1C 271570a_100016259895_100000089043 [0,1,0,0,0,1|2,0,0]=4 845 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [0,1,0,0,0,1|2,0,0]=4 846 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [0,1,0,0,0,1|2,0,0]=4 847 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [0,1,0,0,0,1|2,0,0]=4 848 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [0,1,0,0,0,1|2,0,0]=4 849 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [0,1,0,0,0,1|2,0,0]=4 850 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [0,1,0,0,0,1|2,0,0]=4 851 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [0,1,0,0,0,1|2,0,0]=4 852 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [0,1,0,0,0,1|2,0,0]=4 853 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [0,1,0,0,0,1|2,0,0]=4 854 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [0,1,0,0,0,1|2,0,0]=4 855 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [0,1,0,0,0,1|2,0,0]=4 856 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [0,1,0,0,0,1|2,0,0]=4 857 B10R1.20 C=Cc1cccnc1C#N 271570a_100011290941_100000685805 [0,1,0,0,0,1|1,0,1]=4 858 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [0,1,0,0,0,1|1,0,1]=4 859 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [0,1,0,0,0,1|1,0,0]=3 860 B10R1.20 C=Cc1cccnc1CN 271570a_100011290941_100020591323 [0,1,0,0,0,1|1,0,0]=3 861 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [0,1,0,0,0,1|1,0,0]=3 862 B10R1.20 C=Cc1cccnc1NC 271570a_100011290941_100000700899 [0,1,0,0,0,1|1,0,0]=3 863 B10R1.20 C=Cc1cccnc1NN 271570a_100011290941_100011464834 [0,1,0,0,0,1|2,0,0]=4 864 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [0,1,0,0,0,1|1,0,0]=3 865 B10R1.20 C=Cc1cccnc1SC 271570a_100011290941_100011465278 [0,1,0,0,0,1|1,0,0]=3 866 B10R1.20 C=Cc1ccncc1C#N 271570a_100011290941_100000687039 [0,1,0,0,0,1|1,0,1]=4 867 B10R1.20 C=Cc1ccncc1C=O 271570a_100011290941_100000050567 [0,1,0,0,0,1|1,0,1]=4 868 B10R1.20 C=Cc1ccncc1CC 271570a_100011290941_100025704421 [0,1,0,0,0,1|1,0,0]=3 869 B10R1.20 C=Cc1ccncc1CO 271570a_100011290941_100000117392 [0,1,0,0,0,1|1,0,0]=3 870 B10R1.20 C=Cc1ccncc1OC 271570a_100011290941_100016988167 [0,1,0,0,0,1|1,0,0]=3 871 B10R1.20 C=Cc1cnccc1CC 271570a_100011290941_100009819861 [0,1,0,0,0,1|2,0,0]=4 872 B10R1.20 C=Cc1cnccc1CN 271570a_100011290941_100020640021 [0,1,0,0,0,1|2,0,0]=4 873 B10R1.20 C=Cc1cnccc1CO 271570a_100011290941_100009873359 [0,1,0,0,0,1|2,0,0]=4 874 B10R1.20 C=Cc1cnccc1NC 271570a_100011290941_100010069531 [0,1,0,0,0,1|2,0,0]=4 875 B10R1.20 C=Cc1cnccc1OC 271570a_100011290941_100011997281 [0,1,0,0,0,1|2,0,0]=4 876 B10R1.20 C=Cc1cncnc1C#N 271570a_100011290941_100012001395 [0,1,0,0,0,1|1,0,1]=4 877 B10R1.20 C=Cc1cncnc1CC 271570a_100011290941_100009816992 [0,1,0,0,0,1|1,0,0]=3 878 B10R1.20 C=Cc1cncnc1NC 271570a_100011290941_200012180720 [0,1,0,0,0,1|1,0,0]=3 879 B10R1.20 C=Cc1cncnc1OC 271570a_100011290941_100000719902 [0,1,0,0,0,1|1,0,0]=3 880 B10R1.20 C=Cc1ncccc1CN 271570a_100011290941_100015189234 [0,1,0,0,0,1|2,0,0]=4 881 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [0,1,0,0,0,1|2,0,0]=4 882 B10R1.20 C=Cc1ncccc1NC 271570a_100011290941_200011806188 [0,1,0,0,0,1|2,0,0]=4 883 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [0,1,0,0,0,1|2,0,0]=4 884 B10R1.20 C=Cc1nccnc1C#N 271570a_100011290941_100000040484 [0,1,0,0,0,1|1,0,1]=4 885 B10R1.20 C=Cc1nccnc1CC 271570a_100011290941_100011995844 [0,1,0,0,0,1|1,0,0]=3 886 B10R1.20 C=Cc1nccnc1CN 271570a_100011290941_100000729963 [0,1,0,0,0,1|1,0,0]=3 887 B10R1.20 C=Cc1nccnc1CO 271570a_100011290941_100000057004 [0,1,0,0,0,1|1,0,0]=3 888 B10R1.20 C=Cc1nccnc1NC 271570a_100011290941_100011529439 [0,1,0,0,0,1|1,0,0]=3 889 B10R1.20 C=Cc1nccnc1NN 271570a_100011290941_100000755098 [0,1,0,0,0,1|2,0,0]=4 890 B10R1.20 C=Cc1nccnc1OC 271570a_100011290941_100000749998 [0,1,0,0,0,1|1,0,0]=3 891 B10R1.20 C=Cc1ncncc1C#N 271570a_100011290941_100000687955 [0,1,0,0,0,1|1,0,1]=4 892 B10R1.20 C=Cc1ncncc1CC 271570a_100011290941_200000100055 [0,1,0,0,0,1|1,0,0]=3 893 B10R1.20 C=Cc1ncncc1OC 271570a_100011290941_100012001275 [0,1,0,0,0,1|1,0,0]=3 894 B10R1.20 CSc1cnccc1C=O 62a_100011934409_200000210301 [0,1,0,0,0,1|2,0,0]=4 895 B10R1.20 CSc1cnccc1C=O 62a_200000210301_100011934409 [0,1,0,0,0,1|2,0,0]=4 896 B10R1.20 CSc1ncccc1C=O 62a_100009816751_200000210301 [0,1,0,0,0,1|2,0,0]=4 897 B10R1.20 CSc1ncccc1C=O 62a_200000210301_100009816751 [0,1,0,0,0,1|2,0,0]=4 898 B10R1.20 CSc1nccnc1C=O 62a_100000051000_200000210301 [0,1,0,0,0,1|2,0,0]=4 899 B10R1.20 CSc1nccnc1C=O 62a_200000210301_100000051000 [0,1,0,0,0,1|2,0,0]=4 900 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_100011934409_200025704644 [0,1,0,0,0,1|2,0,0]=4 901 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_200025704644_100011934409 [0,1,0,0,0,1|2,0,0]=4 902 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_100009816751_200025704644 [0,1,0,0,0,1|2,0,0]=4 903 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_200025704644_100009816751 [0,1,0,0,0,1|2,0,0]=4 904 B10R1.20 [13CH3]Sc1nccnc1C=O 62a_100000051000_200025704644 [0,1,0,0,0,1|2,0,0]=4 905 B10R1.20 [13CH3]Sc1nccnc1C=O 62a_200025704644_100000051000 [0,1,0,0,0,1|2,0,0]=4 906 B10R1.25 C=Cc1c[nH]c(=O)nc1N 271570a_100011290941_100000050048 [0,1,0,0,0,1|2,0,0]=4 907 B10R1.25 C=Cc1cc[n+](cc1C)[O-] 271570a_100011290941_100000074940 [0,1,0,0,0,1|1,0,1]=4 908 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [0,1,0,0,0,1|2,0,0]=4 909 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [0,1,0,0,0,1|2,0,0]=4 910 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [0,1,0,0,0,1|2,0,0]=4 911 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [0,1,0,0,0,1|2,0,0]=4 912 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [0,1,0,0,0,1|2,0,0]=4 913 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [0,1,0,0,0,1|2,0,0]=4 914 B10R1.25 C=Cc1ccc(nc1Br)N 271570a_100011290941_100010734177 [0,1,0,0,0,1|2,0,0]=4 915 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [0,1,0,0,0,1|1,0,0]=3 916 B10R1.25 C=Cc1ccc(nc1C)Cl 271570a_100011290941_100000062408 [0,1,0,0,0,1|1,0,0]=3 917 B10R1.25 C=Cc1ccc(nc1C)F 271570a_100011290941_100000688911 [0,1,0,0,0,1|1,0,0]=3 918 B10R1.25 C=Cc1ccc(nc1C)N 271570a_100011290941_100000013003 [0,1,0,0,0,1|1,0,0]=3 919 B10R1.25 C=Cc1ccc(nc1C)O 271570a_100011290941_100000691680 [0,1,0,0,0,1|1,0,0]=3 920 B10R1.25 C=Cc1ccc(nc1Cl)Br 271570a_100011290941_100010246183 [0,1,0,0,0,1|2,0,0]=4 921 B10R1.25 C=Cc1ccc(nc1Cl)N 271570a_100011290941_100010270343 [0,1,0,0,0,1|2,0,0]=4 922 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [0,1,0,0,0,1|2,0,0]=4 923 B10R1.25 C=Cc1ccc(nc1F)Cl 271570a_100011290941_100010168078 [0,1,0,0,0,1|2,0,0]=4 924 B10R1.25 C=Cc1ccc(nc1F)F 271570a_100011290941_100000070099 [0,1,0,0,0,1|2,0,0]=4 925 B10R1.25 C=Cc1ccc(nc1F)N 271570a_100011290941_100009882772 [0,1,0,0,0,1|2,0,0]=4 926 B10R1.25 C=Cc1ccc(nc1F)O 271570a_100011290941_100009879308 [0,1,0,0,0,1|2,0,0]=4 927 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [0,1,0,0,0,1|2,0,0]=4 928 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [0,1,0,0,0,1|2,0,0]=4 929 B10R1.25 C=Cc1ccc(nc1N)F 271570a_100011290941_100009854977 [0,1,0,0,0,1|2,0,0]=4 930 B10R1.25 C=Cc1ccc(nc1N)N 271570a_100011290941_100011356871 [0,1,0,0,0,1|2,0,0]=4 931 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [0,1,0,0,0,1|2,0,0]=4 932 B10R1.25 C=Cc1cnc(cc1C)Br 271570a_100011290941_100009816104 [0,1,0,0,0,1|2,0,0]=4 933 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [0,1,0,0,0,1|2,0,0]=4 934 B10R1.25 C=Cc1cnc(cc1C)Cl 271570a_100011290941_100010172789 [0,1,0,0,0,1|2,0,0]=4 935 B10R1.25 C=Cc1cnc(cc1C)F 271570a_100011290941_100009820716 [0,1,0,0,0,1|2,0,0]=4 936 B10R1.25 C=Cc1cnc(cc1C)N 271570a_100011290941_100000050067 [0,1,0,0,0,1|2,0,0]=4 937 B10R1.25 C=Cc1cnc(cc1C)O 271570a_100011290941_100010114363 [0,1,0,0,0,1|2,0,0]=4 938 B10R1.25 C=Cc1cnc(nc1C)N 271570a_100011290941_100000725598 [0,1,0,0,0,1|1,0,0]=3 939 B10R1.25 C=Cc1cnc(nc1F)F 271570a_100011290941_100009820707 [0,1,0,0,0,1|2,0,0]=4 940 B10R1.25 C=Cc1cnc(nc1N)C 271570a_100011290941_100000684960 [0,1,0,0,0,1|2,0,0]=4 941 B10R1.25 C=Cc1cnc(nc1N)N 271570a_100011290941_200010734216 [0,1,0,0,0,1|2,0,0]=4 942 B10R1.25 C=Cc1n[nH]c(=O)cc1C 271570a_100011290941_100000081757 [0,1,0,0,0,1|2,0,0]=4 943 B10R1.25 C=Cc1ncc(cc1C)Br 271570a_100011290941_100012353652 [0,1,0,0,0,1|2,0,0]=4 944 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [0,1,0,0,0,1|2,0,0]=4 945 B10R1.25 C=Cc1ncc(cc1C)F 271570a_100011290941_100009817009 [0,1,0,0,0,1|2,0,0]=4 946 B10R1.25 C=Cc1ncc(cc1C)N 271570a_100011290941_100000761747 [0,1,0,0,0,1|2,0,0]=4 947 B10R1.25 C=Cc1ncc(cc1C)O 271570a_100011290941_100012000486 [0,1,0,0,0,1|2,0,0]=4 948 B10R1.25 C=Cc1ncc(nc1C)C 271570a_100011290941_100000065684 [0,1,0,0,0,1|1,0,0]=3 949 B10R1.25 C=Cc1ncc(nc1C)N 271570a_100011290941_100009818570 [0,1,0,0,0,1|1,0,0]=3 950 B10R1.25 C=Cc1nnc(cc1C)N 271570a_100011290941_100000123434 [0,1,0,0,0,1|2,0,0]=4 951 B10R1.25 Cc1nc(ccc1C=O)O 271570a_203496583355_100000050599 [0,1,0,0,0,1|2,0,0]=4 952 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,1,0,0,0,1|2,0,0]=4 953 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [0,1,0,0,0,1|2,0,0]=4 954 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [0,1,0,0,0,1|1,0,0]=3 955 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [0,1,0,0,0,1|2,0,0]=4 956 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [0,1,0,0,0,1|2,0,0]=4 957 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [0,1,0,0,0,1|2,0,0]=4 958 B10R1.61 C=C(C)c1ccn[nH]c1=O 271570a_100000694244_100000087129 [0,1,0,0,0,1|2,0,0]=4 959 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [0,1,0,0,0,1|2,0,0]=4 960 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [0,1,0,0,0,1|1,0,0]=3 961 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [0,1,0,0,0,1|2,0,0]=4 962 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [0,1,0,0,0,1|2,0,0]=4 963 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [0,1,0,0,0,1|2,0,0]=4 964 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [0,1,0,0,0,1|2,0,0]=4 965 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [0,1,0,0,0,1|2,0,0]=4 966 B10R1.61 C=C(C)c1cncnc1Br 271570a_100000694244_200012461658 [0,1,0,0,0,1|2,0,0]=4 967 B10R1.61 C=C(C)c1cncnc1C 271570a_100000694244_100009819671 [0,1,0,0,0,1|1,0,0]=3 968 B10R1.61 C=C(C)c1cncnc1Cl 271570a_100000694244_100000758962 [0,1,0,0,0,1|2,0,0]=4 969 B10R1.61 C=C(C)c1cncnc1N 271570a_100000694244_100011996079 [0,1,0,0,0,1|2,0,0]=4 970 B10R1.61 C=C(C)c1cncnc1O 271570a_100000694244_100000751107 [0,1,0,0,0,1|2,0,0]=4 971 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [0,1,0,0,0,1|2,0,0]=4 972 B10R1.61 C=C(C)c1nccnc1C 271570a_100000694244_100011999405 [0,1,0,0,0,1|1,0,0]=3 973 B10R1.61 C=C(C)c1nccnc1F 271570a_100000694244_200010125657 [0,1,0,0,0,1|2,0,0]=4 974 B10R1.61 C=C(C)c1nccnc1N 271570a_100000694244_100000747729 [0,1,0,0,0,1|2,0,0]=4 975 B10R1.61 C=C(C)c1ncncc1C 271570a_100000694244_100011998708 [0,1,0,0,0,1|1,0,0]=3 976 B10R1.61 C=C(C)c1ncncc1F 271570a_100000694244_100000069762 [0,1,0,0,0,1|2,0,0]=4 977 B10R1.61 C=C(C)c1ncncc1N 271570a_100000694244_100000709731 [0,1,0,0,0,1|2,0,0]=4 978 B10R1.61 C=C(C)c1nnccc1C 271570a_100000694244_100000089043 [0,1,0,0,0,1|2,0,0]=4 979 B10R1.245 C=Cc1c(ccc[n+]1[O-])C 271570a_100011290941_100116209805 [0,1,0,0,0,1|2,0,0]=4 980 B10R1.245 C=Cc1c(cccc1C)C 271570a_100011290941_100000033847 [0,1,0,0,0,1|2,0,0]=4 981 B10R1.245 C=Cc1c(cccc1Cl)C 271570a_100011290941_100000043165 [0,1,0,0,0,1|2,0,0]=4 982 B10R1.245 C=Cc1c(cccc1F)C 271570a_100011290941_100012349962 [0,1,0,0,0,1|2,0,0]=4 983 B10R1.245 C=Cc1c(cccc1N)C 271570a_100011290941_100000684715 [0,1,0,0,0,1|2,0,0]=4 984 B10R1.245 C=Cc1c(cccc1O)C 271570a_100011290941_100000686692 [0,1,0,0,0,1|2,0,0]=4 985 B10R1.245 C=Cc1c(ccnc1C)C 271570a_100011290941_100012000501 [0,1,0,0,0,1|1,0,0]=3 986 B10R1.245 C=Cc1c(ccnc1C)N 271570a_100011290941_100010243816 [0,1,0,0,0,1|1,0,0]=3 987 B10R1.245 C=Cc1c(ccnc1F)C 271570a_100011290941_100009818256 [0,1,0,0,0,1|2,0,0]=4 988 B10R1.245 C=Cc1c(ccnc1F)F 271570a_100011290941_100009874084 [0,1,0,0,0,1|2,0,0]=4 989 B10R1.245 C=Cc1c(ccnc1F)N 271570a_100011290941_100010381272 [0,1,0,0,0,1|2,0,0]=4 990 B10R1.245 C=Cc1c(ccnc1N)C 271570a_100011290941_100011998619 [0,1,0,0,0,1|2,0,0]=4 991 B10R1.245 C=Cc1c(ccnc1N)Cl 271570a_100011290941_100010199028 [0,1,0,0,0,1|2,0,0]=4 992 B10R1.245 C=Cc1c(ccnc1O)C 271570a_100011290941_100012000493 [0,1,0,0,0,1|2,0,0]=4 993 B10R1.245 C=Cc1c(ccnc1O)O 271570a_100011290941_200009817435 [0,1,0,0,0,1|2,0,0]=4 994 B10R1.245 C=Cc1c(cn[nH]c1=O)N 271570a_100011290941_100000687681 [0,1,0,0,0,1|2,0,0]=4 995 B10R1.245 C=Cc1c(cn[nH]c1=O)O 271570a_100011290941_100000116976 [0,1,0,0,0,1|2,0,0]=4 996 B10R1.245 C=Cc1c(cncc1Br)Br 271570a_100011290941_100010172828 [0,1,0,0,0,1|2,0,0]=4 997 B10R1.245 C=Cc1c(cncc1C)C 271570a_100011290941_100009817138 [0,1,0,0,0,1|1,0,0]=3 998 B10R1.245 C=Cc1c(cncc1Cl)Cl 271570a_100011290941_100000036193 [0,1,0,0,0,1|2,0,0]=4 999 B10R1.245 C=Cc1c(cncc1F)F 271570a_100011290941_100000760538 [0,1,0,0,0,1|2,0,0]=4 1000 B10R1.245 C=Cc1c(nc[nH]c1=O)C 271570a_100011290941_100011356812 [0,1,0,0,0,1|1,0,0]=3 1001 B10R1.245 C=Cc1c(ncnc1C)C 271570a_100011290941_100009820708 [0,1,0,0,0,1|1,0,0]=3 1002 B10R1.245 C=Cc1c(ncnc1F)F 271570a_100011290941_100009816962 [0,1,0,0,0,1|2,0,0]=4 1003 B10R1.245 C=Cc1c(ncnc1N)C 271570a_100011290941_100011996190 [0,1,0,0,0,1|1,0,0]=3 1004 B10R1.245 C=Cc1c(ncnc1N)N 271570a_100011290941_100010128106 [0,1,0,0,0,1|2,0,0]=4 1005 B10R1.5 C=C=Cc1c[nH]nc1OC 271570a_100015277604_100010982843 [0,2,0,0,0,0|2,0,0]=4 1006 B10R1.5 C=C=Cc1ccnn1CC 271570a_100015277604_100000728327 [0,2,0,0,0,0|2,0,0]=4 1007 B10R1.5 C=C=Cc1ccsc1CO 271570a_100015277604_100000702026 [0,2,0,0,0,0|2,0,0]=4 1008 B10R1.5 C=C=Cc1ccsc1SC 271570a_100015277604_200010341309 [0,2,0,0,0,0|2,0,0]=4 1009 B10R1.5 C=C=Cc1ncnn1CC 271570a_100015277604_100009879425 [0,2,0,0,0,0|2,0,0]=4 1010 B10R1.5 C=C=Cc1ncsc1CO 271570a_100015277604_100012000948 [0,2,0,0,0,0|2,0,0]=4 1011 B10R1.5 C=C=Cc1sccc1C#N 271570a_100015277604_100009817073 [0,2,0,0,0,0|1,0,1]=4 1012 B10R1.5 C=C=Cc1sccc1C=O 271570a_100015277604_100009816921 [0,2,0,0,0,0|1,0,1]=4 1013 B10R1.5 C=C=Cc1sccc1CC 271570a_100015277604_200009875468 [0,2,0,0,0,0|1,0,0]=3 1014 B10R1.5 C=C=Cc1sccc1CN 271570a_100015277604_100000727803 [0,2,0,0,0,0|1,0,0]=3 1015 B10R1.5 C=C=Cc1sccc1CO 271570a_100015277604_100009816922 [0,2,0,0,0,0|1,0,0]=3 1016 B10R1.5 C=Cc1ccsc1CNC 271570a_100011290941_100000767120 [0,2,0,0,0,0|2,0,0]=4 1017 B10R1.5 C=Cc1sccc1CNC 271570a_100011290941_100009817074 [0,2,0,0,0,0|1,0,0]=3 1018 B10R1.5 CC=Cc1c[nH]nc1OC 271570a_100016259895_100010982843 [0,2,0,0,0,0|2,0,0]=4 1019 B10R1.5 CC=Cc1ccnn1CC 271570a_100016259895_100000728327 [0,2,0,0,0,0|2,0,0]=4 1020 B10R1.5 CC=Cc1ccsc1C=O 271570a_100016259895_100000766043 [0,2,0,0,0,0|2,0,0]=4 1021 B10R1.5 CC=Cc1ccsc1CO 271570a_100016259895_100000702026 [0,2,0,0,0,0|2,0,0]=4 1022 B10R1.5 CC=Cc1ccsc1SC 271570a_100016259895_200010341309 [0,2,0,0,0,0|2,0,0]=4 1023 B10R1.5 CC=Cc1ncnn1CC 271570a_100016259895_100009879425 [0,2,0,0,0,0|2,0,0]=4 1024 B10R1.5 CC=Cc1ncsc1CO 271570a_100016259895_100012000948 [0,2,0,0,0,0|1,0,1]=4 1025 B10R1.5 CC=Cc1sccc1C#N 271570a_100016259895_100009817073 [0,2,0,0,0,0|1,0,1]=4 1026 B10R1.5 CC=Cc1sccc1C=O 271570a_100016259895_100009816921 [0,2,0,0,0,0|1,0,1]=4 1027 B10R1.5 CC=Cc1sccc1CC 271570a_100016259895_200009875468 [0,2,0,0,0,0|1,0,0]=3 1028 B10R1.5 CC=Cc1sccc1CN 271570a_100016259895_100000727803 [0,2,0,0,0,0|1,0,0]=3 1029 B10R1.5 CC=Cc1sccc1CO 271570a_100016259895_100009816922 [0,2,0,0,0,0|1,0,0]=3 1030 B10R1.5 CCSc1ccsc1C=O 62a_100000210202_100000766043 [0,2,0,0,0,0|2,0,0]=4 1031 B10R1.5 CCSc1ccsc1C=O 62a_100000766043_100000210202 [0,2,0,0,0,0|2,0,0]=4 1032 B10R1.5 CCSc1ncsc1CO 62a_100000210202_100012000948 [0,2,0,0,0,0|1,0,1]=4 1033 B10R1.5 CCSc1ncsc1CO 62a_100012000948_100000210202 [0,2,0,0,0,0|1,0,1]=4 1034 B10R1.5 O=Cc1sccc1SCF 62a_100000766043_100015361967 [0,2,0,0,0,0|2,0,0]=4 1035 B10R1.5 O=Cc1sccc1SCF 62a_100015361967_100000766043 [0,2,0,0,0,0|2,0,0]=4 1036 B10R1.5 OCc1scnc1SCF 62a_100012000948_100015361967 [0,2,0,0,0,0|1,0,1]=4 1037 B10R1.5 OCc1scnc1SCF 62a_100015361967_100012000948 [0,2,0,0,0,0|1,0,1]=4 1038 B10R1.32 C=Cc1cn(nc1CC)C 271570a_100011290941_100012396458 [0,2,0,0,0,0|2,0,0]=4 1039 B10R1.32 C=Cc1cn(nc1CO)C 271570a_100011290941_100009816719 [0,2,0,0,0,0|2,0,0]=4 1040 B10R1.32 C=Cc1cn(nc1OC)C 271570a_100011290941_100015475556 [0,2,0,0,0,0|2,0,0]=4 1041 B10R1.32 C=Cc1sc(nc1CO)C 271570a_100011290941_100011103066 [0,2,0,0,0,0|0,0,0]=2 1042 B10R1.32 CSc1cc(sc1C=O)C 62a_100011361552_200000210301 [0,2,0,0,0,0|2,0,0]=4 1043 B10R1.32 CSc1cc(sc1C=O)C 62a_200000210301_100011361552 [0,2,0,0,0,0|2,0,0]=4 1044 B10R1.32 CSc1sc(nc1CO)C 62a_100011103066_200000210301 [0,2,0,0,0,0|1,0,1]=4 1045 B10R1.32 CSc1sc(nc1CO)C 62a_200000210301_100011103066 [0,2,0,0,0,0|1,0,1]=4 1046 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_100011361552_200025704644 [0,2,0,0,0,0|2,0,0]=4 1047 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_200025704644_100011361552 [0,2,0,0,0,0|2,0,0]=4 1048 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_100011103066_200025704644 [0,2,0,0,0,0|1,0,1]=4 1049 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_200025704644_100011103066 [0,2,0,0,0,0|1,0,1]=4 1050 B10R1.39 C=C(C)c1c[nH]nc1OC 271570a_100000694244_100010982843 [0,2,0,0,0,0|2,0,0]=4 1051 B10R1.39 C=C(C)c1ccnn1CC 271570a_100000694244_100000728327 [0,2,0,0,0,0|2,0,0]=4 1052 B10R1.39 C=C(C)c1ccsc1C=O 271570a_100000694244_100000766043 [0,2,0,0,0,0|2,0,0]=4 1053 B10R1.39 C=C(C)c1ccsc1CO 271570a_100000694244_100000702026 [0,2,0,0,0,0|2,0,0]=4 1054 B10R1.39 C=C(C)c1ccsc1SC 271570a_100000694244_200010341309 [0,2,0,0,0,0|2,0,0]=4 1055 B10R1.39 C=C(C)c1ncnn1CC 271570a_100000694244_100009879425 [0,2,0,0,0,0|2,0,0]=4 1056 B10R1.39 C=C(C)c1ncsc1CO 271570a_100000694244_100012000948 [0,2,0,0,0,0|1,0,1]=4 1057 B10R1.39 C=C(C)c1sccc1C#N 271570a_100000694244_100009817073 [0,2,0,0,0,0|1,0,1]=4 1058 B10R1.39 C=C(C)c1sccc1C=O 271570a_100000694244_100009816921 [0,2,0,0,0,0|1,0,1]=4 1059 B10R1.39 C=C(C)c1sccc1CC 271570a_100000694244_200009875468 [0,2,0,0,0,0|1,0,0]=3 1060 B10R1.39 C=C(C)c1sccc1CN 271570a_100000694244_100000727803 [0,2,0,0,0,0|1,0,0]=3 1061 B10R1.39 C=C(C)c1sccc1CO 271570a_100000694244_100009816922 [0,2,0,0,0,0|1,0,0]=3 1062 B10R1.39 C=Cc1ccnn1C(C)C 271570a_100011290941_100010264481 [0,2,0,0,0,0|2,0,0]=4 1063 B10R1.39 C=Cc1ccsc1C(=O)C 271570a_100011290941_100000738688 [0,2,0,0,0,0|2,0,0]=4 1064 B10R1.39 C=Cc1ccsc1C(F)F 271570a_100011290941_100000733619 [0,2,0,0,0,0|2,0,0]=4 1065 B10R1.39 C=Cc1ncnn1C(C)C 271570a_100011290941_100009989917 [0,2,0,0,0,0|2,0,0]=4 1066 B10R1.39 C=Cc1ncsc1C(=O)C 271570a_100011290941_200010339033 [0,2,0,0,0,0|0,0,2]=4 1067 B10R1.39 CC(=O)c1sccc1S[13CH3] 62a_100000738688_200025704644 [0,2,0,0,0,0|1,0,1]=4 1068 B10R1.39 CC(=O)c1scnc1S[13CH3] 62a_200010339033_200025704644 [0,2,0,0,0,0|0,0,1]=3 1069 B10R1.39 CC(=O)c1scnc1S[13CH3] 62a_200025704644_200010339033 [0,2,0,0,0,0|0,0,1]=3 1070 B10R1.39 CSc1ccsc1C(=O)C 62a_100000738688_200000210301 [0,2,0,0,0,0|1,0,1]=4 1071 B10R1.39 CSc1ncsc1C(=O)C 62a_200000210301_200010339033 [0,2,0,0,0,0|0,0,1]=3 1072 B10R1.39 CSc1ncsc1C(=O)C 62a_200010339033_200000210301 [0,2,0,0,0,0|0,0,1]=3 1073 B10R1.257 C=Cc1c(cnn1C)C#N 271570a_100011290941_100000702867 [0,2,0,0,0,0|2,0,0]=4 1074 B10R1.257 C=Cc1c(cnn1C)CO 271570a_100011290941_100011063722 [0,2,0,0,0,0|2,0,0]=4 1075 B10R1.257 C=Cc1c(n[nH]c1CO)C 271570a_100011290941_100015664438 [0,2,0,0,0,0|2,0,0]=4 1076 B10R1.257 CSc1ncn(c1C=O)C 62a_200000040309_200000210301 [0,2,0,0,0,0|2,0,0]=4 1077 B10R1.257 CSc1ncn(c1C=O)C 62a_200000210301_200000040309 [0,2,0,0,0,0|2,0,0]=4 1078 B10R1.257 Cn1cnc(c1C=O)S[13CH3] 62a_200000040309_200025704644 [0,2,0,0,0,0|2,0,0]=4 1079 B10R1.257 Cn1cnc(c1C=O)S[13CH3] 62a_200025704644_200000040309 [0,2,0,0,0,0|2,0,0]=4 1080 B10R1.35 C=Cc1cc(c(s1)C=O)C 271570a_100011290941_100010221198 [0,2,0,0,0,0|2,0,0]=4 1081 B10R1.35 C=Cc1cc(sc1C)C=O 271570a_100011290941_100000708457 [0,2,0,0,0,0|2,0,0]=4 1082 B10R1.35 C=Cc1cc(sc1C)CO 271570a_100011290941_100013897464 [0,2,0,0,0,0|2,0,0]=4 1083 B10R1.35 C=Cc1nc(c(s1)C=O)C 271570a_100011290941_100010339034 [0,2,0,0,0,0|1,0,0]=3 1084 B10R1.35 C=Cc1nc(c(s1)CO)C 271570a_100011290941_100010264302 [0,2,0,0,0,0|1,0,1]=4 1085 B10R1.35 C=Cc1sc(cc1C)C=O 271570a_100011290941_100000761930 [0,2,0,0,0,0|1,0,0]=3 1086 B10R1.35 C=Cc1sc(nc1C)CC 271570a_100011290941_100010138847 [0,2,0,0,0,0|0,0,0]=2 1087 B10R1.35 CCc1nc(c(s1)SC)C 62a_100010138847_200000210301 [0,2,0,0,0,0|1,0,1]=4 1088 B10R1.35 CCc1nc(c(s1)SC)C 62a_200000210301_100010138847 [0,2,0,0,0,0|1,0,1]=4 1089 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_100010138847_200025704644 [0,2,0,0,0,0|1,0,1]=4 1090 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_200025704644_100010138847 [0,2,0,0,0,0|1,0,1]=4 1091 B10R1.35 CNc1nc(c(s1)C=O)C 27a_100102657272_100010339034 [0,2,0,0,0,0|1,0,0]=3 1092 B10R1.35 CSc1cc(c(s1)C=O)C 62a_100010221198_200000210301 [0,2,0,0,0,0|2,0,0]=4 1093 B10R1.35 CSc1cc(c(s1)C=O)C 62a_200000210301_100010221198 [0,2,0,0,0,0|2,0,0]=4 1094 B10R1.35 CSc1nc(c(s1)C=O)C 62a_100010339034_200000210301 [0,2,0,0,0,0|1,0,0]=3 1095 B10R1.35 CSc1nc(c(s1)C=O)C 62a_200000210301_100010339034 [0,2,0,0,0,0|1,0,0]=3 1096 B10R1.35 CSc1nc(c(s1)CO)C 62a_100010264302_200000210301 [0,2,0,0,0,0|1,0,1]=4 1097 B10R1.35 CSc1nc(c(s1)CO)C 62a_200000210301_100010264302 [0,2,0,0,0,0|1,0,1]=4 1098 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_100010221198_200025704644 [0,2,0,0,0,0|2,0,0]=4 1099 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_200025704644_100010221198 [0,2,0,0,0,0|2,0,0]=4 1100 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_100010339034_200025704644 [0,2,0,0,0,0|1,0,0]=3 1101 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_200025704644_100010339034 [0,2,0,0,0,0|1,0,0]=3 1102 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_100010264302_200025704644 [0,2,0,0,0,0|1,0,1]=4 1103 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_200025704644_100010264302 [0,2,0,0,0,0|1,0,1]=4 1104 B10R1.59 C=C(C)c1cc(nn1C)C 271570a_100000694244_100009818511 [0,2,0,0,0,0|2,0,0]=4 1105 B10R1.59 C=C(C)c1cc(nn1C)N 271570a_100000694244_100116209741 [0,2,0,0,0,0|2,0,0]=4 1106 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,2,0,0,0,0|2,0,0]=4 1107 B10R1.59 C=C(C)c1cn(nc1C)C 271570a_100000694244_100011996311 [0,2,0,0,0,0|2,0,0]=4 1108 B10R1.59 C=C(C)c1nc(sc1C)C 271570a_100000694244_100010270876 [0,2,0,0,0,0|2,0,0]=4 1109 B10R1.59 C=C(C)c1nc(sc1C)N 271570a_100000694244_100009817509 [0,2,0,0,0,0|2,0,0]=4 1110 B10R1.59 C=C(C)c1nn(nc1C)C 271570a_100000694244_200009884731 [0,2,0,0,0,0|2,0,0]=4 1111 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,2,0,0,0,0|1,0,0]=3 1112 B10R1.59 C=C(C)c1sc(nc1C)C 271570a_100000694244_100009814099 [0,2,0,0,0,0|0,0,0]=2 1113 B10R1.59 CC(=O)c1sc(nc1C)O 271570a_203496583355_100010106820 [0,2,0,0,0,0|0,0,1]=3 1114 B10R1.130 C=C=Cc1cc(nn1C)C 271570a_100015277604_100009818511 [0,2,0,0,0,0|2,0,0]=4 1115 B10R1.130 C=C=Cc1cc(nn1C)N 271570a_100015277604_100116209741 [0,2,0,0,0,0|2,0,0]=4 1116 B10R1.130 C=C=Cc1cc(sc1C)C 271570a_100015277604_100000688054 [0,2,0,0,0,0|2,0,0]=4 1117 B10R1.130 C=C=Cc1cn(nc1C)C 271570a_100015277604_100011996311 [0,2,0,0,0,0|2,0,0]=4 1118 B10R1.130 C=C=Cc1nc(sc1C)C 271570a_100015277604_100010270876 [0,2,0,0,0,0|2,0,0]=4 1119 B10R1.130 C=C=Cc1nc(sc1C)N 271570a_100015277604_100009817509 [0,2,0,0,0,0|2,0,0]=4 1120 B10R1.130 C=C=Cc1nn(nc1C)C 271570a_100015277604_200009884731 [0,2,0,0,0,0|2,0,0]=4 1121 B10R1.130 C=C=Cc1sc(cc1C)C 271570a_100015277604_100000689295 [0,2,0,0,0,0|1,0,0]=3 1122 B10R1.130 C=C=Cc1sc(nc1C)C 271570a_100015277604_100009814099 [0,2,0,0,0,0|0,0,0]=2 1123 B10R1.130 CC=Cc1cc(nn1C)C 271570a_100016259895_100009818511 [0,2,0,0,0,0|2,0,0]=4 1124 B10R1.130 CC=Cc1cc(nn1C)N 271570a_100016259895_100116209741 [0,2,0,0,0,0|2,0,0]=4 1125 B10R1.130 CC=Cc1cc(sc1C)C 271570a_100016259895_100000688054 [0,2,0,0,0,0|2,0,0]=4 1126 B10R1.130 CC=Cc1cn(nc1C)C 271570a_100016259895_100011996311 [0,2,0,0,0,0|2,0,0]=4 1127 B10R1.130 CC=Cc1nc(sc1C)C 271570a_100016259895_100010270876 [0,2,0,0,0,0|2,0,0]=4 1128 B10R1.130 CC=Cc1nc(sc1C)N 271570a_100016259895_100009817509 [0,2,0,0,0,0|2,0,0]=4 1129 B10R1.130 CC=Cc1nn(nc1C)C 271570a_100016259895_200009884731 [0,2,0,0,0,0|2,0,0]=4 1130 B10R1.130 CC=Cc1sc(cc1C)C 271570a_100016259895_100000689295 [0,2,0,0,0,0|1,0,0]=3 1131 B10R1.130 CC=Cc1sc(nc1C)C 271570a_100016259895_100009814099 [0,2,0,0,0,0|0,0,0]=2 1132 B10R1.130 CCSc1sc(nc1C)C 62a_100000210202_100009814099 [0,2,0,0,0,0|0,0,2]=4 1133 B10R1.130 CCSc1sc(nc1C)C 62a_100009814099_100000210202 [0,2,0,0,0,0|0,0,2]=4 1134 B10R1.130 CCSc1sc(nc1C)N 62a_100000210202_100159269596 [0,2,0,0,0,0|0,0,2]=4 1135 B10R1.130 CCSc1sc(nc1C)N 62a_100159269596_100000210202 [0,2,0,0,0,0|0,0,2]=4 1136 B10R1.130 CNCc1sc(nc1C)C 207a_100102657272_100000757988 [0,2,0,0,0,0|0,0,2]=4 1137 B10R1.130 CNCc1sc(nc1C)C 2230a_100000761763_200000210301 [0,2,0,0,0,0|0,0,2]=4 1138 B10R1.130 CNCc1sc(nc1C)C 2230a_106832991635_100000760948 [0,2,0,0,0,0|0,0,2]=4 1139 B10R1.130 CNCc1sc(nc1C)C 34a_100102657272_100000760948 [0,2,0,0,0,0|0,0,2]=4 1140 B10R1.130 CNCc1sc(nc1C)C 7a_106832991635_100000760948 [0,2,0,0,0,0|0,0,2]=4 1141 B10R1.130 COCc1sc(nc1C)Br 7a_100010264302_200000210301 [0,2,0,0,0,0|0,0,2]=4 1142 B10R1.130 COCc1sc(nc1C)C 34a_100000750043_200000210301 [0,2,0,0,0,0|0,0,2]=4 1143 B10R1.130 COCc1sc(nc1C)C 34a_100138415774_100000760948 [0,2,0,0,0,0|0,0,2]=4 1144 B10R1.130 COCc1sc(nc1C)C 7a_100000750043_200000210301 [0,2,0,0,0,0|0,0,2]=4 1145 B10R1.130 CSCc1sc(nc1C)C 62a_100000760948_200000210301 [0,2,0,0,0,0|0,0,2]=4 1146 B10R1.130 CSCc1sc(nc1C)C 62a_200000210301_100000760948 [0,2,0,0,0,0|0,0,2]=4 1147 B10R1.130 Cc1nc(c(s1)CN[13CH3])C 2230a_100000761763_200025704644 [0,2,0,0,0,0|0,0,2]=4 1148 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 34a_100000750043_200025704644 [0,2,0,0,0,0|0,0,2]=4 1149 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 7a_100000750043_200025704644 [0,2,0,0,0,0|0,0,2]=4 1150 B10R1.130 Cc1nc(c(s1)CS[13CH3])C 62a_100000760948_200025704644 [0,2,0,0,0,0|0,0,2]=4 1151 B10R1.130 Cc1nc(c(s1)CS[13CH3])C 62a_200025704644_100000760948 [0,2,0,0,0,0|0,0,2]=4 1152 B10R1.130 Cc1nc(c(s1)SCF)C 62a_100009814099_100015361967 [0,2,0,0,0,0|1,0,1]=4 1153 B10R1.130 Cc1nc(c(s1)SCF)C 62a_100015361967_100009814099 [0,2,0,0,0,0|1,0,1]=4 1154 B10R1.130 Cc1nc(sc1CO[13CH3])Br 7a_100010264302_200025704644 [0,2,0,0,0,0|0,0,2]=4 1155 B10R1.130 Cc1nc(sc1SCF)N 62a_100015361967_100159269596 [0,2,0,0,0,0|1,0,1]=4 1156 B10R1.130 Cc1nc(sc1SCF)N 62a_100159269596_100015361967 [0,2,0,0,0,0|1,0,1]=4 1157 B10R1.256 C=Cc1c(nn(c1C)C)C 271570a_100011290941_100000239273 [0,2,0,0,0,0|2,0,0]=4 1158 B10R1.187 C=C=Cc1c(n[nH]c1C)C 271570a_100015277604_100000238710 [0,2,0,0,0,0|2,0,0]=4 1159 B10R1.187 C=C=Cc1c(n[nH]c1N)C 271570a_100015277604_100000182022 [0,2,0,0,0,0|2,0,0]=4 1160 B10R1.187 C=C=Cc1c(nnn1C)C 271570a_100015277604_100016037793 [0,2,0,0,0,0|2,0,0]=4 1161 B10R1.187 C=C=Cc1c(noc1C)C 271570a_100015277604_100000694658 [0,2,0,0,0,0|2,0,0]=4 1162 B10R1.187 C=C=Cc1c(noc1N)C 271570a_100015277604_100000754107 [0,2,0,0,0,0|2,0,0]=4 1163 B10R1.187 C=C=Cc1c(nsc1N)C 271570a_100015277604_100000701153 [0,2,0,0,0,0|2,0,0]=4 1164 B10R1.187 CC=Cc1c(n[nH]c1C)C 271570a_100016259895_100000238710 [0,2,0,0,0,0|2,0,0]=4 1165 B10R1.187 CC=Cc1c(n[nH]c1N)C 271570a_100016259895_100000182022 [0,2,0,0,0,0|2,0,0]=4 1166 B10R1.187 CC=Cc1c(nnn1C)C 271570a_100016259895_100016037793 [0,2,0,0,0,0|2,0,0]=4 1167 B10R1.187 CC=Cc1c(noc1C)C 271570a_100016259895_100000694658 [0,2,0,0,0,0|2,0,0]=4 1168 B10R1.187 CC=Cc1c(noc1N)C 271570a_100016259895_100000754107 [0,2,0,0,0,0|2,0,0]=4 1169 B10R1.187 CC=Cc1c(nsc1N)C 271570a_100016259895_100000701153 [0,2,0,0,0,0|2,0,0]=4 1170 B10R1.192 C=C(C)c1c(n[nH]c1C)C 271570a_100000694244_100000238710 [0,2,0,0,0,0|2,0,0]=4 1171 B10R1.192 C=C(C)c1c(n[nH]c1N)C 271570a_100000694244_100000182022 [0,2,0,0,0,0|2,0,0]=4 1172 B10R1.192 C=C(C)c1c(nnn1C)C 271570a_100000694244_100016037793 [0,2,0,0,0,0|2,0,0]=4 1173 B10R1.192 C=C(C)c1c(noc1C)C 271570a_100000694244_100000694658 [0,2,0,0,0,0|2,0,0]=4 1174 B10R1.192 C=C(C)c1c(noc1N)C 271570a_100000694244_100000754107 [0,2,0,0,0,0|2,0,0]=4 1175 B10R1.192 C=C(C)c1c(nsc1N)C 271570a_100000694244_100000701153 [0,2,0,0,0,0|2,0,0]=4 1176 B10R1.29 C#CCSc1scnc1C 62a_100000038162_100009817116 [0,2,0,0,0,0|0,0,2]=4 1177 B10R1.29 C=CCNc1ncnn1C 27a_100020586998_100000732653 [0,2,0,0,0,0|2,0,0]=4 1178 B10R1.29 C=CCOc1ccnn1C 34a_100020632926_100015514636 [0,2,0,0,0,0|2,0,0]=4 1179 B10R1.29 C=CCSc1[nH]cnc1Cl 62a_100000210623_100010200774 [0,2,0,0,0,0|2,0,0]=4 1180 B10R1.29 C=CCSc1[nH]cnc1Cl 62a_100010200774_100000210623 [0,2,0,0,0,0|2,0,0]=4 1181 B10R1.29 C=CCSc1c[nH]nc1C 62a_100000210623_100000692133 [0,2,0,0,0,0|2,0,0]=4 1182 B10R1.29 C=CCSc1c[nH]nc1C 62a_100000692133_100000210623 [0,2,0,0,0,0|2,0,0]=4 1183 B10R1.29 C=CCSc1ccnn1C 62a_100000210623_100000688441 [0,2,0,0,0,0|2,0,0]=4 1184 B10R1.29 C=CCSc1ccnn1C 62a_100000688441_100000210623 [0,2,0,0,0,0|2,0,0]=4 1185 B10R1.29 C=CCSc1ccsc1C 62a_100000210623_100000684487 [0,2,0,0,0,0|2,0,0]=4 1186 B10R1.29 C=CCSc1ccsc1C 62a_100000684487_100000210623 [0,2,0,0,0,0|2,0,0]=4 1187 B10R1.29 C=CCSc1nc[nH]c1C 62a_100000210623_100010186451 [0,2,0,0,0,0|1,0,1]=4 1188 B10R1.29 C=CCSc1nc[nH]c1C 62a_100010186451_100000210623 [0,2,0,0,0,0|1,0,1]=4 1189 B10R1.29 C=CCSc1ncnn1C 62a_100000210623_100000732653 [0,2,0,0,0,0|2,0,0]=4 1190 B10R1.29 C=CCSc1ncnn1C 62a_100000732653_100000210623 [0,2,0,0,0,0|2,0,0]=4 1191 B10R1.29 C=CCSc1ncsc1C 62a_100000210623_100000732656 [0,2,0,0,0,0|2,0,0]=4 1192 B10R1.29 C=CCSc1ncsc1C 62a_100000732656_100000210623 [0,2,0,0,0,0|2,0,0]=4 1193 B10R1.29 C=CCSc1sccc1Br 62a_100000210623_100012361411 [0,2,0,0,0,0|2,0,0]=4 1194 B10R1.29 C=CCSc1sccc1Br 62a_100012361411_100000210623 [0,2,0,0,0,0|2,0,0]=4 1195 B10R1.29 C=CCSc1sccc1C 62a_100000210623_100010247149 [0,2,0,0,0,0|1,0,0]=3 1196 B10R1.29 C=CCSc1sccc1C 62a_100010247149_100000210623 [0,2,0,0,0,0|1,0,0]=3 1197 B10R1.29 C=CCSc1scnc1C 62a_100000210623_100009817116 [0,2,0,0,0,0|0,0,0]=2 1198 B10R1.29 C=CCSc1scnc1C 62a_100009817116_100000210623 [0,2,0,0,0,0|0,0,0]=2 1199 B10R1.29 CCCCc1scnc1C 271570a_100020621405_100009817116 [0,2,0,0,0,0|0,0,2]=4 1200 B10R1.29 CCCSc1scnc1C 62a_100000210303_100009817116 [0,2,0,0,0,0|0,0,2]=4 1201 B10R1.29 CCCSc1scnc1C 62a_100009817116_100000210303 [0,2,0,0,0,0|0,0,2]=4 1202 B10R1.29 CCNCc1scnc1C 207a_100015525214_100000764165 [0,2,0,0,0,0|0,0,2]=4 1203 B10R1.29 CCNCc1scnc1C 2230a_100000752186_100000210202 [0,2,0,0,0,0|0,0,2]=4 1204 B10R1.29 CCOCc1scnc1C 34a_100000750112_100000210202 [0,2,0,0,0,0|0,0,2]=4 1205 B10R1.29 CCOCc1scnc1C 7a_100000750112_100000210202 [0,2,0,0,0,0|0,0,2]=4 1206 B10R1.29 CNCCc1scnc1C 2230a_100000238517_200000210301 [0,2,0,0,0,0|0,0,2]=4 1207 B10R1.29 CNCCc1scnc1C 2230a_106832991635_100000057103 [0,2,0,0,0,0|0,0,2]=4 1208 B10R1.29 CNCCc1scnc1C 34a_100000238517_200000210301 [0,2,0,0,0,0|0,0,2]=4 1209 B10R1.29 CNCCc1scnc1C 34a_100102657272_100000057103 [0,2,0,0,0,0|0,0,2]=4 1210 B10R1.29 CNCCc1scnc1C 7a_106832991635_100000057103 [0,2,0,0,0,0|0,0,2]=4 1211 B10R1.29 COCCc1scnc1C 34a_100000211055_200000210301 [0,2,0,0,0,0|0,0,2]=4 1212 B10R1.29 COCCc1scnc1C 34a_100138415774_100000057103 [0,2,0,0,0,0|0,0,2]=4 1213 B10R1.29 COCCc1scnc1C 7a_100000211055_200000210301 [0,2,0,0,0,0|0,0,2]=4 1214 B10R1.29 COCSc1scnc1C 62a_100000766300_100009817116 [0,2,0,0,0,0|0,0,2]=4 1215 B10R1.29 COCSc1scnc1C 62a_100009817116_100000766300 [0,2,0,0,0,0|0,0,2]=4 1216 B10R1.29 CSCCc1scnc1C 62a_100000057103_200000210301 [0,2,0,0,0,0|0,0,2]=4 1217 B10R1.29 CSCCc1scnc1C 62a_200000210301_100000057103 [0,2,0,0,0,0|0,0,2]=4 1218 B10R1.29 CSCSc1scnc1C 62a_100009817116_100011218213 [0,2,0,0,0,0|0,0,2]=4 1219 B10R1.29 CSCSc1scnc1C 62a_100011218213_100009817116 [0,2,0,0,0,0|0,0,2]=4 1220 B10R1.29 Cc1ccsc1SCC=O 62a_100010247149_200015260668 [0,2,0,0,0,0|1,0,1]=4 1221 B10R1.29 Cc1ccsc1SCC=O 62a_200015260668_100010247149 [0,2,0,0,0,0|1,0,1]=4 1222 B10R1.29 Cc1ncsc1CCN[13CH3] 2230a_100000238517_200025704644 [0,2,0,0,0,0|0,0,2]=4 1223 B10R1.29 Cc1ncsc1CCN[13CH3] 34a_100000238517_200025704644 [0,2,0,0,0,0|0,0,2]=4 1224 B10R1.29 Cc1ncsc1CCO[13CH3] 34a_100000211055_200025704644 [0,2,0,0,0,0|0,0,2]=4 1225 B10R1.29 Cc1ncsc1CCO[13CH3] 7a_100000211055_200025704644 [0,2,0,0,0,0|0,0,2]=4 1226 B10R1.29 Cc1ncsc1CCS[13CH3] 62a_100000057103_200025704644 [0,2,0,0,0,0|0,0,2]=4 1227 B10R1.29 Cc1ncsc1CCS[13CH3] 62a_200025704644_100000057103 [0,2,0,0,0,0|0,0,2]=4 1228 B10R1.29 Cc1ncsc1COCF 34a_100000750112_100015361967 [0,2,0,0,0,0|0,0,2]=4 1229 B10R1.29 Cc1ncsc1COCF 7a_100000750112_100015361967 [0,2,0,0,0,0|0,0,2]=4 1230 B10R1.29 Cc1ncsc1SCC#N 62a_100009817116_100011215382 [0,2,0,0,0,0|0,0,2]=4 1231 B10R1.29 Cc1ncsc1SCC#N 62a_100011215382_100009817116 [0,2,0,0,0,0|0,0,2]=4 1232 B10R1.29 Cc1ncsc1SCC=O 62a_100009817116_200015260668 [0,2,0,0,0,0|0,0,1]=3 1233 B10R1.29 Cc1ncsc1SCC=O 62a_200015260668_100009817116 [0,2,0,0,0,0|0,0,1]=3 1234 B10R1.29 Cc1ncsc1SCCF 62a_100009817116_100011217306 [0,2,0,0,0,0|0,0,2]=4 1235 B10R1.29 Cc1ncsc1SCCF 62a_100011217306_100009817116 [0,2,0,0,0,0|0,0,2]=4 1236 B10R1.29 Cc1ncsc1SCCO 62a_100000211926_100009817116 [0,2,0,0,0,0|0,0,2]=4 1237 B10R1.29 Cc1ncsc1SCCO 62a_100009817116_100000211926 [0,2,0,0,0,0|0,0,2]=4 1238 B10R1.64 CC(=Cc1[nH]cnc1Cl)C 271570a_100102525489_100010200774 [0,2,0,0,0,0|2,0,0]=4 1239 B10R1.64 CC(=Cc1c[nH]nc1C)C 271570a_100102525489_100011912673 [0,2,0,0,0,0|2,0,0]=4 1240 B10R1.64 CC(=Cc1ccnn1C)C 271570a_100102525489_100000688441 [0,2,0,0,0,0|2,0,0]=4 1241 B10R1.64 CC(=Cc1ccsc1C)C 271570a_100102525489_100000684487 [0,2,0,0,0,0|2,0,0]=4 1242 B10R1.64 CC(=Cc1nc[nH]c1C)C 271570a_100102525489_100009816806 [0,2,0,0,0,0|1,0,1]=4 1243 B10R1.64 CC(=Cc1ncnn1C)C 271570a_100102525489_100000732653 [0,2,0,0,0,0|2,0,0]=4 1244 B10R1.64 CC(=Cc1ncsc1C)C 271570a_100102525489_100000732656 [0,2,0,0,0,0|2,0,0]=4 1245 B10R1.64 CC(=Cc1sccc1Br)C 271570a_100102525489_100012361411 [0,2,0,0,0,0|2,0,0]=4 1246 B10R1.64 CC(=Cc1sccc1C)C 271570a_100102525489_100000742657 [0,2,0,0,0,0|1,0,0]=3 1247 B10R1.64 CC(=Cc1scnc1C)C 271570a_100102525489_100009817116 [0,2,0,0,0,0|0,0,0]=2 1248 B10R1.64 CC(=O)Cc1snnc1C 1458a_100000070787_100000732739 [0,2,0,0,0,0|1,0,1]=4 1249 B10R1.64 Cc1ncsc1SC(C)C 62a_100000210206_100009817116 [0,2,0,0,0,0|0,0,2]=4 1250 B10R1.64 Cc1ncsc1SC(C)C 62a_100009817116_100000210206 [0,2,0,0,0,0|0,0,2]=4 1251 B10R1.149 COC(=O)c1scnc1O 271570a_203496583355_100013370767 [0,2,0,0,0,0|1,0,1]=4 1252 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [0,0,1,1,0,0|1,0,1]=4 1253 B8R1.2 C=Cc1ccncn1 271570a_100011290941_100000703185 [0,0,1,1,0,0|1,0,1]=4 1254 B8R1.5 Cc1ncccc1O 271570a_203496583355_100000751574 [0,0,1,1,0,0|2,0,0]=4 1255 B8R1.5 Cc1ncncc1O 271570a_203496583355_100009819671 [0,0,1,1,0,0|2,0,0]=4 1256 B8R1.4 Cc1cc(ccn1)O 271570a_203496583355_100000758586 [0,0,1,1,0,0|2,0,0]=4 1257 B8R1.4 Cc1cc(ncn1)O 271570a_203496583355_100000744208 [0,0,1,1,0,0|2,0,0]=4 1258 B8R1.4 Cc1cccc(c1)O 271570a_203496583355_100011215228 [0,0,1,1,0,0|1,1,0]=4 1259 B8R1.4 Cc1cccc(n1)O 271570a_203496583355_100000742759 [0,0,1,1,0,0|0,1,0]=3 1260 B8R1.4 Cc1ccnc(n1)O 271570a_203496583355_100011243806 [0,0,1,1,0,0|1,1,0]=4 1261 B8R1.4 Cc1cncc(n1)O 271570a_203496583355_100009842155 [0,0,1,1,0,0|1,1,0]=4 1262 B8R1.4 Cc1nccc(n1)O 271570a_203496583355_100000749937 [0,0,1,1,0,0|1,1,0]=4 1263 B8R1.4 Nc1cccc(n1)O 271570a_203496583355_100000740741 [0,0,1,1,0,0|1,1,0]=4 1264 B8R1.4 Oc1cccc(n1)Br 271570a_203496583355_100000684672 [0,0,1,1,0,0|1,1,0]=4 1265 B8R1.4 Oc1cccc(n1)F 271570a_203496583355_100009815982 [0,0,1,1,0,0|1,1,0]=4 1266 B10R2.32 Oc1csc2c1scc2 271570a_203496583355_100009817191 [0,1,0,1,0,0|2,0,0]=4 1267 B10R2.2 Oc1cc2sccc2s1 271570a_203496583355_200010191111 [0,1,0,1,0,0|2,0,0]=4 1268 B10R2.21 Cc1ncsc1C2CC2 271570a_100011220607_100009817116 [0,1,0,1,0,0|0,0,2]=4