0 B11R1.267 C=Cc1cccc(c1C)OC 271570a_100011290941_100010002647 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.267 C=Cc1cccc(c1Cl)OC 271570a_100011290941_100010147677 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.267 C=Cc1cccc(c1F)OC 271570a_100011290941_100010185846 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.267 C=Cc1cccc(c1F)SC 62a_100010741937_200000210301 [0,0,0,0,0,0|2,1,1]=4 4 B11R1.267 C=Cc1cccc(c1F)SC 62a_200000210301_100010741937 [0,0,0,0,0,0|2,1,1]=4 5 B11R1.267 C=Cc1cccc(c1F)S[13CH3] 62a_100010741937_200025704644 [0,0,0,0,0,0|2,1,1]=4 6 B11R1.267 C=Cc1cccc(c1F)S[13CH3] 62a_200025704644_100010741937 [0,0,0,0,0,0|2,1,1]=4 7 B11R1.267 C=Cc1cccc(c1N)NC 271570a_100011290941_100000695761 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.267 C=Cc1cccc(c1N)OC 271570a_100011290941_100000708083 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.267 C=Cc1cccc(c1O)C#N 271570a_100011290941_100009817103 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.267 C=Cc1cccc(c1O)C=O 271570a_100011290941_100000737635 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.267 C=Cc1cccc(c1O)CC 271570a_100011290941_200010001580 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.267 C=Cc1cccc(c1O)OC 271570a_100011290941_100000686866 [0,0,0,0,0,0|1,0,1]=2 13 B11R1.267 C=Cc1ccnc(c1C)OC 271570a_100011290941_100010068544 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.267 C=Cc1ccnc(c1F)OC 271570a_100011290941_100009885657 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.267 C=Cc1cncc(c1C)OC 271570a_100011290941_100010136163 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.267 C=Cc1nccc(c1C)OC 271570a_100011290941_100010067686 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.267 C=Cc1nccc(c1F)OC 271570a_100011290941_200010136267 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.267 C=Cc1nccc(c1N)OC 271570a_100011290941_100000100113 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.267 CCc1cccc(c1O)CC 271570a_203496583355_100010212195 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.267 CCc1cccc(c1O)SC 62a_200000210301_200010001580 [0,0,0,0,0,0|1,1,0]=2 21 B11R1.267 CCc1cccc(c1O)SC 62a_200010001580_200000210301 [0,0,0,0,0,0|1,1,0]=2 22 B11R1.267 CCc1cccc(c1O)S[13CH3] 62a_200010001580_200025704644 [0,0,0,0,0,0|1,1,0]=2 23 B11R1.267 CCc1cccc(c1O)S[13CH3] 62a_200025704644_200010001580 [0,0,0,0,0,0|1,1,0]=2 24 B11R1.267 CCc1ncnc(c1F)OC 34a_100011934678_200000210301 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.267 CCc1ncnc(c1F)O[13CH3] 34a_100011934678_200025704644 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.267 CNc1cccc(c1Br)C#N 34a_100009877206_200000210301 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.267 CNc1cccc(c1Br)OC 34a_100000703447_200000210301 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.267 CNc1cccc(c1C)CO 2230a_102495339961_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.267 CNc1cccc(c1C)CO 34a_102495339961_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.267 CNc1cccc(c1C)OC 34a_100011244893_200000210301 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.267 CNc1cccc(c1C)OC 7a_100011244893_200000210301 [0,0,0,0,0,0|2,0,0]=2 32 B11R1.267 CNc1cccc(c1Cl)C#N 34a_100012184300_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.267 CNc1cccc(c1Cl)OC 34a_100000089720_200000210301 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.267 CNc1cccc(c1F)C#N 34a_100000087142_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.267 CNc1cccc(c1F)CO 34a_100012023829_200000210301 [0,0,0,0,0,0|4,0,0]=4 36 B11R1.267 CNc1cccc(c1F)OC 34a_100000100910_200000210301 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.267 CNc1cccc(c1I)OC 34a_100010245509_200000210301 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.267 CNc1cccc(c1N)SC 62a_100000695761_200000210301 [0,0,0,0,0,0|2,1,0]=3 39 B11R1.267 CNc1cccc(c1N)S[13CH3] 62a_100000695761_200025704644 [0,0,0,0,0,0|2,1,0]=3 40 B11R1.267 CNc1cccc(c1O)OC 34a_100000123586_200000210301 [0,0,0,0,0,0|1,0,0]=1 41 B11R1.267 CNc1ccnc(c1N)SC 62a_200000210301_200000076579 [0,0,0,0,0,0|3,1,0]=4 42 B11R1.267 CNc1ccnc(c1N)S[13CH3] 62a_200025704644_200000076579 [0,0,0,0,0,0|3,1,0]=4 43 B11R1.267 CNc1ncnc(c1C)OC 27a_100102657272_200011912725 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.267 COc1cccc(c1Br)C#N 34a_100009818990_200000210301 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.267 COc1cccc(c1Br)C#N 7a_100009818990_200000210301 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.267 COc1cccc(c1Br)N[13CH3] 34a_100000703447_200025704644 [0,0,0,0,0,0|2,0,0]=2 47 B11R1.267 COc1cccc(c1Br)OC 34a_100010202623_200000210301 [0,0,0,0,0,0|1,0,0]=1 48 B11R1.267 COc1cccc(c1Br)OC 7a_100010202623_200000210301 [0,0,0,0,0,0|1,0,0]=1 49 B11R1.267 COc1cccc(c1Br)O[13CH3] 34a_100010202623_200025704644 [0,0,0,0,0,0|1,0,0]=1 50 B11R1.267 COc1cccc(c1Br)O[13CH3] 7a_100010202623_200025704644 [0,0,0,0,0,0|1,0,0]=1 51 B11R1.267 COc1cccc(c1Br)SC 62a_100010146559_200000210301 [0,0,0,0,0,0|1,1,0]=2 52 B11R1.267 COc1cccc(c1Br)SC 62a_200000210301_100010146559 [0,0,0,0,0,0|1,1,0]=2 53 B11R1.267 COc1cccc(c1Br)S[13CH3] 62a_100010146559_200025704644 [0,0,0,0,0,0|1,1,0]=2 54 B11R1.267 COc1cccc(c1Br)S[13CH3] 62a_200025704644_100010146559 [0,0,0,0,0,0|1,1,0]=2 55 B11R1.267 COc1cccc(c1C)C#N 34a_100000079589_200000210301 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.267 COc1cccc(c1C)C#N 7a_100000079589_200000210301 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.267 COc1cccc(c1C)CO 34a_200000084602_200000210301 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.267 COc1cccc(c1C)CO 7a_200000084602_200000210301 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.267 COc1cccc(c1C)N[13CH3] 34a_100011244893_200025704644 [0,0,0,0,0,0|2,0,0]=2 60 B11R1.267 COc1cccc(c1C)N[13CH3] 7a_100011244893_200025704644 [0,0,0,0,0,0|2,0,0]=2 61 B11R1.267 COc1cccc(c1C)SC 62a_100010002647_200000210301 [0,0,0,0,0,0|1,1,0]=2 62 B11R1.267 COc1cccc(c1C)SC 62a_200000210301_100010002647 [0,0,0,0,0,0|1,1,0]=2 63 B11R1.267 COc1cccc(c1C)S[13CH3] 62a_100010002647_200025704644 [0,0,0,0,0,0|1,1,0]=2 64 B11R1.267 COc1cccc(c1C)S[13CH3] 62a_200025704644_100010002647 [0,0,0,0,0,0|1,1,0]=2 65 B11R1.267 COc1cccc(c1Cl)C#N 34a_200009871651_200000210301 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.267 COc1cccc(c1Cl)C#N 7a_200009871651_200000210301 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.267 COc1cccc(c1Cl)N[13CH3] 34a_100000089720_200025704644 [0,0,0,0,0,0|2,0,0]=2 68 B11R1.267 COc1cccc(c1Cl)OC 34a_100000087810_200000210301 [0,0,0,0,0,0|1,0,0]=1 69 B11R1.267 COc1cccc(c1Cl)OC 7a_100000087810_200000210301 [0,0,0,0,0,0|1,0,0]=1 70 B11R1.267 COc1cccc(c1Cl)O[13CH3] 34a_100000087810_200025704644 [0,0,0,0,0,0|1,0,0]=1 71 B11R1.267 COc1cccc(c1Cl)O[13CH3] 7a_100000087810_200025704644 [0,0,0,0,0,0|1,0,0]=1 72 B11R1.267 COc1cccc(c1Cl)SC 62a_100010147677_200000210301 [0,0,0,0,0,0|1,1,0]=2 73 B11R1.267 COc1cccc(c1Cl)SC 62a_200000210301_100010147677 [0,0,0,0,0,0|1,1,0]=2 74 B11R1.267 COc1cccc(c1Cl)S[13CH3] 62a_100010147677_200025704644 [0,0,0,0,0,0|1,1,0]=2 75 B11R1.267 COc1cccc(c1Cl)S[13CH3] 62a_200025704644_100010147677 [0,0,0,0,0,0|1,1,0]=2 76 B11R1.267 COc1cccc(c1F)C#N 34a_200000094591_200000210301 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.267 COc1cccc(c1F)C#N 7a_200000094591_200000210301 [0,0,0,0,0,0|3,0,0]=3 78 B11R1.267 COc1cccc(c1F)CN 34a_100025773512_200000210301 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.267 COc1cccc(c1F)N[13CH3] 34a_100000100910_200025704644 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.267 COc1cccc(c1F)OC 34a_100000102366_200000210301 [0,0,0,0,0,0|1,0,0]=1 81 B11R1.267 COc1cccc(c1F)OC 7a_100000102366_200000210301 [0,0,0,0,0,0|1,0,0]=1 82 B11R1.267 COc1cccc(c1F)O[13CH3] 34a_100000102366_200025704644 [0,0,0,0,0,0|1,0,0]=1 83 B11R1.267 COc1cccc(c1F)O[13CH3] 7a_100000102366_200025704644 [0,0,0,0,0,0|1,0,0]=1 84 B11R1.267 COc1cccc(c1F)SC 62a_100010185846_200000210301 [0,0,0,0,0,0|1,1,0]=2 85 B11R1.267 COc1cccc(c1F)SC 62a_200000210301_100010185846 [0,0,0,0,0,0|1,1,0]=2 86 B11R1.267 COc1cccc(c1F)S[13CH3] 62a_100010185846_200025704644 [0,0,0,0,0,0|1,1,0]=2 87 B11R1.267 COc1cccc(c1F)S[13CH3] 62a_200025704644_100010185846 [0,0,0,0,0,0|1,1,0]=2 88 B11R1.267 COc1cccc(c1I)N[13CH3] 34a_100010245509_200025704644 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.267 COc1cccc(c1I)OC 34a_200010201982_200000210301 [0,0,0,0,0,0|1,0,0]=1 90 B11R1.267 COc1cccc(c1I)OC 7a_200010201982_200000210301 [0,0,0,0,0,0|1,0,0]=1 91 B11R1.267 COc1cccc(c1I)O[13CH3] 34a_200010201982_200025704644 [0,0,0,0,0,0|1,0,0]=1 92 B11R1.267 COc1cccc(c1I)O[13CH3] 7a_200010201982_200025704644 [0,0,0,0,0,0|1,0,0]=1 93 B11R1.267 COc1cccc(c1N)OC 34a_100012022766_200000210301 [0,0,0,0,0,0|1,0,0]=1 94 B11R1.267 COc1cccc(c1N)OC 7a_100012022766_200000210301 [0,0,0,0,0,0|1,0,0]=1 95 B11R1.267 COc1cccc(c1N)O[13CH3] 34a_100012022766_200025704644 [0,0,0,0,0,0|1,0,0]=1 96 B11R1.267 COc1cccc(c1N)O[13CH3] 7a_100012022766_200025704644 [0,0,0,0,0,0|1,0,0]=1 97 B11R1.267 COc1cccc(c1N)SC 62a_100000708083_200000210301 [0,0,0,0,0,0|1,1,0]=2 98 B11R1.267 COc1cccc(c1N)S[13CH3] 62a_100000708083_200025704644 [0,0,0,0,0,0|1,1,0]=2 99 B11R1.267 COc1cccc(c1O)CO 271570a_203496583355_100010236476 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.267 COc1cccc(c1O)N[13CH3] 34a_100000123586_200025704644 [0,0,0,0,0,0|1,0,0]=1 101 B11R1.267 COc1cccc(c1O)OC 271570a_203496583355_100000050062 [0,0,0,0,0,0|0,0,0]=0 102 B11R1.267 COc1cccc(c1O)SC 62a_200000210301_100000686866 [0,0,0,0,0,0|0,1,0]=1 103 B11R1.267 COc1cccc(c1O)S[13CH3] 62a_200025704644_100000686866 [0,0,0,0,0,0|0,1,0]=1 104 B11R1.267 COc1ccnc(c1C)SC 62a_100010067686_200000210301 [0,0,0,0,0,0|2,1,0]=3 105 B11R1.267 COc1ccnc(c1C)SC 62a_200000210301_100010067686 [0,0,0,0,0,0|2,1,0]=3 106 B11R1.267 COc1ccnc(c1C)S[13CH3] 62a_100010067686_200025704644 [0,0,0,0,0,0|2,1,0]=3 107 B11R1.267 COc1ccnc(c1C)S[13CH3] 62a_200025704644_100010067686 [0,0,0,0,0,0|2,1,0]=3 108 B11R1.267 COc1ccnc(c1F)SC 62a_200000210301_200010136267 [0,0,0,0,0,0|2,1,0]=3 109 B11R1.267 COc1ccnc(c1F)SC 62a_200010136267_200000210301 [0,0,0,0,0,0|2,1,0]=3 110 B11R1.267 COc1ccnc(c1F)S[13CH3] 62a_200010136267_200025704644 [0,0,0,0,0,0|2,1,0]=3 111 B11R1.267 COc1ccnc(c1F)S[13CH3] 62a_200025704644_200010136267 [0,0,0,0,0,0|2,1,0]=3 112 B11R1.267 COc1ccnc(c1N)SC 62a_100010233645_200000210301 [0,0,0,0,0,0|2,1,0]=3 113 B11R1.267 COc1ccnc(c1N)SC 62a_200000210301_100000100113 [0,0,0,0,0,0|2,1,0]=3 114 B11R1.267 COc1ccnc(c1N)S[13CH3] 62a_100010233645_200025704644 [0,0,0,0,0,0|2,1,0]=3 115 B11R1.267 COc1ccnc(c1N)S[13CH3] 62a_200025704644_100000100113 [0,0,0,0,0,0|2,1,0]=3 116 B11R1.267 COc1ccnc(c1O)OC 271570a_203496583355_100010114374 [0,0,0,0,0,0|1,0,0]=1 117 B11R1.267 COc1cncc(c1C)SC 62a_100010136163_200000210301 [0,0,0,0,0,0|2,1,0]=3 118 B11R1.267 COc1cncc(c1C)SC 62a_200000210301_100010136163 [0,0,0,0,0,0|2,1,0]=3 119 B11R1.267 COc1cncc(c1C)S[13CH3] 62a_100010136163_200025704644 [0,0,0,0,0,0|2,1,0]=3 120 B11R1.267 COc1cncc(c1C)S[13CH3] 62a_200025704644_100010136163 [0,0,0,0,0,0|2,1,0]=3 121 B11R1.267 COc1cncc(c1O)OC 271570a_203496583355_200010191558 [0,0,0,0,0,0|1,0,0]=1 122 B11R1.267 COc1cnnc(c1O)OC 271570a_203496583355_100009871623 [0,0,0,0,0,0|2,0,0]=2 123 B11R1.267 COc1nccc(c1C)SC 62a_100010068544_200000210301 [0,0,0,0,0,0|2,1,0]=3 124 B11R1.267 COc1nccc(c1C)SC 62a_200000210301_100010068544 [0,0,0,0,0,0|2,1,0]=3 125 B11R1.267 COc1nccc(c1C)S[13CH3] 62a_100010068544_200025704644 [0,0,0,0,0,0|2,1,0]=3 126 B11R1.267 COc1nccc(c1C)S[13CH3] 62a_200025704644_100010068544 [0,0,0,0,0,0|2,1,0]=3 127 B11R1.267 COc1nccc(c1F)SC 62a_100009885657_200000210301 [0,0,0,0,0,0|2,1,0]=3 128 B11R1.267 COc1nccc(c1F)SC 62a_200000210301_100009885657 [0,0,0,0,0,0|2,1,0]=3 129 B11R1.267 COc1nccc(c1F)S[13CH3] 62a_100009885657_200025704644 [0,0,0,0,0,0|2,1,0]=3 130 B11R1.267 COc1nccc(c1F)S[13CH3] 62a_200025704644_100009885657 [0,0,0,0,0,0|2,1,0]=3 131 B11R1.267 COc1nccc(c1O)C#N 271570a_203496583355_200000050020 [0,0,0,0,0,0|3,0,0]=3 132 B11R1.267 COc1ncnc(c1C)SC 62a_200000210301_200011912725 [0,0,0,0,0,0|3,1,0]=4 133 B11R1.267 COc1ncnc(c1C)SC 62a_200011912725_200000210301 [0,0,0,0,0,0|3,1,0]=4 134 B11R1.267 COc1ncnc(c1C)S[13CH3] 62a_200011912725_200025704644 [0,0,0,0,0,0|3,1,0]=4 135 B11R1.267 COc1ncnc(c1C)S[13CH3] 62a_200025704644_200011912725 [0,0,0,0,0,0|3,1,0]=4 136 B11R1.267 COc1ncnc(c1N)SC 62a_100000686339_200000210301 [0,0,0,0,0,0|3,1,0]=4 137 B11R1.267 COc1ncnc(c1N)SC 62a_200000210301_100000686339 [0,0,0,0,0,0|3,1,0]=4 138 B11R1.267 COc1ncnc(c1N)S[13CH3] 62a_100000686339_200025704644 [0,0,0,0,0,0|3,1,0]=4 139 B11R1.267 COc1ncnc(c1N)S[13CH3] 62a_200025704644_100000686339 [0,0,0,0,0,0|3,1,0]=4 140 B11R1.267 COc1ncnc(c1O)OC 271570a_203496583355_100009995502 [0,0,0,0,0,0|2,0,0]=2 141 B11R1.267 CSc1cccc(c1Br)CO 62a_100010240205_200000210301 [0,0,0,0,0,0|3,1,0]=4 142 B11R1.267 CSc1cccc(c1Br)CO 62a_200000210301_100010240205 [0,0,0,0,0,0|3,1,0]=4 143 B11R1.267 CSc1cccc(c1C)C#N 62a_200000210301_100000721996 [0,0,0,0,0,0|3,1,0]=4 144 B11R1.267 CSc1cccc(c1C)C=O 62a_100012179384_200000210301 [0,0,0,0,0,0|3,1,0]=4 145 B11R1.267 CSc1cccc(c1C)C=O 62a_200000210301_100012179384 [0,0,0,0,0,0|3,1,0]=4 146 B11R1.267 CSc1cccc(c1C)CN 62a_100000724210_200000210301 [0,0,0,0,0,0|3,1,0]=4 147 B11R1.267 CSc1cccc(c1C)CN 62a_200000210301_100000724210 [0,0,0,0,0,0|3,1,0]=4 148 B11R1.267 CSc1cccc(c1C)CO 62a_100000694458_200000210301 [0,0,0,0,0,0|3,1,0]=4 149 B11R1.267 CSc1cccc(c1C)CO 62a_200000210301_100000694458 [0,0,0,0,0,0|3,1,0]=4 150 B11R1.267 CSc1cccc(c1F)C#N 62a_200000210301_100000239898 [0,0,0,0,0,0|3,1,0]=4 151 B11R1.267 CSc1cccc(c1F)C=O 62a_100000766533_200000210301 [0,0,0,0,0,0|3,1,0]=4 152 B11R1.267 CSc1cccc(c1F)C=O 62a_200000210301_100000766533 [0,0,0,0,0,0|3,1,0]=4 153 B11R1.267 CSc1cccc(c1F)CN 62a_100015189953_200000210301 [0,0,0,0,0,0|3,1,0]=4 154 B11R1.267 CSc1cccc(c1F)CN 62a_200000210301_100015189953 [0,0,0,0,0,0|3,1,0]=4 155 B11R1.267 CSc1cccc(c1F)CO 62a_100011935076_200000210301 [0,0,0,0,0,0|3,1,0]=4 156 B11R1.267 CSc1cccc(c1F)CO 62a_200000210301_100011935076 [0,0,0,0,0,0|3,1,0]=4 157 B11R1.267 CSc1cccc(c1N)C#N 62a_200000210301_100011934406 [0,0,0,0,0,0|3,1,0]=4 158 B11R1.267 CSc1cccc(c1N)C=O 62a_100010144990_200000210301 [0,0,0,0,0,0|3,1,0]=4 159 B11R1.267 CSc1cccc(c1N)CO 62a_100012349457_200000210301 [0,0,0,0,0,0|3,1,0]=4 160 B11R1.267 CSc1cccc(c1N)CO 62a_200000210301_100012349457 [0,0,0,0,0,0|3,1,0]=4 161 B11R1.267 CSc1cccc(c1O)C#N 62a_200000210301_100009817103 [0,0,0,0,0,0|2,1,0]=3 162 B11R1.267 CSc1cccc(c1O)C=O 62a_200000210301_100010171435 [0,0,0,0,0,0|2,1,0]=3 163 B11R1.267 CSc1ccnc(c1F)SC 62a_200000210301_200021123860 [0,0,0,0,0,0|2,2,0]=4 164 B11R1.267 CSc1ccnc(c1F)SC 62a_200021123860_200000210301 [0,0,0,0,0,0|2,2,0]=4 165 B11R1.267 CSc1ccnc(c1F)S[13CH3] 62a_200021123860_200025704644 [0,0,0,0,0,0|2,2,0]=4 166 B11R1.267 CSc1ccnc(c1F)S[13CH3] 62a_200025704644_200021123860 [0,0,0,0,0,0|2,2,0]=4 167 B11R1.267 CSc1cncc(c1O)C=O 62a_100010729654_200000210301 [0,0,0,0,0,0|3,1,0]=4 168 B11R1.267 CSc1cncc(c1O)C=O 62a_200000210301_100010729654 [0,0,0,0,0,0|3,1,0]=4 169 B11R1.267 Cc1c(cccc1N[13CH3])CO 2230a_102495339961_200025704644 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.267 Cc1c(cccc1N[13CH3])CO 34a_102495339961_200025704644 [0,0,0,0,0,0|4,0,0]=4 171 B11R1.267 Cc1c(cccc1O[13CH3])C#N 34a_100000079589_200025704644 [0,0,0,0,0,0|3,0,0]=3 172 B11R1.267 Cc1c(cccc1O[13CH3])C#N 7a_100000079589_200025704644 [0,0,0,0,0,0|3,0,0]=3 173 B11R1.267 Cc1c(cccc1O[13CH3])CO 34a_200000084602_200025704644 [0,0,0,0,0,0|3,0,0]=3 174 B11R1.267 Cc1c(cccc1O[13CH3])CO 7a_200000084602_200025704644 [0,0,0,0,0,0|3,0,0]=3 175 B11R1.267 Cc1c(cccc1S[13CH3])C#N 62a_200025704644_100000721996 [0,0,0,0,0,0|3,1,0]=4 176 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_100012179384_200025704644 [0,0,0,0,0,0|3,1,0]=4 177 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_200025704644_100012179384 [0,0,0,0,0,0|3,1,0]=4 178 B11R1.267 Cc1c(cccc1S[13CH3])CN 62a_100000724210_200025704644 [0,0,0,0,0,0|3,1,0]=4 179 B11R1.267 Cc1c(cccc1S[13CH3])CN 62a_200025704644_100000724210 [0,0,0,0,0,0|3,1,0]=4 180 B11R1.267 Cc1c(cccc1S[13CH3])CO 62a_100000694458_200025704644 [0,0,0,0,0,0|3,1,0]=4 181 B11R1.267 Cc1c(cccc1S[13CH3])CO 62a_200025704644_100000694458 [0,0,0,0,0,0|3,1,0]=4 182 B11R1.267 N#Cc1cccc(c1O)C#N 271570a_203496583355_200000077726 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.267 N#Cc1cccc(c1O)C=O 271570a_203496583355_100010133059 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.267 [13CH3]Nc1cccc(c1Br)C#N 34a_100009877206_200025704644 [0,0,0,0,0,0|4,0,0]=4 185 B11R1.267 [13CH3]Nc1cccc(c1Cl)C#N 34a_100012184300_200025704644 [0,0,0,0,0,0|4,0,0]=4 186 B11R1.267 [13CH3]Nc1cccc(c1F)C#N 34a_100000087142_200025704644 [0,0,0,0,0,0|4,0,0]=4 187 B11R1.267 [13CH3]Nc1cccc(c1F)CO 34a_100012023829_200025704644 [0,0,0,0,0,0|4,0,0]=4 188 B11R1.267 [13CH3]Oc1cccc(c1Br)C#N 34a_100009818990_200025704644 [0,0,0,0,0,0|3,0,0]=3 189 B11R1.267 [13CH3]Oc1cccc(c1Br)C#N 7a_100009818990_200025704644 [0,0,0,0,0,0|3,0,0]=3 190 B11R1.267 [13CH3]Oc1cccc(c1Cl)C#N 34a_200009871651_200025704644 [0,0,0,0,0,0|3,0,0]=3 191 B11R1.267 [13CH3]Oc1cccc(c1Cl)C#N 7a_200009871651_200025704644 [0,0,0,0,0,0|3,0,0]=3 192 B11R1.267 [13CH3]Oc1cccc(c1F)C#N 34a_200000094591_200025704644 [0,0,0,0,0,0|3,0,0]=3 193 B11R1.267 [13CH3]Oc1cccc(c1F)C#N 7a_200000094591_200025704644 [0,0,0,0,0,0|3,0,0]=3 194 B11R1.267 [13CH3]Oc1cccc(c1F)CN 34a_100025773512_200025704644 [0,0,0,0,0,0|3,0,0]=3 195 B11R1.267 [13CH3]Sc1cccc(c1Br)CO 62a_100010240205_200025704644 [0,0,0,0,0,0|3,1,0]=4 196 B11R1.267 [13CH3]Sc1cccc(c1Br)CO 62a_200025704644_100010240205 [0,0,0,0,0,0|3,1,0]=4 197 B11R1.267 [13CH3]Sc1cccc(c1F)C#N 62a_200025704644_100000239898 [0,0,0,0,0,0|3,1,0]=4 198 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_100000766533_200025704644 [0,0,0,0,0,0|3,1,0]=4 199 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_200025704644_100000766533 [0,0,0,0,0,0|3,1,0]=4 200 B11R1.267 [13CH3]Sc1cccc(c1F)CN 62a_100015189953_200025704644 [0,0,0,0,0,0|3,1,0]=4 201 B11R1.267 [13CH3]Sc1cccc(c1F)CN 62a_200025704644_100015189953 [0,0,0,0,0,0|3,1,0]=4 202 B11R1.267 [13CH3]Sc1cccc(c1F)CO 62a_100011935076_200025704644 [0,0,0,0,0,0|3,1,0]=4 203 B11R1.267 [13CH3]Sc1cccc(c1F)CO 62a_200025704644_100011935076 [0,0,0,0,0,0|3,1,0]=4 204 B11R1.267 [13CH3]Sc1cccc(c1N)C#N 62a_200025704644_100011934406 [0,0,0,0,0,0|3,1,0]=4 205 B11R1.267 [13CH3]Sc1cccc(c1N)C=O 62a_100010144990_200025704644 [0,0,0,0,0,0|3,1,0]=4 206 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_100012349457_200025704644 [0,0,0,0,0,0|3,1,0]=4 207 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_200025704644_100012349457 [0,0,0,0,0,0|3,1,0]=4 208 B11R1.267 [13CH3]Sc1cccc(c1O)C#N 62a_200025704644_100009817103 [0,0,0,0,0,0|2,1,0]=3 209 B11R1.267 [13CH3]Sc1cccc(c1O)C=O 62a_200025704644_100010171435 [0,0,0,0,0,0|2,1,0]=3 210 B11R1.267 [13CH3]Sc1cncc(c1O)C=O 62a_100010729654_200025704644 [0,0,0,0,0,0|3,1,0]=4 211 B11R1.267 [13CH3]Sc1cncc(c1O)C=O 62a_200025704644_100010729654 [0,0,0,0,0,0|3,1,0]=4 212 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,0,0,0,0,0|2,0,1]=4 213 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,0,0,0,0,0|2,0,1]=4 214 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,0,0,0,0,0|2,0,1]=4 215 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,0,0,0,0,0|2,0,1]=4 216 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,0,0,0,0,0|2,0,1]=4 217 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,0,0,0,0,0|2,0,1]=4 218 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,0,0,0,0,0|2,0,1]=4 219 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,0,0,0,0,0|2,0,1]=4 220 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,0,0,0,0,0|2,0,1]=4 221 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,0,0,0,0,0|2,0,1]=4 222 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,0,0,0,0,0|1,0,1]=3 223 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,0,0,0,0,0|2,0,1]=4 224 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,0,0,0,0,0|2,0,1]=4 225 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,0,0,0,0,0|2,0,1]=4 226 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,0,0,0,0,0|1,0,1]=3 227 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,0,0,0,0,0|2,0,1]=4 228 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,0,0,0,0,0|1,0,0]=2 229 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,0,0,0,0,0|1,0,0]=2 230 B10R1.2 CNc1cccc(c1Br)C 34a_100000684715_200000210301 [1,0,0,0,0,0|2,0,0]=3 231 B10R1.2 CNc1cccc(c1Br)Cl 34a_100000687072_200000210301 [1,0,0,0,0,0|3,0,0]=4 232 B10R1.2 CNc1cccc(c1Br)F 34a_100011934729_200000210301 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.2 CNc1cccc(c1Br)O 34a_100012183704_200000210301 [1,0,0,0,0,0|2,0,0]=3 234 B10R1.2 CNc1cccc(c1Br)O 7a_100012183704_200000210301 [1,0,0,0,0,0|2,0,0]=3 235 B10R1.2 CNc1cccc(c1C)Br 34a_100000750434_200000210301 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.2 CNc1cccc(c1C)C 2230a_100000210026_200000210301 [1,0,0,0,0,0|2,0,0]=3 237 B10R1.2 CNc1cccc(c1C)C 34a_100000210026_200000210301 [1,0,0,0,0,0|2,0,0]=3 238 B10R1.2 CNc1cccc(c1C)C 7a_100000210026_200000210301 [1,0,0,0,0,0|2,0,0]=3 239 B10R1.2 CNc1cccc(c1C)Cl 2230a_100000210441_200000210301 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.2 CNc1cccc(c1C)Cl 34a_100000210441_200000210301 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.2 CNc1cccc(c1C)Cl 7a_100000210441_200000210301 [1,0,0,0,0,0|3,0,0]=4 242 B10R1.2 CNc1cccc(c1C)F 34a_100000745574_200000210301 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.2 CNc1cccc(c1C)F 7a_100000745574_200000210301 [1,0,0,0,0,0|3,0,0]=4 244 B10R1.2 CNc1cccc(c1C)I 34a_100000761887_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B10R1.2 CNc1cccc(c1C)O 34a_100011216573_200000210301 [1,0,0,0,0,0|2,0,0]=3 246 B10R1.2 CNc1cccc(c1C)O 7a_100011216573_200000210301 [1,0,0,0,0,0|2,0,0]=3 247 B10R1.2 CNc1cccc(c1Cl)Br 34a_100000687075_200000210301 [1,0,0,0,0,0|3,0,0]=4 248 B10R1.2 CNc1cccc(c1Cl)C 34a_100000765562_200000210301 [1,0,0,0,0,0|2,0,0]=3 249 B10R1.2 CNc1cccc(c1Cl)C 7a_100000765562_200000210301 [1,0,0,0,0,0|2,0,0]=3 250 B10R1.2 CNc1cccc(c1Cl)Cl 34a_100000185733_200000210301 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.2 CNc1cccc(c1Cl)F 34a_100000692321_200000210301 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.2 CNc1cccc(c1Cl)O 34a_100012002038_200000210301 [1,0,0,0,0,0|2,0,0]=3 253 B10R1.2 CNc1cccc(c1Cl)O 7a_100012002038_200000210301 [1,0,0,0,0,0|2,0,0]=3 254 B10R1.2 CNc1cccc(c1F)Br 2230a_100011935091_200000210301 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.2 CNc1cccc(c1F)Br 34a_100011935091_200000210301 [1,0,0,0,0,0|3,0,0]=4 256 B10R1.2 CNc1cccc(c1F)C 2230a_100000697159_200000210301 [1,0,0,0,0,0|2,0,0]=3 257 B10R1.2 CNc1cccc(c1F)C 34a_100000697159_200000210301 [1,0,0,0,0,0|2,0,0]=3 258 B10R1.2 CNc1cccc(c1F)C 7a_100000697159_200000210301 [1,0,0,0,0,0|2,0,0]=3 259 B10R1.2 CNc1cccc(c1F)Cl 2230a_100000199060_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.2 CNc1cccc(c1F)Cl 34a_100000199060_200000210301 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.2 CNc1cccc(c1F)F 34a_100000743855_200000210301 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.2 CNc1cccc(c1I)Br 34a_100020590159_200000210301 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.2 CNc1cccc(c1I)C 34a_100000761888_200000210301 [1,0,0,0,0,0|2,0,0]=3 264 B10R1.2 CNc1cccc(c1I)Cl 34a_100000049713_200000210301 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.2 CNc1cccc(c1I)F 34a_100000690935_200000210301 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.2 CNc1cccc(c1N)O 271570a_203496583355_100000695761 [1,0,0,0,0,0|2,0,0]=3 267 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,0,0,0,0,0|2,0,0]=3 268 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,0,0,0,0,0|1,0,0]=2 269 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,0,0,0,0,0|2,0,0]=3 270 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,0,0,0,0,0|2,0,0]=3 271 B10R1.2 CNc1ccnc(c1Cl)C 27a_100102657272_100000698670 [1,0,0,0,0,0|3,0,0]=4 272 B10R1.2 CNc1ccnc(c1F)C 27a_100102657272_100009849794 [1,0,0,0,0,0|3,0,0]=4 273 B10R1.2 CNc1ccnc(c1N)O 271570a_203496583355_200000076579 [1,0,0,0,0,0|3,0,0]=4 274 B10R1.2 COc1cccc(c1Br)Br 34a_100010187966_200000210301 [1,0,0,0,0,0|2,0,0]=3 275 B10R1.2 COc1cccc(c1Br)Br 7a_100010187966_200000210301 [1,0,0,0,0,0|2,0,0]=3 276 B10R1.2 COc1cccc(c1Br)C 34a_100000686692_200000210301 [1,0,0,0,0,0|1,0,0]=2 277 B10R1.2 COc1cccc(c1Br)C 7a_100000686692_200000210301 [1,0,0,0,0,0|1,0,0]=2 278 B10R1.2 COc1cccc(c1Br)Cl 34a_100012348804_200000210301 [1,0,0,0,0,0|2,0,0]=3 279 B10R1.2 COc1cccc(c1Br)Cl 7a_100012348804_200000210301 [1,0,0,0,0,0|2,0,0]=3 280 B10R1.2 COc1cccc(c1Br)F 34a_100009820682_200000210301 [1,0,0,0,0,0|2,0,0]=3 281 B10R1.2 COc1cccc(c1Br)F 7a_100009820682_200000210301 [1,0,0,0,0,0|2,0,0]=3 282 B10R1.2 COc1cccc(c1Br)I 34a_100010187914_200000210301 [1,0,0,0,0,0|2,0,0]=3 283 B10R1.2 COc1cccc(c1Br)I 7a_100010187914_200000210301 [1,0,0,0,0,0|2,0,0]=3 284 B10R1.2 COc1cccc(c1Br)N 34a_100012183704_200000210301 [1,0,0,0,0,0|2,0,0]=3 285 B10R1.2 COc1cccc(c1Br)N 7a_100012183704_200000210301 [1,0,0,0,0,0|2,0,0]=3 286 B10R1.2 COc1cccc(c1C)Br 34a_100012002258_200000210301 [1,0,0,0,0,0|2,0,0]=3 287 B10R1.2 COc1cccc(c1C)Br 7a_100012002258_200000210301 [1,0,0,0,0,0|2,0,0]=3 288 B10R1.2 COc1cccc(c1C)C 34a_100000185855_200000210301 [1,0,0,0,0,0|1,0,0]=2 289 B10R1.2 COc1cccc(c1C)C 7a_100000185855_200000210301 [1,0,0,0,0,0|1,0,0]=2 290 B10R1.2 COc1cccc(c1C)Cl 34a_100011265684_200000210301 [1,0,0,0,0,0|2,0,0]=3 291 B10R1.2 COc1cccc(c1C)Cl 7a_100011265684_200000210301 [1,0,0,0,0,0|2,0,0]=3 292 B10R1.2 COc1cccc(c1C)F 34a_100011217231_200000210301 [1,0,0,0,0,0|2,0,0]=3 293 B10R1.2 COc1cccc(c1C)F 7a_100011217231_200000210301 [1,0,0,0,0,0|2,0,0]=3 294 B10R1.2 COc1cccc(c1C)N 34a_100011216573_200000210301 [1,0,0,0,0,0|2,0,0]=3 295 B10R1.2 COc1cccc(c1C)N 7a_100011216573_200000210301 [1,0,0,0,0,0|2,0,0]=3 296 B10R1.2 COc1cccc(c1C)O 271570a_203496583355_100010002647 [1,0,0,0,0,0|1,0,0]=2 297 B10R1.2 COc1cccc(c1Cl)Br 34a_100010187913_200000210301 [1,0,0,0,0,0|2,0,0]=3 298 B10R1.2 COc1cccc(c1Cl)Br 7a_100010187913_200000210301 [1,0,0,0,0,0|2,0,0]=3 299 B10R1.2 COc1cccc(c1Cl)C 34a_100000695629_200000210301 [1,0,0,0,0,0|1,0,0]=2 300 B10R1.2 COc1cccc(c1Cl)C 7a_100000695629_200000210301 [1,0,0,0,0,0|1,0,0]=2 301 B10R1.2 COc1cccc(c1Cl)Cl 34a_100000211076_200000210301 [1,0,0,0,0,0|2,0,0]=3 302 B10R1.2 COc1cccc(c1Cl)Cl 7a_100000211076_200000210301 [1,0,0,0,0,0|2,0,0]=3 303 B10R1.2 COc1cccc(c1Cl)F 34a_100000087408_200000210301 [1,0,0,0,0,0|2,0,0]=3 304 B10R1.2 COc1cccc(c1Cl)F 7a_100000087408_200000210301 [1,0,0,0,0,0|2,0,0]=3 305 B10R1.2 COc1cccc(c1Cl)I 34a_100000049636_200000210301 [1,0,0,0,0,0|2,0,0]=3 306 B10R1.2 COc1cccc(c1Cl)I 7a_100000049636_200000210301 [1,0,0,0,0,0|2,0,0]=3 307 B10R1.2 COc1cccc(c1Cl)N 34a_100012002038_200000210301 [1,0,0,0,0,0|2,0,0]=3 308 B10R1.2 COc1cccc(c1Cl)N 7a_100012002038_200000210301 [1,0,0,0,0,0|2,0,0]=3 309 B10R1.2 COc1cccc(c1Cl)O 271570a_203496583355_100010147677 [1,0,0,0,0,0|1,0,0]=2 310 B10R1.2 COc1cccc(c1F)Br 34a_100009817021_200000210301 [1,0,0,0,0,0|2,0,0]=3 311 B10R1.2 COc1cccc(c1F)Br 7a_100009817021_200000210301 [1,0,0,0,0,0|2,0,0]=3 312 B10R1.2 COc1cccc(c1F)C 34a_100000751311_200000210301 [1,0,0,0,0,0|1,0,0]=2 313 B10R1.2 COc1cccc(c1F)C 7a_100000751311_200000210301 [1,0,0,0,0,0|1,0,0]=2 314 B10R1.2 COc1cccc(c1F)Cl 34a_100000687438_200000210301 [1,0,0,0,0,0|2,0,0]=3 315 B10R1.2 COc1cccc(c1F)Cl 7a_100000687438_200000210301 [1,0,0,0,0,0|2,0,0]=3 316 B10R1.2 COc1cccc(c1F)F 34a_100000751161_200000210301 [1,0,0,0,0,0|2,0,0]=3 317 B10R1.2 COc1cccc(c1F)F 7a_100000751161_200000210301 [1,0,0,0,0,0|2,0,0]=3 318 B10R1.2 COc1cccc(c1F)O 271570a_203496583355_100010185846 [1,0,0,0,0,0|1,0,0]=2 319 B10R1.2 COc1cccc(c1I)Br 34a_100010187912_200000210301 [1,0,0,0,0,0|2,0,0]=3 320 B10R1.2 COc1cccc(c1I)Br 7a_100010187912_200000210301 [1,0,0,0,0,0|2,0,0]=3 321 B10R1.2 COc1cccc(c1I)C 34a_100010083724_200000210301 [1,0,0,0,0,0|1,0,0]=2 322 B10R1.2 COc1cccc(c1I)C 7a_100010083724_200000210301 [1,0,0,0,0,0|1,0,0]=2 323 B10R1.2 COc1cccc(c1I)Cl 34a_100000050174_200000210301 [1,0,0,0,0,0|2,0,0]=3 324 B10R1.2 COc1cccc(c1I)Cl 7a_100000050174_200000210301 [1,0,0,0,0,0|2,0,0]=3 325 B10R1.2 COc1cccc(c1I)F 34a_100000690913_200000210301 [1,0,0,0,0,0|2,0,0]=3 326 B10R1.2 COc1cccc(c1I)F 7a_100000690913_200000210301 [1,0,0,0,0,0|2,0,0]=3 327 B10R1.2 COc1cccc(c1N)Br 34a_100011934926_200000210301 [1,0,0,0,0,0|2,0,0]=3 328 B10R1.2 COc1cccc(c1N)Br 7a_100011934926_200000210301 [1,0,0,0,0,0|2,0,0]=3 329 B10R1.2 COc1cccc(c1N)C 34a_100000743429_200000210301 [1,0,0,0,0,0|1,0,0]=2 330 B10R1.2 COc1cccc(c1N)C 7a_100000743429_200000210301 [1,0,0,0,0,0|1,0,0]=2 331 B10R1.2 COc1cccc(c1N)Cl 34a_100012022510_200000210301 [1,0,0,0,0,0|2,0,0]=3 332 B10R1.2 COc1cccc(c1N)Cl 7a_100012022510_200000210301 [1,0,0,0,0,0|2,0,0]=3 333 B10R1.2 COc1cccc(c1N)F 34a_100020591140_200000210301 [1,0,0,0,0,0|2,0,0]=3 334 B10R1.2 COc1cccc(c1N)F 7a_100020591140_200000210301 [1,0,0,0,0,0|2,0,0]=3 335 B10R1.2 COc1cccc(c1N)I 34a_200000049512_200000210301 [1,0,0,0,0,0|2,0,0]=3 336 B10R1.2 COc1cccc(c1N)I 7a_200000049512_200000210301 [1,0,0,0,0,0|2,0,0]=3 337 B10R1.2 COc1cccc(c1N)N 34a_100000033209_200000210301 [1,0,0,0,0,0|2,0,0]=3 338 B10R1.2 COc1cccc(c1N)O 271570a_203496583355_100000708083 [1,0,0,0,0,0|1,0,0]=2 339 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,0,0,0,0,0|1,0,0]=2 340 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,0,0,0,0,0|1,0,0]=2 341 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,0,0,0,0,0|1,0,0]=2 342 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,0,0,0,0,0|0,0,0]=1 343 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,0,0,0,0,0|0,0,0]=1 344 B10R1.2 COc1cccn(c1=O)C 34a_100000117616_200000210301 [1,0,0,0,0,0|1,0,1]=3 345 B10R1.2 COc1cccn(c1=O)C 7a_100000117616_200000210301 [1,0,0,0,0,0|1,0,1]=3 346 B10R1.2 COc1ccnc(c1Br)Cl 34a_100010136240_200000210301 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.2 COc1ccnc(c1C)O 271570a_203496583355_100010067686 [1,0,0,0,0,0|2,0,0]=3 348 B10R1.2 COc1ccnc(c1Cl)Cl 34a_100009860235_200000210301 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.2 COc1ccnc(c1F)Br 34a_100009876375_200000210301 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.2 COc1ccnc(c1F)Cl 34a_100009856406_200000210301 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.2 COc1ccnc(c1F)O 271570a_203496583355_200010136267 [1,0,0,0,0,0|2,0,0]=3 352 B10R1.2 COc1ccnc(c1N)Cl 34a_100000128729_200000210301 [1,0,0,0,0,0|3,0,0]=4 353 B10R1.2 COc1ccnc(c1N)O 271570a_203496583355_100000100113 [1,0,0,0,0,0|2,0,0]=3 354 B10R1.2 COc1cn[nH]c(=O)c1O 271570a_203496583355_100000020519 [1,0,0,0,0,0|2,0,1]=4 355 B10R1.2 COc1cncc(c1C)O 271570a_203496583355_100010136163 [1,0,0,0,0,0|2,0,0]=3 356 B10R1.2 COc1nccc(c1Br)C 34a_100012000493_200000210301 [1,0,0,0,0,0|2,0,0]=3 357 B10R1.2 COc1nccc(c1C)Br 34a_100009858498_200000210301 [1,0,0,0,0,0|3,0,0]=4 358 B10R1.2 COc1nccc(c1C)O 271570a_203496583355_100010068544 [1,0,0,0,0,0|2,0,0]=3 359 B10R1.2 COc1nccc(c1Cl)N 34a_200000093555_200000210301 [1,0,0,0,0,0|3,0,0]=4 360 B10R1.2 COc1nccc(c1F)O 271570a_203496583355_100009885657 [1,0,0,0,0,0|2,0,0]=3 361 B10R1.2 COc1nccc(c1O)C 271570a_203496583355_100012353928 [1,0,0,0,0,0|1,0,0]=2 362 B10R1.2 COc1nccc(c1O)N 271570a_203496583355_100010243811 [1,0,0,0,0,0|2,0,0]=3 363 B10R1.2 COc1ncnc(c1C)C 34a_100000697798_200000210301 [1,0,0,0,0,0|3,0,0]=4 364 B10R1.2 COc1ncnc(c1C)O 271570a_203496583355_200011912725 [1,0,0,0,0,0|3,0,0]=4 365 B10R1.2 COc1ncnc(c1N)O 271570a_203496583355_100000686339 [1,0,0,0,0,0|3,0,0]=4 366 B10R1.2 COc1ncnc(c1O)C 271570a_203496583355_100010110394 [1,0,0,0,0,0|2,0,0]=3 367 B10R1.2 CSc1cccc(c1Br)Br 62a_100010175083_200000210301 [1,0,0,0,0,0|2,1,0]=4 368 B10R1.2 CSc1cccc(c1Br)Br 62a_200000210301_100010175083 [1,0,0,0,0,0|2,1,0]=4 369 B10R1.2 CSc1cccc(c1Br)C 62a_100012362457_200000210301 [1,0,0,0,0,0|1,1,0]=3 370 B10R1.2 CSc1cccc(c1Br)C 62a_200000210301_100012362457 [1,0,0,0,0,0|1,1,0]=3 371 B10R1.2 CSc1cccc(c1Br)Cl 62a_100014021842_200000210301 [1,0,0,0,0,0|2,1,0]=4 372 B10R1.2 CSc1cccc(c1Br)Cl 62a_200000210301_100014021842 [1,0,0,0,0,0|2,1,0]=4 373 B10R1.2 CSc1cccc(c1Br)F 62a_100010202630_200000210301 [1,0,0,0,0,0|2,1,0]=4 374 B10R1.2 CSc1cccc(c1Br)F 62a_200000210301_100010202630 [1,0,0,0,0,0|2,1,0]=4 375 B10R1.2 CSc1cccc(c1Br)O 62a_100010187914_200000210301 [1,0,0,0,0,0|1,1,0]=3 376 B10R1.2 CSc1cccc(c1Br)O 62a_200000210301_100010187914 [1,0,0,0,0,0|1,1,0]=3 377 B10R1.2 CSc1cccc(c1C)Br 62a_100012353703_200000210301 [1,0,0,0,0,0|2,1,0]=4 378 B10R1.2 CSc1cccc(c1C)Br 62a_200000210301_100012353703 [1,0,0,0,0,0|2,1,0]=4 379 B10R1.2 CSc1cccc(c1C)C 62a_100011214922_200000210301 [1,0,0,0,0,0|1,1,0]=3 380 B10R1.2 CSc1cccc(c1C)C 62a_200000210301_100011214922 [1,0,0,0,0,0|1,1,0]=3 381 B10R1.2 CSc1cccc(c1C)Cl 62a_100000726075_200000210301 [1,0,0,0,0,0|2,1,0]=4 382 B10R1.2 CSc1cccc(c1C)Cl 62a_200000210301_100000726075 [1,0,0,0,0,0|2,1,0]=4 383 B10R1.2 CSc1cccc(c1C)F 62a_100011216893_200000210301 [1,0,0,0,0,0|2,1,0]=4 384 B10R1.2 CSc1cccc(c1C)F 62a_200000210301_100011216893 [1,0,0,0,0,0|2,1,0]=4 385 B10R1.2 CSc1cccc(c1C)N 62a_100000761887_200000210301 [1,0,0,0,0,0|2,1,0]=4 386 B10R1.2 CSc1cccc(c1C)N 62a_200000210301_100000761887 [1,0,0,0,0,0|2,1,0]=4 387 B10R1.2 CSc1cccc(c1C)O 62a_100012002258_200000210301 [1,0,0,0,0,0|1,1,0]=3 388 B10R1.2 CSc1cccc(c1C)O 62a_200000210301_100012002258 [1,0,0,0,0,0|1,1,0]=3 389 B10R1.2 CSc1cccc(c1Cl)Br 62a_100010142854_200000210301 [1,0,0,0,0,0|2,1,0]=4 390 B10R1.2 CSc1cccc(c1Cl)Br 62a_200000210301_100010142854 [1,0,0,0,0,0|2,1,0]=4 391 B10R1.2 CSc1cccc(c1Cl)C 62a_200000210301_200012352035 [1,0,0,0,0,0|1,1,0]=3 392 B10R1.2 CSc1cccc(c1Cl)C 62a_200012352035_200000210301 [1,0,0,0,0,0|1,1,0]=3 393 B10R1.2 CSc1cccc(c1Cl)Cl 62a_100011215384_200000210301 [1,0,0,0,0,0|2,1,0]=4 394 B10R1.2 CSc1cccc(c1Cl)Cl 62a_200000210301_100011215384 [1,0,0,0,0,0|2,1,0]=4 395 B10R1.2 CSc1cccc(c1Cl)F 62a_200000210301_200010234923 [1,0,0,0,0,0|2,1,0]=4 396 B10R1.2 CSc1cccc(c1Cl)F 62a_200010234923_200000210301 [1,0,0,0,0,0|2,1,0]=4 397 B10R1.2 CSc1cccc(c1Cl)O 62a_200000210301_100000049636 [1,0,0,0,0,0|1,1,0]=3 398 B10R1.2 CSc1cccc(c1F)Br 62a_100000702267_200000210301 [1,0,0,0,0,0|2,1,0]=4 399 B10R1.2 CSc1cccc(c1F)Br 62a_200000210301_100000702267 [1,0,0,0,0,0|2,1,0]=4 400 B10R1.2 CSc1cccc(c1F)C 62a_100000717567_200000210301 [1,0,0,0,0,0|1,1,0]=3 401 B10R1.2 CSc1cccc(c1F)C 62a_200000210301_100000717567 [1,0,0,0,0,0|1,1,0]=3 402 B10R1.2 CSc1cccc(c1F)Cl 62a_100011217346_200000210301 [1,0,0,0,0,0|2,1,0]=4 403 B10R1.2 CSc1cccc(c1F)Cl 62a_200000210301_100011217346 [1,0,0,0,0,0|2,1,0]=4 404 B10R1.2 CSc1cccc(c1F)F 62a_100000694657_200000210301 [1,0,0,0,0,0|2,1,0]=4 405 B10R1.2 CSc1cccc(c1F)F 62a_200000210301_100000694657 [1,0,0,0,0,0|2,1,0]=4 406 B10R1.2 CSc1cccc(c1F)N 62a_100011935091_200000210301 [1,0,0,0,0,0|2,1,0]=4 407 B10R1.2 CSc1cccc(c1F)N 62a_200000210301_100011935091 [1,0,0,0,0,0|2,1,0]=4 408 B10R1.2 CSc1cccc(c1F)O 62a_100009817021_200000210301 [1,0,0,0,0,0|1,1,0]=3 409 B10R1.2 CSc1cccc(c1F)O 62a_200000210301_100009817021 [1,0,0,0,0,0|1,1,0]=3 410 B10R1.2 CSc1cccc(c1N)Br 62a_100010146558_200000210301 [1,0,0,0,0,0|2,1,0]=4 411 B10R1.2 CSc1cccc(c1N)Br 62a_200000210301_100010146558 [1,0,0,0,0,0|2,1,0]=4 412 B10R1.2 CSc1cccc(c1N)C 62a_100011834072_200000210301 [1,0,0,0,0,0|1,1,0]=3 413 B10R1.2 CSc1cccc(c1N)C 62a_200000210301_100011834072 [1,0,0,0,0,0|1,1,0]=3 414 B10R1.2 CSc1cccc(c1N)Cl 62a_100010190421_200000210301 [1,0,0,0,0,0|2,1,0]=4 415 B10R1.2 CSc1cccc(c1N)Cl 62a_200000210301_100010190421 [1,0,0,0,0,0|2,1,0]=4 416 B10R1.2 CSc1cccc(c1N)F 62a_100000042321_200000210301 [1,0,0,0,0,0|2,1,0]=4 417 B10R1.2 CSc1cccc(c1N)F 62a_200000210301_100000042321 [1,0,0,0,0,0|2,1,0]=4 418 B10R1.2 CSc1cccc(c1N)N 62a_100015191791_200000210301 [1,0,0,0,0,0|2,1,0]=4 419 B10R1.2 CSc1cccc(c1N)O 62a_200000210301_100011934926 [1,0,0,0,0,0|1,1,0]=3 420 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,0,0,0,0,0|1,1,0]=3 421 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,0,0,0,0,0|1,1,0]=3 422 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,0,0,0,0,0|0,1,0]=2 423 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,0,0,0,0,0|0,1,0]=2 424 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,0,0,0,0,0|1,1,0]=3 425 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,0,0,0,0,0|1,1,0]=3 426 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,0,0,0,0,0|1,1,0]=3 427 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,0,0,0,0,0|1,1,0]=3 428 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,0,0,0,0,0|1,1,0]=3 429 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,0,0,0,0,0|1,1,0]=3 430 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,0,0,0,0,0|0,1,0]=2 431 B10R1.2 CSc1cccn(c1=O)C 62a_100000687173_200000210301 [1,0,0,0,0,0|1,1,1]=4 432 B10R1.2 CSc1cccn(c1=O)C 62a_200000210301_100000687173 [1,0,0,0,0,0|1,1,1]=4 433 B10R1.2 CSc1ccnc(c1C)C 62a_100009846815_200000210301 [1,0,0,0,0,0|2,1,0]=4 434 B10R1.2 CSc1ccnc(c1C)C 62a_200000210301_100009846815 [1,0,0,0,0,0|2,1,0]=4 435 B10R1.2 CSc1ccnc(c1C)O 62a_100009858498_200000210301 [1,0,0,0,0,0|2,1,0]=4 436 B10R1.2 CSc1ccnc(c1C)O 62a_200000210301_100009858498 [1,0,0,0,0,0|2,1,0]=4 437 B10R1.2 CSc1ccnc(c1Cl)C 62a_100000698670_200000210301 [1,0,0,0,0,0|2,1,0]=4 438 B10R1.2 CSc1ccnc(c1Cl)C 62a_200000210301_100000698670 [1,0,0,0,0,0|2,1,0]=4 439 B10R1.2 CSc1ccnc(c1F)C 62a_100009849794_200000210301 [1,0,0,0,0,0|2,1,0]=4 440 B10R1.2 CSc1ccnc(c1F)C 62a_200000210301_100009849794 [1,0,0,0,0,0|2,1,0]=4 441 B10R1.2 CSc1ccnc(c1F)O 271570a_203496583355_200021123860 [1,0,0,0,0,0|2,1,0]=4 442 B10R1.2 CSc1ccnc(c1N)C 62a_100009885578_200000210301 [1,0,0,0,0,0|2,1,0]=4 443 B10R1.2 CSc1ccnc(c1N)C 62a_200000210301_100009885578 [1,0,0,0,0,0|2,1,0]=4 444 B10R1.2 CSc1ccnc(c1O)Cl 62a_200000210301_100010067911 [1,0,0,0,0,0|2,1,0]=4 445 B10R1.2 CSc1cncc(c1C)C 62a_100009864703_200000210301 [1,0,0,0,0,0|2,1,0]=4 446 B10R1.2 CSc1cncc(c1C)C 62a_200000210301_100009864703 [1,0,0,0,0,0|2,1,0]=4 447 B10R1.2 CSc1cncc(c1N)C 62a_100009818025_200000210301 [1,0,0,0,0,0|2,1,0]=4 448 B10R1.2 CSc1cncc(c1N)C 62a_200000210301_100009818025 [1,0,0,0,0,0|2,1,0]=4 449 B10R1.2 CSc1cncc(c1O)N 62a_100000694263_200000210301 [1,0,0,0,0,0|2,1,0]=4 450 B10R1.2 CSc1cncc(c1O)N 62a_200000210301_100000694263 [1,0,0,0,0,0|2,1,0]=4 451 B10R1.2 CSc1nccc(c1C)C 62a_100009847204_200000210301 [1,0,0,0,0,0|2,1,0]=4 452 B10R1.2 CSc1nccc(c1C)C 62a_200000210301_100009847204 [1,0,0,0,0,0|2,1,0]=4 453 B10R1.2 CSc1nccc(c1F)C 62a_100009817629_200000210301 [1,0,0,0,0,0|2,1,0]=4 454 B10R1.2 CSc1nccc(c1F)C 62a_200000210301_100009817629 [1,0,0,0,0,0|2,1,0]=4 455 B10R1.2 CSc1nccc(c1F)O 62a_100009876375_200000210301 [1,0,0,0,0,0|2,1,0]=4 456 B10R1.2 CSc1nccc(c1F)O 62a_200000210301_100009876375 [1,0,0,0,0,0|2,1,0]=4 457 B10R1.2 CSc1nccc(c1N)C 62a_100000763560_200000210301 [1,0,0,0,0,0|2,1,0]=4 458 B10R1.2 CSc1nccc(c1N)C 62a_200000210301_100000763560 [1,0,0,0,0,0|2,1,0]=4 459 B10R1.2 CSc1nccc(c1O)C 62a_200000210301_100000696282 [1,0,0,0,0,0|1,1,0]=3 460 B10R1.2 CSc1nccc(c1O)F 62a_200000210301_100009867227 [1,0,0,0,0,0|2,1,0]=4 461 B10R1.2 CSc1nccc(c1O)N 62a_200000210301_100009844647 [1,0,0,0,0,0|2,1,0]=4 462 B10R1.2 Cc1c(cccc1C#N)O 271570a_203496583355_100000721996 [1,0,0,0,0,0|3,0,0]=4 463 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,0,0,0,0,0|3,0,0]=4 464 B10R1.2 Cc1c(cccc1CN)O 271570a_203496583355_100000724210 [1,0,0,0,0,0|3,0,0]=4 465 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [1,0,0,0,0,0|3,0,0]=4 466 B10R1.2 Cc1c(cccc1N[13CH3])Br 34a_100000750434_200025704644 [1,0,0,0,0,0|3,0,0]=4 467 B10R1.2 Cc1c(cccc1N[13CH3])Cl 2230a_100000210441_200025704644 [1,0,0,0,0,0|3,0,0]=4 468 B10R1.2 Cc1c(cccc1N[13CH3])Cl 34a_100000210441_200025704644 [1,0,0,0,0,0|3,0,0]=4 469 B10R1.2 Cc1c(cccc1N[13CH3])Cl 7a_100000210441_200025704644 [1,0,0,0,0,0|3,0,0]=4 470 B10R1.2 Cc1c(cccc1N[13CH3])F 34a_100000745574_200025704644 [1,0,0,0,0,0|3,0,0]=4 471 B10R1.2 Cc1c(cccc1N[13CH3])F 7a_100000745574_200025704644 [1,0,0,0,0,0|3,0,0]=4 472 B10R1.2 Cc1c(cccc1N[13CH3])I 34a_100000761887_200025704644 [1,0,0,0,0,0|3,0,0]=4 473 B10R1.2 Cc1c(cccc1N[13CH3])O 34a_100011216573_200025704644 [1,0,0,0,0,0|2,0,0]=3 474 B10R1.2 Cc1c(cccc1N[13CH3])O 7a_100011216573_200025704644 [1,0,0,0,0,0|2,0,0]=3 475 B10R1.2 Cc1c(cccc1O[13CH3])Br 34a_100012002258_200025704644 [1,0,0,0,0,0|2,0,0]=3 476 B10R1.2 Cc1c(cccc1O[13CH3])Br 7a_100012002258_200025704644 [1,0,0,0,0,0|2,0,0]=3 477 B10R1.2 Cc1c(cccc1O[13CH3])Cl 34a_100011265684_200025704644 [1,0,0,0,0,0|2,0,0]=3 478 B10R1.2 Cc1c(cccc1O[13CH3])Cl 7a_100011265684_200025704644 [1,0,0,0,0,0|2,0,0]=3 479 B10R1.2 Cc1c(cccc1O[13CH3])F 34a_100011217231_200025704644 [1,0,0,0,0,0|2,0,0]=3 480 B10R1.2 Cc1c(cccc1O[13CH3])F 7a_100011217231_200025704644 [1,0,0,0,0,0|2,0,0]=3 481 B10R1.2 Cc1c(cccc1O[13CH3])N 34a_100011216573_200025704644 [1,0,0,0,0,0|2,0,0]=3 482 B10R1.2 Cc1c(cccc1O[13CH3])N 7a_100011216573_200025704644 [1,0,0,0,0,0|2,0,0]=3 483 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_100012353703_200025704644 [1,0,0,0,0,0|2,1,0]=4 484 B10R1.2 Cc1c(cccc1S[13CH3])Br 62a_200025704644_100012353703 [1,0,0,0,0,0|2,1,0]=4 485 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_100000726075_200025704644 [1,0,0,0,0,0|2,1,0]=4 486 B10R1.2 Cc1c(cccc1S[13CH3])Cl 62a_200025704644_100000726075 [1,0,0,0,0,0|2,1,0]=4 487 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_100011216893_200025704644 [1,0,0,0,0,0|2,1,0]=4 488 B10R1.2 Cc1c(cccc1S[13CH3])F 62a_200025704644_100011216893 [1,0,0,0,0,0|2,1,0]=4 489 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_100000761887_200025704644 [1,0,0,0,0,0|2,1,0]=4 490 B10R1.2 Cc1c(cccc1S[13CH3])N 62a_200025704644_100000761887 [1,0,0,0,0,0|2,1,0]=4 491 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_100012002258_200025704644 [1,0,0,0,0,0|1,1,0]=3 492 B10R1.2 Cc1c(cccc1S[13CH3])O 62a_200025704644_100012002258 [1,0,0,0,0,0|1,1,0]=3 493 B10R1.2 Cc1c(ccnc1O)S[13CH3] 62a_100009858498_200025704644 [1,0,0,0,0,0|2,1,0]=4 494 B10R1.2 Cc1c(ccnc1O)S[13CH3] 62a_200025704644_100009858498 [1,0,0,0,0,0|2,1,0]=4 495 B10R1.2 Cc1c(ccnc1O[13CH3])Br 34a_100009858498_200025704644 [1,0,0,0,0,0|3,0,0]=4 496 B10R1.2 Cc1cccc(c1Br)N[13CH3] 34a_100000684715_200025704644 [1,0,0,0,0,0|2,0,0]=3 497 B10R1.2 Cc1cccc(c1Br)O[13CH3] 34a_100000686692_200025704644 [1,0,0,0,0,0|1,0,0]=2 498 B10R1.2 Cc1cccc(c1Br)O[13CH3] 7a_100000686692_200025704644 [1,0,0,0,0,0|1,0,0]=2 499 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_100012362457_200025704644 [1,0,0,0,0,0|1,1,0]=3 500 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_200025704644_100012362457 [1,0,0,0,0,0|1,1,0]=3 501 B10R1.2 Cc1cccc(c1C)N[13CH3] 2230a_100000210026_200025704644 [1,0,0,0,0,0|2,0,0]=3 502 B10R1.2 Cc1cccc(c1C)N[13CH3] 34a_100000210026_200025704644 [1,0,0,0,0,0|2,0,0]=3 503 B10R1.2 Cc1cccc(c1C)N[13CH3] 7a_100000210026_200025704644 [1,0,0,0,0,0|2,0,0]=3 504 B10R1.2 Cc1cccc(c1C)O[13CH3] 34a_100000185855_200025704644 [1,0,0,0,0,0|1,0,0]=2 505 B10R1.2 Cc1cccc(c1C)O[13CH3] 7a_100000185855_200025704644 [1,0,0,0,0,0|1,0,0]=2 506 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_100011214922_200025704644 [1,0,0,0,0,0|1,1,0]=3 507 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_200025704644_100011214922 [1,0,0,0,0,0|1,1,0]=3 508 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 34a_100000765562_200025704644 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 7a_100000765562_200025704644 [1,0,0,0,0,0|2,0,0]=3 510 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 34a_100000695629_200025704644 [1,0,0,0,0,0|1,0,0]=2 511 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 7a_100000695629_200025704644 [1,0,0,0,0,0|1,0,0]=2 512 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200012352035_200025704644 [1,0,0,0,0,0|1,1,0]=3 513 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200025704644_200012352035 [1,0,0,0,0,0|1,1,0]=3 514 B10R1.2 Cc1cccc(c1F)N[13CH3] 2230a_100000697159_200025704644 [1,0,0,0,0,0|2,0,0]=3 515 B10R1.2 Cc1cccc(c1F)N[13CH3] 34a_100000697159_200025704644 [1,0,0,0,0,0|2,0,0]=3 516 B10R1.2 Cc1cccc(c1F)N[13CH3] 7a_100000697159_200025704644 [1,0,0,0,0,0|2,0,0]=3 517 B10R1.2 Cc1cccc(c1F)O[13CH3] 34a_100000751311_200025704644 [1,0,0,0,0,0|1,0,0]=2 518 B10R1.2 Cc1cccc(c1F)O[13CH3] 7a_100000751311_200025704644 [1,0,0,0,0,0|1,0,0]=2 519 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_100000717567_200025704644 [1,0,0,0,0,0|1,1,0]=3 520 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_200025704644_100000717567 [1,0,0,0,0,0|1,1,0]=3 521 B10R1.2 Cc1cccc(c1I)N[13CH3] 34a_100000761888_200025704644 [1,0,0,0,0,0|2,0,0]=3 522 B10R1.2 Cc1cccc(c1I)O[13CH3] 34a_100010083724_200025704644 [1,0,0,0,0,0|1,0,0]=2 523 B10R1.2 Cc1cccc(c1I)O[13CH3] 7a_100010083724_200025704644 [1,0,0,0,0,0|1,0,0]=2 524 B10R1.2 Cc1cccc(c1N)O[13CH3] 34a_100000743429_200025704644 [1,0,0,0,0,0|1,0,0]=2 525 B10R1.2 Cc1cccc(c1N)O[13CH3] 7a_100000743429_200025704644 [1,0,0,0,0,0|1,0,0]=2 526 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_100011834072_200025704644 [1,0,0,0,0,0|1,1,0]=3 527 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_200025704644_100011834072 [1,0,0,0,0,0|1,1,0]=3 528 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,0,0,0,0,0|2,0,0]=3 529 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,0,0,0,0,0|2,0,0]=3 530 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,0,0,0,0,0|1,0,0]=2 531 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,0,0,0,0,0|0,1,0]=2 532 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,0,0,0,0,0|0,1,0]=2 533 B10R1.2 Cc1ccnc(c1Br)O[13CH3] 34a_100012000493_200025704644 [1,0,0,0,0,0|2,0,0]=3 534 B10R1.2 Cc1ccnc(c1C)S[13CH3] 62a_100009847204_200025704644 [1,0,0,0,0,0|2,1,0]=4 535 B10R1.2 Cc1ccnc(c1C)S[13CH3] 62a_200025704644_100009847204 [1,0,0,0,0,0|2,1,0]=4 536 B10R1.2 Cc1ccnc(c1F)S[13CH3] 62a_100009817629_200025704644 [1,0,0,0,0,0|2,1,0]=4 537 B10R1.2 Cc1ccnc(c1F)S[13CH3] 62a_200025704644_100009817629 [1,0,0,0,0,0|2,1,0]=4 538 B10R1.2 Cc1ccnc(c1N)S[13CH3] 62a_100000763560_200025704644 [1,0,0,0,0,0|2,1,0]=4 539 B10R1.2 Cc1ccnc(c1N)S[13CH3] 62a_200025704644_100000763560 [1,0,0,0,0,0|2,1,0]=4 540 B10R1.2 Cc1ccnc(c1O)C#N 271570a_203496583355_100009878727 [1,0,0,0,0,0|3,0,0]=4 541 B10R1.2 Cc1ccnc(c1O)S[13CH3] 62a_200025704644_100000696282 [1,0,0,0,0,0|1,1,0]=3 542 B10R1.2 Cc1cncc(c1C)S[13CH3] 62a_100009864703_200025704644 [1,0,0,0,0,0|2,1,0]=4 543 B10R1.2 Cc1cncc(c1C)S[13CH3] 62a_200025704644_100009864703 [1,0,0,0,0,0|2,1,0]=4 544 B10R1.2 Cc1cncc(c1N)S[13CH3] 62a_100009818025_200025704644 [1,0,0,0,0,0|2,1,0]=4 545 B10R1.2 Cc1cncc(c1N)S[13CH3] 62a_200025704644_100009818025 [1,0,0,0,0,0|2,1,0]=4 546 B10R1.2 Cc1nccc(c1C)S[13CH3] 62a_100009846815_200025704644 [1,0,0,0,0,0|2,1,0]=4 547 B10R1.2 Cc1nccc(c1C)S[13CH3] 62a_200025704644_100009846815 [1,0,0,0,0,0|2,1,0]=4 548 B10R1.2 Cc1nccc(c1Cl)S[13CH3] 62a_100000698670_200025704644 [1,0,0,0,0,0|2,1,0]=4 549 B10R1.2 Cc1nccc(c1Cl)S[13CH3] 62a_200025704644_100000698670 [1,0,0,0,0,0|2,1,0]=4 550 B10R1.2 Cc1nccc(c1F)S[13CH3] 62a_100009849794_200025704644 [1,0,0,0,0,0|2,1,0]=4 551 B10R1.2 Cc1nccc(c1F)S[13CH3] 62a_200025704644_100009849794 [1,0,0,0,0,0|2,1,0]=4 552 B10R1.2 Cc1nccc(c1N)S[13CH3] 62a_100009885578_200025704644 [1,0,0,0,0,0|2,1,0]=4 553 B10R1.2 Cc1nccc(c1N)S[13CH3] 62a_200025704644_100009885578 [1,0,0,0,0,0|2,1,0]=4 554 B10R1.2 Cc1ncnc(c1C)O[13CH3] 34a_100000697798_200025704644 [1,0,0,0,0,0|3,0,0]=4 555 B10R1.2 Cn1cccc(c1=O)O[13CH3] 34a_100000117616_200025704644 [1,0,0,0,0,0|1,0,1]=3 556 B10R1.2 Cn1cccc(c1=O)O[13CH3] 7a_100000117616_200025704644 [1,0,0,0,0,0|1,0,1]=3 557 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_100000687173_200025704644 [1,0,0,0,0,0|1,1,1]=4 558 B10R1.2 Cn1cccc(c1=O)S[13CH3] 62a_200025704644_100000687173 [1,0,0,0,0,0|1,1,1]=4 559 B10R1.2 N#Cc1cccc(c1F)O 271570a_203496583355_100011934600 [1,0,0,0,0,0|3,0,0]=4 560 B10R1.2 N#Cc1cccc(c1N)O 271570a_203496583355_100000690598 [1,0,0,0,0,0|3,0,0]=4 561 B10R1.2 N#Cc1cccc(c1O)Br 271570a_203496583355_100000703783 [1,0,0,0,0,0|3,0,0]=4 562 B10R1.2 N#Cc1cccc(c1O)Cl 271570a_203496583355_100010134094 [1,0,0,0,0,0|3,0,0]=4 563 B10R1.2 N#Cc1cccc(c1O)F 271570a_203496583355_100011219237 [1,0,0,0,0,0|3,0,0]=4 564 B10R1.2 N#Cc1cccc(c1O)N 271570a_203496583355_100009877206 [1,0,0,0,0,0|3,0,0]=4 565 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,0,0,0,0,0|2,0,0]=3 566 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,0,0,0,0,0|2,0,0]=3 567 B10R1.2 NCc1cccc(c1F)O 271570a_203496583355_100015189953 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,0,0,0,0,0|3,0,0]=4 569 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,0,0,0,0,0|3,0,0]=4 572 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,0,0,0,0,0|2,0,0]=3 573 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,0,0,0,0,0|2,0,0]=3 574 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [1,0,0,0,0,0|3,0,0]=4 575 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [1,0,0,0,0,0|3,0,0]=4 576 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,0,0,0,0,0|3,0,0]=4 577 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,0,0,0,0,0|3,0,0]=4 578 B10R1.2 [13CH3]Nc1cccc(c1Br)Cl 34a_100000687072_200025704644 [1,0,0,0,0,0|3,0,0]=4 579 B10R1.2 [13CH3]Nc1cccc(c1Br)F 34a_100011934729_200025704644 [1,0,0,0,0,0|3,0,0]=4 580 B10R1.2 [13CH3]Nc1cccc(c1Br)O 34a_100012183704_200025704644 [1,0,0,0,0,0|2,0,0]=3 581 B10R1.2 [13CH3]Nc1cccc(c1Br)O 7a_100012183704_200025704644 [1,0,0,0,0,0|2,0,0]=3 582 B10R1.2 [13CH3]Nc1cccc(c1Cl)Br 34a_100000687075_200025704644 [1,0,0,0,0,0|3,0,0]=4 583 B10R1.2 [13CH3]Nc1cccc(c1Cl)Cl 34a_100000185733_200025704644 [1,0,0,0,0,0|3,0,0]=4 584 B10R1.2 [13CH3]Nc1cccc(c1Cl)F 34a_100000692321_200025704644 [1,0,0,0,0,0|3,0,0]=4 585 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 34a_100012002038_200025704644 [1,0,0,0,0,0|2,0,0]=3 586 B10R1.2 [13CH3]Nc1cccc(c1Cl)O 7a_100012002038_200025704644 [1,0,0,0,0,0|2,0,0]=3 587 B10R1.2 [13CH3]Nc1cccc(c1F)Br 2230a_100011935091_200025704644 [1,0,0,0,0,0|3,0,0]=4 588 B10R1.2 [13CH3]Nc1cccc(c1F)Br 34a_100011935091_200025704644 [1,0,0,0,0,0|3,0,0]=4 589 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 2230a_100000199060_200025704644 [1,0,0,0,0,0|3,0,0]=4 590 B10R1.2 [13CH3]Nc1cccc(c1F)Cl 34a_100000199060_200025704644 [1,0,0,0,0,0|3,0,0]=4 591 B10R1.2 [13CH3]Nc1cccc(c1F)F 34a_100000743855_200025704644 [1,0,0,0,0,0|3,0,0]=4 592 B10R1.2 [13CH3]Nc1cccc(c1I)Br 34a_100020590159_200025704644 [1,0,0,0,0,0|3,0,0]=4 593 B10R1.2 [13CH3]Nc1cccc(c1I)Cl 34a_100000049713_200025704644 [1,0,0,0,0,0|3,0,0]=4 594 B10R1.2 [13CH3]Nc1cccc(c1I)F 34a_100000690935_200025704644 [1,0,0,0,0,0|3,0,0]=4 595 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,0,0,0,0,0|2,0,0]=3 596 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,0,0,0,0,0|2,0,0]=3 597 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,0,0,0,0,0|2,0,0]=3 598 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 34a_100010187966_200025704644 [1,0,0,0,0,0|2,0,0]=3 599 B10R1.2 [13CH3]Oc1cccc(c1Br)Br 7a_100010187966_200025704644 [1,0,0,0,0,0|2,0,0]=3 600 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 34a_100012348804_200025704644 [1,0,0,0,0,0|2,0,0]=3 601 B10R1.2 [13CH3]Oc1cccc(c1Br)Cl 7a_100012348804_200025704644 [1,0,0,0,0,0|2,0,0]=3 602 B10R1.2 [13CH3]Oc1cccc(c1Br)F 34a_100009820682_200025704644 [1,0,0,0,0,0|2,0,0]=3 603 B10R1.2 [13CH3]Oc1cccc(c1Br)F 7a_100009820682_200025704644 [1,0,0,0,0,0|2,0,0]=3 604 B10R1.2 [13CH3]Oc1cccc(c1Br)I 34a_100010187914_200025704644 [1,0,0,0,0,0|2,0,0]=3 605 B10R1.2 [13CH3]Oc1cccc(c1Br)I 7a_100010187914_200025704644 [1,0,0,0,0,0|2,0,0]=3 606 B10R1.2 [13CH3]Oc1cccc(c1Br)N 34a_100012183704_200025704644 [1,0,0,0,0,0|2,0,0]=3 607 B10R1.2 [13CH3]Oc1cccc(c1Br)N 7a_100012183704_200025704644 [1,0,0,0,0,0|2,0,0]=3 608 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 34a_100010187913_200025704644 [1,0,0,0,0,0|2,0,0]=3 609 B10R1.2 [13CH3]Oc1cccc(c1Cl)Br 7a_100010187913_200025704644 [1,0,0,0,0,0|2,0,0]=3 610 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 34a_100000211076_200025704644 [1,0,0,0,0,0|2,0,0]=3 611 B10R1.2 [13CH3]Oc1cccc(c1Cl)Cl 7a_100000211076_200025704644 [1,0,0,0,0,0|2,0,0]=3 612 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 34a_100000087408_200025704644 [1,0,0,0,0,0|2,0,0]=3 613 B10R1.2 [13CH3]Oc1cccc(c1Cl)F 7a_100000087408_200025704644 [1,0,0,0,0,0|2,0,0]=3 614 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 34a_100000049636_200025704644 [1,0,0,0,0,0|2,0,0]=3 615 B10R1.2 [13CH3]Oc1cccc(c1Cl)I 7a_100000049636_200025704644 [1,0,0,0,0,0|2,0,0]=3 616 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 34a_100012002038_200025704644 [1,0,0,0,0,0|2,0,0]=3 617 B10R1.2 [13CH3]Oc1cccc(c1Cl)N 7a_100012002038_200025704644 [1,0,0,0,0,0|2,0,0]=3 618 B10R1.2 [13CH3]Oc1cccc(c1F)Br 34a_100009817021_200025704644 [1,0,0,0,0,0|2,0,0]=3 619 B10R1.2 [13CH3]Oc1cccc(c1F)Br 7a_100009817021_200025704644 [1,0,0,0,0,0|2,0,0]=3 620 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 34a_100000687438_200025704644 [1,0,0,0,0,0|2,0,0]=3 621 B10R1.2 [13CH3]Oc1cccc(c1F)Cl 7a_100000687438_200025704644 [1,0,0,0,0,0|2,0,0]=3 622 B10R1.2 [13CH3]Oc1cccc(c1F)F 34a_100000751161_200025704644 [1,0,0,0,0,0|2,0,0]=3 623 B10R1.2 [13CH3]Oc1cccc(c1F)F 7a_100000751161_200025704644 [1,0,0,0,0,0|2,0,0]=3 624 B10R1.2 [13CH3]Oc1cccc(c1I)Br 34a_100010187912_200025704644 [1,0,0,0,0,0|2,0,0]=3 625 B10R1.2 [13CH3]Oc1cccc(c1I)Br 7a_100010187912_200025704644 [1,0,0,0,0,0|2,0,0]=3 626 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 34a_100000050174_200025704644 [1,0,0,0,0,0|2,0,0]=3 627 B10R1.2 [13CH3]Oc1cccc(c1I)Cl 7a_100000050174_200025704644 [1,0,0,0,0,0|2,0,0]=3 628 B10R1.2 [13CH3]Oc1cccc(c1I)F 34a_100000690913_200025704644 [1,0,0,0,0,0|2,0,0]=3 629 B10R1.2 [13CH3]Oc1cccc(c1I)F 7a_100000690913_200025704644 [1,0,0,0,0,0|2,0,0]=3 630 B10R1.2 [13CH3]Oc1cccc(c1N)Br 34a_100011934926_200025704644 [1,0,0,0,0,0|2,0,0]=3 631 B10R1.2 [13CH3]Oc1cccc(c1N)Br 7a_100011934926_200025704644 [1,0,0,0,0,0|2,0,0]=3 632 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 34a_100012022510_200025704644 [1,0,0,0,0,0|2,0,0]=3 633 B10R1.2 [13CH3]Oc1cccc(c1N)Cl 7a_100012022510_200025704644 [1,0,0,0,0,0|2,0,0]=3 634 B10R1.2 [13CH3]Oc1cccc(c1N)F 34a_100020591140_200025704644 [1,0,0,0,0,0|2,0,0]=3 635 B10R1.2 [13CH3]Oc1cccc(c1N)F 7a_100020591140_200025704644 [1,0,0,0,0,0|2,0,0]=3 636 B10R1.2 [13CH3]Oc1cccc(c1N)I 34a_200000049512_200025704644 [1,0,0,0,0,0|2,0,0]=3 637 B10R1.2 [13CH3]Oc1cccc(c1N)I 7a_200000049512_200025704644 [1,0,0,0,0,0|2,0,0]=3 638 B10R1.2 [13CH3]Oc1cccc(c1N)N 34a_100000033209_200025704644 [1,0,0,0,0,0|2,0,0]=3 639 B10R1.2 [13CH3]Oc1ccnc(c1Br)Cl 34a_100010136240_200025704644 [1,0,0,0,0,0|3,0,0]=4 640 B10R1.2 [13CH3]Oc1ccnc(c1Cl)Cl 34a_100009860235_200025704644 [1,0,0,0,0,0|3,0,0]=4 641 B10R1.2 [13CH3]Oc1ccnc(c1F)Br 34a_100009876375_200025704644 [1,0,0,0,0,0|3,0,0]=4 642 B10R1.2 [13CH3]Oc1ccnc(c1F)Cl 34a_100009856406_200025704644 [1,0,0,0,0,0|3,0,0]=4 643 B10R1.2 [13CH3]Oc1ccnc(c1N)Cl 34a_100000128729_200025704644 [1,0,0,0,0,0|3,0,0]=4 644 B10R1.2 [13CH3]Oc1nccc(c1Cl)N 34a_200000093555_200025704644 [1,0,0,0,0,0|3,0,0]=4 645 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_100010175083_200025704644 [1,0,0,0,0,0|2,1,0]=4 646 B10R1.2 [13CH3]Sc1cccc(c1Br)Br 62a_200025704644_100010175083 [1,0,0,0,0,0|2,1,0]=4 647 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_100014021842_200025704644 [1,0,0,0,0,0|2,1,0]=4 648 B10R1.2 [13CH3]Sc1cccc(c1Br)Cl 62a_200025704644_100014021842 [1,0,0,0,0,0|2,1,0]=4 649 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_100010202630_200025704644 [1,0,0,0,0,0|2,1,0]=4 650 B10R1.2 [13CH3]Sc1cccc(c1Br)F 62a_200025704644_100010202630 [1,0,0,0,0,0|2,1,0]=4 651 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_100010187914_200025704644 [1,0,0,0,0,0|1,1,0]=3 652 B10R1.2 [13CH3]Sc1cccc(c1Br)O 62a_200025704644_100010187914 [1,0,0,0,0,0|1,1,0]=3 653 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_100010142854_200025704644 [1,0,0,0,0,0|2,1,0]=4 654 B10R1.2 [13CH3]Sc1cccc(c1Cl)Br 62a_200025704644_100010142854 [1,0,0,0,0,0|2,1,0]=4 655 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_100011215384_200025704644 [1,0,0,0,0,0|2,1,0]=4 656 B10R1.2 [13CH3]Sc1cccc(c1Cl)Cl 62a_200025704644_100011215384 [1,0,0,0,0,0|2,1,0]=4 657 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200010234923_200025704644 [1,0,0,0,0,0|2,1,0]=4 658 B10R1.2 [13CH3]Sc1cccc(c1Cl)F 62a_200025704644_200010234923 [1,0,0,0,0,0|2,1,0]=4 659 B10R1.2 [13CH3]Sc1cccc(c1Cl)O 62a_200025704644_100000049636 [1,0,0,0,0,0|1,1,0]=3 660 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_100000702267_200025704644 [1,0,0,0,0,0|2,1,0]=4 661 B10R1.2 [13CH3]Sc1cccc(c1F)Br 62a_200025704644_100000702267 [1,0,0,0,0,0|2,1,0]=4 662 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_100011217346_200025704644 [1,0,0,0,0,0|2,1,0]=4 663 B10R1.2 [13CH3]Sc1cccc(c1F)Cl 62a_200025704644_100011217346 [1,0,0,0,0,0|2,1,0]=4 664 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_100000694657_200025704644 [1,0,0,0,0,0|2,1,0]=4 665 B10R1.2 [13CH3]Sc1cccc(c1F)F 62a_200025704644_100000694657 [1,0,0,0,0,0|2,1,0]=4 666 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_100011935091_200025704644 [1,0,0,0,0,0|2,1,0]=4 667 B10R1.2 [13CH3]Sc1cccc(c1F)N 62a_200025704644_100011935091 [1,0,0,0,0,0|2,1,0]=4 668 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_100009817021_200025704644 [1,0,0,0,0,0|1,1,0]=3 669 B10R1.2 [13CH3]Sc1cccc(c1F)O 62a_200025704644_100009817021 [1,0,0,0,0,0|1,1,0]=3 670 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_100010146558_200025704644 [1,0,0,0,0,0|2,1,0]=4 671 B10R1.2 [13CH3]Sc1cccc(c1N)Br 62a_200025704644_100010146558 [1,0,0,0,0,0|2,1,0]=4 672 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_100010190421_200025704644 [1,0,0,0,0,0|2,1,0]=4 673 B10R1.2 [13CH3]Sc1cccc(c1N)Cl 62a_200025704644_100010190421 [1,0,0,0,0,0|2,1,0]=4 674 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_100000042321_200025704644 [1,0,0,0,0,0|2,1,0]=4 675 B10R1.2 [13CH3]Sc1cccc(c1N)F 62a_200025704644_100000042321 [1,0,0,0,0,0|2,1,0]=4 676 B10R1.2 [13CH3]Sc1cccc(c1N)N 62a_100015191791_200025704644 [1,0,0,0,0,0|2,1,0]=4 677 B10R1.2 [13CH3]Sc1cccc(c1N)O 62a_200025704644_100011934926 [1,0,0,0,0,0|1,1,0]=3 678 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,0,0,0,0,0|1,1,0]=3 679 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,0,0,0,0,0|1,1,0]=3 680 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,0,0,0,0,0|1,1,0]=3 681 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,0,0,0,0,0|1,1,0]=3 682 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,0,0,0,0,0|1,1,0]=3 683 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,0,0,0,0,0|1,1,0]=3 684 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,0,0,0,0,0|1,1,0]=3 685 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,0,0,0,0,0|1,1,0]=3 686 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,0,0,0,0,0|0,1,0]=2 687 B10R1.2 [13CH3]Sc1ccnc(c1O)Cl 62a_200025704644_100010067911 [1,0,0,0,0,0|2,1,0]=4 688 B10R1.2 [13CH3]Sc1cncc(c1O)N 62a_100000694263_200025704644 [1,0,0,0,0,0|2,1,0]=4 689 B10R1.2 [13CH3]Sc1cncc(c1O)N 62a_200025704644_100000694263 [1,0,0,0,0,0|2,1,0]=4 690 B10R1.2 [13CH3]Sc1nccc(c1F)O 62a_100009876375_200025704644 [1,0,0,0,0,0|2,1,0]=4 691 B10R1.2 [13CH3]Sc1nccc(c1F)O 62a_200025704644_100009876375 [1,0,0,0,0,0|2,1,0]=4 692 B10R1.2 [13CH3]Sc1nccc(c1O)F 62a_200025704644_100009867227 [1,0,0,0,0,0|2,1,0]=4 693 B10R1.2 [13CH3]Sc1nccc(c1O)N 62a_200025704644_100009844647 [1,0,0,0,0,0|2,1,0]=4 694 B10R1.172 C#Cc1cccc(c1)NC 2230a_100000735509_200000210301 [1,0,0,0,0,0|2,0,1]=4 695 B10R1.172 C#Cc1cccc(c1)NC 34a_100000735509_200000210301 [1,0,0,0,0,0|2,0,1]=4 696 B10R1.172 C#Cc1cccc(c1)N[13CH3] 2230a_100000735509_200025704644 [1,0,0,0,0,0|2,0,1]=4 697 B10R1.172 C#Cc1cccc(c1)N[13CH3] 34a_100000735509_200025704644 [1,0,0,0,0,0|2,0,1]=4 698 B10R1.172 C#Cc1cccc(c1)OC 34a_100011216014_200000210301 [1,0,0,0,0,0|1,0,1]=3 699 B10R1.172 C#Cc1cccc(c1)OC 7a_100011216014_200000210301 [1,0,0,0,0,0|1,0,1]=3 700 B10R1.172 C#Cc1cccc(c1)O[13CH3] 34a_100011216014_200025704644 [1,0,0,0,0,0|1,0,1]=3 701 B10R1.172 C#Cc1cccc(c1)O[13CH3] 7a_100011216014_200025704644 [1,0,0,0,0,0|1,0,1]=3 702 B10R1.172 C=Cc1cc(ccn1)OC 271570a_100011290941_100011216251 [1,0,0,0,0,0|2,0,1]=4 703 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [1,0,0,0,0,0|2,0,1]=4 704 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [1,0,0,0,0,0|2,0,1]=4 705 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [1,0,0,0,0,0|2,0,1]=4 706 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [1,0,0,0,0,0|2,0,1]=4 707 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [1,0,0,0,0,0|1,0,1]=3 708 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [1,0,0,0,0,0|1,0,1]=3 709 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [1,0,0,0,0,0|1,0,1]=3 710 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [1,0,0,0,0,0|1,0,1]=3 711 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [1,0,0,0,0,0|1,0,1]=3 712 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [1,0,0,0,0,0|1,1,1]=4 713 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [1,0,0,0,0,0|1,1,1]=4 714 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [1,0,0,0,0,0|1,1,1]=4 715 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [1,0,0,0,0,0|1,1,1]=4 716 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [1,0,0,0,0,0|1,1,1]=4 717 B10R1.172 C=Cc1cccc(n1)OC 271570a_100011290941_100000760917 [1,0,0,0,0,0|2,0,1]=4 718 B10R1.172 C=Cc1ccnc(c1)OC 271570a_100011290941_100000117307 [1,0,0,0,0,0|2,0,1]=4 719 B10R1.172 C=Cc1cncc(c1)OC 271570a_100011290941_100000684773 [1,0,0,0,0,0|2,0,1]=4 720 B10R1.172 CC[n+]1cccc(c1)OC 34a_100000731997_200000210301 [1,0,0,0,0,0|2,0,0]=3 721 B10R1.172 CC[n+]1cccc(c1)OC 7a_100000731997_200000210301 [1,0,0,0,0,0|2,0,0]=3 722 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 34a_100000731997_200025704644 [1,0,0,0,0,0|2,0,0]=3 723 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 7a_100000731997_200025704644 [1,0,0,0,0,0|2,0,0]=3 724 B10R1.172 CCc1cc(ccn1)NC 27a_100102657272_100009820011 [1,0,0,0,0,0|3,0,0]=4 725 B10R1.172 CCc1cc(ccn1)SC 62a_100009820011_200000210301 [1,0,0,0,0,0|2,1,0]=4 726 B10R1.172 CCc1cc(ccn1)SC 62a_200000210301_100009820011 [1,0,0,0,0,0|2,1,0]=4 727 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_100009820011_200025704644 [1,0,0,0,0,0|2,1,0]=4 728 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_200025704644_100009820011 [1,0,0,0,0,0|2,1,0]=4 729 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [1,0,0,0,0,0|2,0,0]=3 730 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [1,0,0,0,0,0|2,0,0]=3 731 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [1,0,0,0,0,0|2,0,0]=3 732 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [1,0,0,0,0,0|2,0,0]=3 733 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [1,0,0,0,0,0|2,0,0]=3 734 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [1,0,0,0,0,0|2,0,0]=3 735 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [1,0,0,0,0,0|1,0,0]=2 736 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [1,0,0,0,0,0|1,0,0]=2 737 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [1,0,0,0,0,0|1,0,0]=2 738 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [1,0,0,0,0,0|1,0,0]=2 739 B10R1.172 CCc1cccc(c1)SC 62a_100011263222_200000210301 [1,0,0,0,0,0|1,1,0]=3 740 B10R1.172 CCc1cccc(c1)SC 62a_200000210301_100011263222 [1,0,0,0,0,0|1,1,0]=3 741 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_100011263222_200025704644 [1,0,0,0,0,0|1,1,0]=3 742 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_200025704644_100011263222 [1,0,0,0,0,0|1,1,0]=3 743 B10R1.172 CCc1cccc(n1)SC 62a_100009856026_200000210301 [1,0,0,0,0,0|2,1,0]=4 744 B10R1.172 CCc1cccc(n1)SC 62a_200000210301_100009856026 [1,0,0,0,0,0|2,1,0]=4 745 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_100009856026_200025704644 [1,0,0,0,0,0|2,1,0]=4 746 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_200025704644_100009856026 [1,0,0,0,0,0|2,1,0]=4 747 B10R1.172 CCc1ccnc(c1)NC 27a_100102657272_100009817561 [1,0,0,0,0,0|3,0,0]=4 748 B10R1.172 CCc1ccnc(c1)SC 62a_100009817561_200000210301 [1,0,0,0,0,0|2,1,0]=4 749 B10R1.172 CCc1ccnc(c1)SC 62a_200000210301_100009817561 [1,0,0,0,0,0|2,1,0]=4 750 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_100009817561_200025704644 [1,0,0,0,0,0|2,1,0]=4 751 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_200025704644_100009817561 [1,0,0,0,0,0|2,1,0]=4 752 B10R1.172 CCc1cncc(c1)OC 34a_200009861530_200000210301 [1,0,0,0,0,0|2,0,0]=3 753 B10R1.172 CCc1cncc(c1)OC 7a_200009861530_200000210301 [1,0,0,0,0,0|2,0,0]=3 754 B10R1.172 CCc1cncc(c1)O[13CH3] 34a_200009861530_200025704644 [1,0,0,0,0,0|2,0,0]=3 755 B10R1.172 CCc1cncc(c1)O[13CH3] 7a_200009861530_200025704644 [1,0,0,0,0,0|2,0,0]=3 756 B10R1.172 CCc1cncc(c1)SC 62a_200000210301_200009819073 [1,0,0,0,0,0|2,1,0]=4 757 B10R1.172 CCc1cncc(c1)SC 62a_200009819073_200000210301 [1,0,0,0,0,0|2,1,0]=4 758 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200009819073_200025704644 [1,0,0,0,0,0|2,1,0]=4 759 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200025704644_200009819073 [1,0,0,0,0,0|2,1,0]=4 760 B10R1.172 CNc1cc(ccn1)SC 62a_100009819592_200000210301 [1,0,0,0,0,0|2,1,0]=4 761 B10R1.172 CNc1cc(ccn1)SC 62a_200000210301_100009819592 [1,0,0,0,0,0|2,1,0]=4 762 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_100009819592_200025704644 [1,0,0,0,0,0|2,1,0]=4 763 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_200025704644_100009819592 [1,0,0,0,0,0|2,1,0]=4 764 B10R1.172 CNc1cc(ncn1)OC 27a_100102657272_100000049997 [1,0,0,0,0,0|3,0,0]=4 765 B10R1.172 CNc1cccc(c1)C#N 34a_100000210922_200000210301 [1,0,0,0,0,0|3,0,0]=4 766 B10R1.172 CNc1cccc(c1)C#N 7a_100000210922_200000210301 [1,0,0,0,0,0|3,0,0]=4 767 B10R1.172 CNc1cccc(c1)CF 2230a_100000126320_200000210301 [1,0,0,0,0,0|3,0,0]=4 768 B10R1.172 CNc1cccc(c1)CF 34a_100000126320_200000210301 [1,0,0,0,0,0|3,0,0]=4 769 B10R1.172 CNc1cccc(c1)CF 7a_100000126320_200000210301 [1,0,0,0,0,0|3,0,0]=4 770 B10R1.172 CNc1cccc(c1)CO 2230a_100000211919_200000210301 [1,0,0,0,0,0|3,0,0]=4 771 B10R1.172 CNc1cccc(c1)CO 34a_100000211919_200000210301 [1,0,0,0,0,0|3,0,0]=4 772 B10R1.172 CNc1cccc(c1)OC 34a_100000210024_200000210301 [1,0,0,0,0,0|1,0,0]=2 773 B10R1.172 CNc1cccc(c1)OC 34a_100000756613_200000210301 [1,0,0,0,0,0|1,0,0]=2 774 B10R1.172 CNc1cccc(c1)OC 7a_100000756613_200000210301 [1,0,0,0,0,0|1,0,0]=2 775 B10R1.172 CNc1cccc(c1)O[13CH3] 34a_100000756613_200025704644 [1,0,0,0,0,0|1,0,0]=2 776 B10R1.172 CNc1cccc(c1)O[13CH3] 7a_100000756613_200025704644 [1,0,0,0,0,0|1,0,0]=2 777 B10R1.172 CNc1cccc(c1)SC 2230a_100000210049_200000210301 [1,0,0,0,0,0|1,1,0]=3 778 B10R1.172 CNc1cccc(c1)SC 34a_100000210049_200000210301 [1,0,0,0,0,0|1,1,0]=3 779 B10R1.172 CNc1cccc(c1)SC 62a_100000219648_200000210301 [1,0,0,0,0,0|1,1,0]=3 780 B10R1.172 CNc1cccc(c1)SC 62a_200000210301_100000219648 [1,0,0,0,0,0|1,1,0]=3 781 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_100000219648_200025704644 [1,0,0,0,0,0|1,1,0]=3 782 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_200025704644_100000219648 [1,0,0,0,0,0|1,1,0]=3 783 B10R1.172 CNc1cccc(n1)SC 62a_100000703281_200000210301 [1,0,0,0,0,0|2,1,0]=4 784 B10R1.172 CNc1cccc(n1)SC 62a_200000210301_100000703281 [1,0,0,0,0,0|2,1,0]=4 785 B10R1.172 CNc1cccc(n1)S[13CH3] 62a_100000703281_200025704644 [1,0,0,0,0,0|2,1,0]=4 786 B10R1.172 CNc1cccc(n1)S[13CH3] 62a_200025704644_100000703281 [1,0,0,0,0,0|2,1,0]=4 787 B10R1.172 CNc1ccnc(c1)SC 62a_100009869472_200000210301 [1,0,0,0,0,0|2,1,0]=4 788 B10R1.172 CNc1ccnc(c1)SC 62a_200000210301_100009869472 [1,0,0,0,0,0|2,1,0]=4 789 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_100009869472_200025704644 [1,0,0,0,0,0|2,1,0]=4 790 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_200025704644_100009869472 [1,0,0,0,0,0|2,1,0]=4 791 B10R1.172 CNc1ccnc(n1)OC 27a_100102657272_100000069072 [1,0,0,0,0,0|3,0,0]=4 792 B10R1.172 CNc1cncc(c1)SC 62a_100012184536_200000210301 [1,0,0,0,0,0|2,1,0]=4 793 B10R1.172 CNc1cncc(c1)SC 62a_200000210301_100012184536 [1,0,0,0,0,0|2,1,0]=4 794 B10R1.172 CNc1cncc(c1)S[13CH3] 62a_100012184536_200025704644 [1,0,0,0,0,0|2,1,0]=4 795 B10R1.172 CNc1cncc(c1)S[13CH3] 62a_200025704644_100012184536 [1,0,0,0,0,0|2,1,0]=4 796 B10R1.172 CNc1cncc(n1)OC 27a_100102657272_100009819700 [1,0,0,0,0,0|3,0,0]=4 797 B10R1.172 CNc1nccc(n1)OC 27a_100102657272_100000182009 [1,0,0,0,0,0|3,0,0]=4 798 B10R1.172 COc1cc(ccn1)CN 34a_100000748557_200000210301 [1,0,0,0,0,0|3,0,0]=4 799 B10R1.172 COc1cc(ccn1)O[13CH3] 34a_100012181050_200025704644 [1,0,0,0,0,0|1,0,0]=2 800 B10R1.172 COc1cc(ccn1)SC 62a_100000117307_200000210301 [1,0,0,0,0,0|1,1,0]=3 801 B10R1.172 COc1cc(ccn1)SC 62a_200000210301_100000117307 [1,0,0,0,0,0|1,1,0]=3 802 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_100000117307_200025704644 [1,0,0,0,0,0|1,1,0]=3 803 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_200025704644_100000117307 [1,0,0,0,0,0|1,1,0]=3 804 B10R1.172 COc1cc(ncn1)SC 62a_100000049997_200000210301 [1,0,0,0,0,0|2,1,0]=4 805 B10R1.172 COc1cc(ncn1)SC 62a_200000210301_100000049997 [1,0,0,0,0,0|2,1,0]=4 806 B10R1.172 COc1cc(ncn1)S[13CH3] 62a_100000049997_200025704644 [1,0,0,0,0,0|2,1,0]=4 807 B10R1.172 COc1cc(ncn1)S[13CH3] 62a_200025704644_100000049997 [1,0,0,0,0,0|2,1,0]=4 808 B10R1.172 COc1cccc(c1)C#N 34a_100000184713_200000210301 [1,0,0,0,0,0|2,0,0]=3 809 B10R1.172 COc1cccc(c1)C#N 7a_100000184713_200000210301 [1,0,0,0,0,0|2,0,0]=3 810 B10R1.172 COc1cccc(c1)CBr 34a_100011660834_200000210301 [1,0,0,0,0,0|2,0,0]=3 811 B10R1.172 COc1cccc(c1)CBr 7a_100011660834_200000210301 [1,0,0,0,0,0|2,0,0]=3 812 B10R1.172 COc1cccc(c1)CCl 34a_100000084143_200000210301 [1,0,0,0,0,0|2,0,0]=3 813 B10R1.172 COc1cccc(c1)CCl 7a_100000084143_200000210301 [1,0,0,0,0,0|2,0,0]=3 814 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [1,0,0,0,0,0|2,0,0]=3 815 B10R1.172 COc1cccc(c1)CO 34a_100011214949_200000210301 [1,0,0,0,0,0|2,0,0]=3 816 B10R1.172 COc1cccc(c1)CO 7a_100011214949_200000210301 [1,0,0,0,0,0|2,0,0]=3 817 B10R1.172 COc1cccc(c1)N[13CH3] 34a_100000210024_200025704644 [1,0,0,0,0,0|1,0,0]=2 818 B10R1.172 COc1cccc(c1)OC 34a_100000211255_200000210301 [1,0,0,0,0,0|0,0,0]=1 819 B10R1.172 COc1cccc(c1)OC 7a_100000211255_200000210301 [1,0,0,0,0,0|0,0,0]=1 820 B10R1.172 COc1cccc(c1)O[13CH3] 34a_100000211255_200025704644 [1,0,0,0,0,0|0,0,0]=1 821 B10R1.172 COc1cccc(c1)O[13CH3] 7a_100000211255_200025704644 [1,0,0,0,0,0|0,0,0]=1 822 B10R1.172 COc1cccc(c1)SC 34a_100011265683_200000210301 [1,0,0,0,0,0|0,1,0]=2 823 B10R1.172 COc1cccc(c1)SC 62a_200000210301_100000170001 [1,0,0,0,0,0|0,1,0]=2 824 B10R1.172 COc1cccc(c1)SC 7a_100011265683_200000210301 [1,0,0,0,0,0|0,1,0]=2 825 B10R1.172 COc1cccc(c1)S[13CH3] 62a_200025704644_100000170001 [1,0,0,0,0,0|0,1,0]=2 826 B10R1.172 COc1cccc(n1)SC 62a_100000760917_200000210301 [1,0,0,0,0,0|1,1,0]=3 827 B10R1.172 COc1cccc(n1)SC 62a_200000210301_100000760917 [1,0,0,0,0,0|1,1,0]=3 828 B10R1.172 COc1cccc(n1)S[13CH3] 62a_100000760917_200025704644 [1,0,0,0,0,0|1,1,0]=3 829 B10R1.172 COc1cccc(n1)S[13CH3] 62a_200025704644_100000760917 [1,0,0,0,0,0|1,1,0]=3 830 B10R1.172 COc1ccnc(c1)C#N 34a_100011777083_200000210301 [1,0,0,0,0,0|3,0,0]=4 831 B10R1.172 COc1ccnc(c1)C#N 7a_100011777083_200000210301 [1,0,0,0,0,0|3,0,0]=4 832 B10R1.172 COc1ccnc(c1)OC 34a_100012181050_200000210301 [1,0,0,0,0,0|1,0,0]=2 833 B10R1.172 COc1ccnc(c1)SC 62a_100009817693_200000210301 [1,0,0,0,0,0|1,1,0]=3 834 B10R1.172 COc1ccnc(c1)SC 62a_200000210301_100011216251 [1,0,0,0,0,0|1,1,0]=3 835 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_100009817693_200025704644 [1,0,0,0,0,0|1,1,0]=3 836 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_200025704644_100011216251 [1,0,0,0,0,0|1,1,0]=3 837 B10R1.172 COc1ccnc(n1)SC 62a_100000182009_200000210301 [1,0,0,0,0,0|2,1,0]=4 838 B10R1.172 COc1ccnc(n1)SC 62a_200000210301_100000182009 [1,0,0,0,0,0|2,1,0]=4 839 B10R1.172 COc1ccnc(n1)S[13CH3] 62a_100000182009_200025704644 [1,0,0,0,0,0|2,1,0]=4 840 B10R1.172 COc1ccnc(n1)S[13CH3] 62a_200025704644_100000182009 [1,0,0,0,0,0|2,1,0]=4 841 B10R1.172 COc1cncc(c1)C#N 34a_100012002025_200000210301 [1,0,0,0,0,0|3,0,0]=4 842 B10R1.172 COc1cncc(c1)C#N 7a_100012002025_200000210301 [1,0,0,0,0,0|3,0,0]=4 843 B10R1.172 COc1cncc(c1)OC 34a_100000084572_200000210301 [1,0,0,0,0,0|1,0,0]=2 844 B10R1.172 COc1cncc(c1)OC 7a_100000084572_200000210301 [1,0,0,0,0,0|1,0,0]=2 845 B10R1.172 COc1cncc(c1)O[13CH3] 34a_100000084572_200025704644 [1,0,0,0,0,0|1,0,0]=2 846 B10R1.172 COc1cncc(c1)O[13CH3] 7a_100000084572_200025704644 [1,0,0,0,0,0|1,0,0]=2 847 B10R1.172 COc1cncc(c1)SC 62a_100000050176_200000210301 [1,0,0,0,0,0|1,1,0]=3 848 B10R1.172 COc1cncc(c1)SC 62a_200000210301_100000050176 [1,0,0,0,0,0|1,1,0]=3 849 B10R1.172 COc1cncc(c1)S[13CH3] 62a_100000050176_200025704644 [1,0,0,0,0,0|1,1,0]=3 850 B10R1.172 COc1cncc(c1)S[13CH3] 62a_200025704644_100000050176 [1,0,0,0,0,0|1,1,0]=3 851 B10R1.172 COc1cncc(n1)SC 62a_100000756030_200000210301 [1,0,0,0,0,0|2,1,0]=4 852 B10R1.172 COc1cncc(n1)SC 62a_200000210301_100000756030 [1,0,0,0,0,0|2,1,0]=4 853 B10R1.172 COc1cncc(n1)S[13CH3] 62a_100000756030_200025704644 [1,0,0,0,0,0|2,1,0]=4 854 B10R1.172 COc1cncc(n1)S[13CH3] 62a_200025704644_100000756030 [1,0,0,0,0,0|2,1,0]=4 855 B10R1.172 COc1cnnc(c1)SC 62a_200000210301_100000087634 [1,0,0,0,0,0|2,1,0]=4 856 B10R1.172 COc1cnnc(c1)S[13CH3] 62a_200025704644_100000087634 [1,0,0,0,0,0|2,1,0]=4 857 B10R1.172 COc1nccc(n1)SC 62a_100000069072_200000210301 [1,0,0,0,0,0|2,1,0]=4 858 B10R1.172 COc1nccc(n1)SC 62a_200000210301_100000069072 [1,0,0,0,0,0|2,1,0]=4 859 B10R1.172 COc1nccc(n1)S[13CH3] 62a_100000069072_200025704644 [1,0,0,0,0,0|2,1,0]=4 860 B10R1.172 COc1nccc(n1)S[13CH3] 62a_200025704644_100000069072 [1,0,0,0,0,0|2,1,0]=4 861 B10R1.172 CSc1cccc(c1)C#N 62a_200000210301_100000189340 [1,0,0,0,0,0|2,1,0]=4 862 B10R1.172 CSc1cccc(c1)C=O 62a_100000014684_200000210301 [1,0,0,0,0,0|2,1,0]=4 863 B10R1.172 CSc1cccc(c1)C=O 62a_200000210301_100000014684 [1,0,0,0,0,0|2,1,0]=4 864 B10R1.172 CSc1cccc(c1)CF 62a_100010878472_200000210301 [1,0,0,0,0,0|2,1,0]=4 865 B10R1.172 CSc1cccc(c1)CF 62a_200000210301_100010878472 [1,0,0,0,0,0|2,1,0]=4 866 B10R1.172 CSc1cccc(c1)CN 62a_100000106179_200000210301 [1,0,0,0,0,0|2,1,0]=4 867 B10R1.172 CSc1cccc(c1)CN 62a_200000210301_100000106179 [1,0,0,0,0,0|2,1,0]=4 868 B10R1.172 CSc1cccc(c1)CO 62a_100000687537_200000210301 [1,0,0,0,0,0|2,1,0]=4 869 B10R1.172 CSc1cccc(c1)CO 62a_200000210301_100000687537 [1,0,0,0,0,0|2,1,0]=4 870 B10R1.172 CSc1cccc(c1)NN 62a_100000217339_200000210301 [1,0,0,0,0,0|2,1,0]=4 871 B10R1.172 CSc1cccc(c1)NN 62a_200000210301_100000217339 [1,0,0,0,0,0|2,1,0]=4 872 B10R1.172 CSc1cccc(c1)N[13CH3] 2230a_100000210049_200025704644 [1,0,0,0,0,0|1,1,0]=3 873 B10R1.172 CSc1cccc(c1)N[13CH3] 34a_100000210049_200025704644 [1,0,0,0,0,0|1,1,0]=3 874 B10R1.172 CSc1cccc(c1)O[13CH3] 34a_100011265683_200025704644 [1,0,0,0,0,0|0,1,0]=2 875 B10R1.172 CSc1cccc(c1)O[13CH3] 7a_100011265683_200025704644 [1,0,0,0,0,0|0,1,0]=2 876 B10R1.172 CSc1cccc(c1)SC 62a_100011215954_200000210301 [1,0,0,0,0,0|0,2,0]=3 877 B10R1.172 CSc1cccc(c1)SC 62a_200000210301_100011215954 [1,0,0,0,0,0|0,2,0]=3 878 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_100011215954_200025704644 [1,0,0,0,0,0|0,2,0]=3 879 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_200025704644_100011215954 [1,0,0,0,0,0|0,2,0]=3 880 B10R1.172 CSc1cccc(n1)SC 62a_100011960944_200000210301 [1,0,0,0,0,0|1,2,0]=4 881 B10R1.172 CSc1cccc(n1)SC 62a_200000210301_100011960944 [1,0,0,0,0,0|1,2,0]=4 882 B10R1.172 CSc1cccc(n1)S[13CH3] 62a_100011960944_200025704644 [1,0,0,0,0,0|1,2,0]=4 883 B10R1.172 CSc1cccc(n1)S[13CH3] 62a_200025704644_100011960944 [1,0,0,0,0,0|1,2,0]=4 884 B10R1.172 CSc1ccnc(c1)SC 62a_100010883326_200000210301 [1,0,0,0,0,0|1,2,0]=4 885 B10R1.172 CSc1ccnc(c1)SC 62a_200000210301_100010883326 [1,0,0,0,0,0|1,2,0]=4 886 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_100010883326_200025704644 [1,0,0,0,0,0|1,2,0]=4 887 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_200025704644_100010883326 [1,0,0,0,0,0|1,2,0]=4 888 B10R1.172 CSc1cncc(c1)SC 62a_100009816972_200000210301 [1,0,0,0,0,0|1,2,0]=4 889 B10R1.172 CSc1cncc(c1)SC 62a_200000210301_100009816972 [1,0,0,0,0,0|1,2,0]=4 890 B10R1.172 CSc1cncc(c1)S[13CH3] 62a_100009816972_200025704644 [1,0,0,0,0,0|1,2,0]=4 891 B10R1.172 CSc1cncc(c1)S[13CH3] 62a_200025704644_100009816972 [1,0,0,0,0,0|1,2,0]=4 892 B10R1.172 [13CH3]Nc1cccc(c1)C#N 34a_100000210922_200025704644 [1,0,0,0,0,0|3,0,0]=4 893 B10R1.172 [13CH3]Nc1cccc(c1)C#N 7a_100000210922_200025704644 [1,0,0,0,0,0|3,0,0]=4 894 B10R1.172 [13CH3]Nc1cccc(c1)CF 2230a_100000126320_200025704644 [1,0,0,0,0,0|3,0,0]=4 895 B10R1.172 [13CH3]Nc1cccc(c1)CF 34a_100000126320_200025704644 [1,0,0,0,0,0|3,0,0]=4 896 B10R1.172 [13CH3]Nc1cccc(c1)CF 7a_100000126320_200025704644 [1,0,0,0,0,0|3,0,0]=4 897 B10R1.172 [13CH3]Nc1cccc(c1)CO 2230a_100000211919_200025704644 [1,0,0,0,0,0|3,0,0]=4 898 B10R1.172 [13CH3]Nc1cccc(c1)CO 34a_100000211919_200025704644 [1,0,0,0,0,0|3,0,0]=4 899 B10R1.172 [13CH3]Oc1cc(ccn1)CN 34a_100000748557_200025704644 [1,0,0,0,0,0|3,0,0]=4 900 B10R1.172 [13CH3]Oc1cccc(c1)C#N 34a_100000184713_200025704644 [1,0,0,0,0,0|2,0,0]=3 901 B10R1.172 [13CH3]Oc1cccc(c1)C#N 7a_100000184713_200025704644 [1,0,0,0,0,0|2,0,0]=3 902 B10R1.172 [13CH3]Oc1cccc(c1)CBr 34a_100011660834_200025704644 [1,0,0,0,0,0|2,0,0]=3 903 B10R1.172 [13CH3]Oc1cccc(c1)CBr 7a_100011660834_200025704644 [1,0,0,0,0,0|2,0,0]=3 904 B10R1.172 [13CH3]Oc1cccc(c1)CCl 34a_100000084143_200025704644 [1,0,0,0,0,0|2,0,0]=3 905 B10R1.172 [13CH3]Oc1cccc(c1)CCl 7a_100000084143_200025704644 [1,0,0,0,0,0|2,0,0]=3 906 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [1,0,0,0,0,0|2,0,0]=3 907 B10R1.172 [13CH3]Oc1cccc(c1)CO 34a_100011214949_200025704644 [1,0,0,0,0,0|2,0,0]=3 908 B10R1.172 [13CH3]Oc1cccc(c1)CO 7a_100011214949_200025704644 [1,0,0,0,0,0|2,0,0]=3 909 B10R1.172 [13CH3]Oc1ccnc(c1)C#N 34a_100011777083_200025704644 [1,0,0,0,0,0|3,0,0]=4 910 B10R1.172 [13CH3]Oc1ccnc(c1)C#N 7a_100011777083_200025704644 [1,0,0,0,0,0|3,0,0]=4 911 B10R1.172 [13CH3]Oc1cncc(c1)C#N 34a_100012002025_200025704644 [1,0,0,0,0,0|3,0,0]=4 912 B10R1.172 [13CH3]Oc1cncc(c1)C#N 7a_100012002025_200025704644 [1,0,0,0,0,0|3,0,0]=4 913 B10R1.172 [13CH3]Sc1cccc(c1)C#N 62a_200025704644_100000189340 [1,0,0,0,0,0|2,1,0]=4 914 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_100000014684_200025704644 [1,0,0,0,0,0|2,1,0]=4 915 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_200025704644_100000014684 [1,0,0,0,0,0|2,1,0]=4 916 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_100010878472_200025704644 [1,0,0,0,0,0|2,1,0]=4 917 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_200025704644_100010878472 [1,0,0,0,0,0|2,1,0]=4 918 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_100000106179_200025704644 [1,0,0,0,0,0|2,1,0]=4 919 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_200025704644_100000106179 [1,0,0,0,0,0|2,1,0]=4 920 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_100000687537_200025704644 [1,0,0,0,0,0|2,1,0]=4 921 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_200025704644_100000687537 [1,0,0,0,0,0|2,1,0]=4 922 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_100000217339_200025704644 [1,0,0,0,0,0|2,1,0]=4 923 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_200025704644_100000217339 [1,0,0,0,0,0|2,1,0]=4 924 B12R1.235 C=Cc1cc(cc(c1N)OC)F 271570a_100011290941_100011004115 [0,1,0,0,0,0|2,0,1]=4 925 B12R1.235 C=Cc1cc(cc(c1O)OC)F 271570a_100011290941_200010391102 [0,1,0,0,0,0|1,0,1]=3 926 B12R1.235 CCc1cc(cc(c1N)CC)O 271570a_203496583355_100011216614 [0,1,0,0,0,0|3,0,0]=4 927 B12R1.235 CCc1cc(cc(c1O)CC)Br 271570a_203496583355_100010205833 [0,1,0,0,0,0|2,0,0]=3 928 B12R1.235 CCc1cc(cc(c1O)CC)C 271570a_203496583355_100010203090 [0,1,0,0,0,0|2,0,0]=3 929 B12R1.235 CNc1cc(cc(c1N)SC)F 62a_200000210301_200102954750 [0,1,0,0,0,0|2,1,0]=4 930 B12R1.235 CNc1cc(cc(c1N)SC)F 62a_200102954750_200000210301 [0,1,0,0,0,0|2,1,0]=4 931 B12R1.235 CNc1cc(cc(c1N)S[13CH3])F 62a_200025704644_200102954750 [0,1,0,0,0,0|2,1,0]=4 932 B12R1.235 CNc1cc(cc(c1N)S[13CH3])F 62a_200102954750_200025704644 [0,1,0,0,0,0|2,1,0]=4 933 B12R1.235 COc1cc(cc(c1F)OC)Br 34a_200015524394_200000210301 [0,1,0,0,0,0|1,0,0]=2 934 B12R1.235 COc1cc(cc(c1F)OC)Br 7a_200015524394_200000210301 [0,1,0,0,0,0|1,0,0]=2 935 B12R1.235 COc1cc(cc(c1F)OC)O 271570a_203496583355_100015304952 [0,1,0,0,0,0|1,0,0]=2 936 B12R1.235 COc1cc(cc(c1F)O[13CH3])Br 34a_200015524394_200025704644 [0,1,0,0,0,0|1,0,0]=2 937 B12R1.235 COc1cc(cc(c1F)O[13CH3])Br 7a_200015524394_200025704644 [0,1,0,0,0,0|1,0,0]=2 938 B12R1.235 COc1cc(cc(c1N)C#N)O 271570a_203496583355_200010734157 [0,1,0,0,0,0|3,0,0]=4 939 B12R1.235 COc1cc(cc(c1N)CO)O 271570a_203496583355_100010235085 [0,1,0,0,0,0|3,0,0]=4 940 B12R1.235 COc1cc(cc(c1N)SC)F 62a_100011004115_200000210301 [0,1,0,0,0,0|1,1,0]=3 941 B12R1.235 COc1cc(cc(c1N)SC)F 62a_200000210301_100011004115 [0,1,0,0,0,0|1,1,0]=3 942 B12R1.235 COc1cc(cc(c1N)S[13CH3])F 62a_100011004115_200025704644 [0,1,0,0,0,0|1,1,0]=3 943 B12R1.235 COc1cc(cc(c1N)S[13CH3])F 62a_200025704644_100011004115 [0,1,0,0,0,0|1,1,0]=3 944 B12R1.235 COc1cc(cc(c1O)CO)O 271570a_203496583355_100000185604 [0,1,0,0,0,0|2,0,0]=3 945 B12R1.235 COc1cc(cc(c1O)OC)O 271570a_203496583355_100000691893 [0,1,0,0,0,0|0,0,0]=1 946 B12R1.235 COc1cc(cc(c1O)SC)F 62a_200000210301_200010391102 [0,1,0,0,0,0|0,1,0]=2 947 B12R1.235 COc1cc(cc(c1O)S[13CH3])F 62a_200025704644_200010391102 [0,1,0,0,0,0|0,1,0]=2 948 B12R1.235 COc1nc(nc(c1N)OC)O 271570a_203496583355_100000095612 [0,1,0,0,0,0|3,0,0]=4 949 B12R1.235 COc1nc(nc(c1O)OC)C 271570a_203496583355_100010893122 [0,1,0,0,0,0|2,0,0]=3 950 B12R1.235 CSc1cc(cc(c1O)C#N)F 62a_200000210301_100010674538 [0,1,0,0,0,0|2,1,0]=4 951 B12R1.235 CSc1cc(cc(c1O)C=O)C 62a_200000210301_100000698970 [0,1,0,0,0,0|2,1,0]=4 952 B12R1.235 CSc1cc(cc(c1O)C=O)Cl 62a_200000210301_200000123117 [0,1,0,0,0,0|2,1,0]=4 953 B12R1.235 CSc1cc(cc(c1O)C=O)F 62a_200000210301_100011659637 [0,1,0,0,0,0|2,1,0]=4 954 B12R1.235 Cc1cc(c(c(c1)S[13CH3])O)C=O 62a_200025704644_100000698970 [0,1,0,0,0,0|2,1,0]=4 955 B12R1.235 [13CH3]Sc1cc(cc(c1O)C#N)F 62a_200025704644_100010674538 [0,1,0,0,0,0|2,1,0]=4 956 B12R1.235 [13CH3]Sc1cc(cc(c1O)C=O)Cl 62a_200025704644_200000123117 [0,1,0,0,0,0|2,1,0]=4 957 B12R1.235 [13CH3]Sc1cc(cc(c1O)C=O)F 62a_200025704644_100011659637 [0,1,0,0,0,0|2,1,0]=4 958 B12R1.280 C=C=Cc1cccc(c1C)OC 271570a_100015277604_100010002647 [0,1,0,0,0,0|2,0,1]=4 959 B12R1.280 C=C=Cc1cccc(c1Cl)OC 271570a_100015277604_100010147677 [0,1,0,0,0,0|2,0,1]=4 960 B12R1.280 C=C=Cc1cccc(c1F)OC 271570a_100015277604_100010185846 [0,1,0,0,0,0|2,0,1]=4 961 B12R1.280 C=C=Cc1cccc(c1N)OC 271570a_100015277604_100000708083 [0,1,0,0,0,0|2,0,1]=4 962 B12R1.280 C=C=Cc1cccc(c1O)CC 271570a_100015277604_200010001580 [0,1,0,0,0,0|2,0,1]=4 963 B12R1.280 C=C=Cc1cccc(c1O)OC 271570a_100015277604_100000686866 [0,1,0,0,0,0|1,0,1]=3 964 B12R1.280 C=Cc1cccc(c1C)COC 271570a_100011290941_100102485947 [0,1,0,0,0,0|2,0,1]=4 965 B12R1.280 C=Cc1cccc(c1N)OCC 271570a_100011290941_200103155331 [0,1,0,0,0,0|2,0,1]=4 966 B12R1.280 CC=Cc1cccc(c1C)OC 271570a_100016259895_100010002647 [0,1,0,0,0,0|2,0,0]=3 967 B12R1.280 CC=Cc1cccc(c1Cl)OC 271570a_100016259895_100010147677 [0,1,0,0,0,0|2,0,0]=3 968 B12R1.280 CC=Cc1cccc(c1F)OC 271570a_100016259895_100010185846 [0,1,0,0,0,0|2,0,0]=3 969 B12R1.280 CC=Cc1cccc(c1N)NC 271570a_100016259895_100000695761 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.280 CC=Cc1cccc(c1N)OC 271570a_100016259895_100000708083 [0,1,0,0,0,0|2,0,0]=3 971 B12R1.280 CC=Cc1cccc(c1O)C#N 271570a_100016259895_100009817103 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.280 CC=Cc1cccc(c1O)C=O 271570a_100016259895_100000737635 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.280 CC=Cc1cccc(c1O)CC 271570a_100016259895_200010001580 [0,1,0,0,0,0|2,0,0]=3 974 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,1,0,0,0,0|1,0,0]=2 975 B12R1.280 CC=Cc1ccnc(c1C)OC 271570a_100016259895_100010068544 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.280 CC=Cc1ccnc(c1F)OC 271570a_100016259895_100009885657 [0,1,0,0,0,0|3,0,0]=4 977 B12R1.280 CC=Cc1cncc(c1C)OC 271570a_100016259895_100010136163 [0,1,0,0,0,0|3,0,0]=4 978 B12R1.280 CC=Cc1nccc(c1C)OC 271570a_100016259895_100010067686 [0,1,0,0,0,0|3,0,0]=4 979 B12R1.280 CC=Cc1nccc(c1F)OC 271570a_100016259895_200010136267 [0,1,0,0,0,0|3,0,0]=4 980 B12R1.280 CC=Cc1nccc(c1N)OC 271570a_100016259895_100000100113 [0,1,0,0,0,0|3,0,0]=4 981 B12R1.280 CCNc1cccc(c1Br)OC 34a_100000703447_100000210202 [0,1,0,0,0,0|2,0,0]=3 982 B12R1.280 CCNc1cccc(c1C)OC 34a_100011244893_100000210202 [0,1,0,0,0,0|2,0,0]=3 983 B12R1.280 CCNc1cccc(c1C)OC 7a_100011244893_100000210202 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.280 CCNc1cccc(c1Cl)OC 34a_100000089720_100000210202 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.280 CCNc1cccc(c1F)OC 34a_100000100910_100000210202 [0,1,0,0,0,0|2,0,0]=3 986 B12R1.280 CCNc1cccc(c1I)OC 34a_100010245509_100000210202 [0,1,0,0,0,0|2,0,0]=3 987 B12R1.280 CCNc1cccc(c1O)OC 34a_100000123586_100000210202 [0,1,0,0,0,0|1,0,0]=2 988 B12R1.280 CCOc1cccc(c1Br)C#N 34a_100009818990_100000210202 [0,1,0,0,0,0|3,0,0]=4 989 B12R1.280 CCOc1cccc(c1Br)C#N 7a_100009818990_100000210202 [0,1,0,0,0,0|3,0,0]=4 990 B12R1.280 CCOc1cccc(c1Br)OC 34a_100010202623_100000210202 [0,1,0,0,0,0|1,0,0]=2 991 B12R1.280 CCOc1cccc(c1Br)OC 7a_100010202623_100000210202 [0,1,0,0,0,0|1,0,0]=2 992 B12R1.280 CCOc1cccc(c1C)C#N 34a_100000079589_100000210202 [0,1,0,0,0,0|3,0,0]=4 993 B12R1.280 CCOc1cccc(c1C)C#N 7a_100000079589_100000210202 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.280 CCOc1cccc(c1C)CO 34a_200000084602_100000210202 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.280 CCOc1cccc(c1C)CO 7a_200000084602_100000210202 [0,1,0,0,0,0|3,0,0]=4 996 B12R1.280 CCOc1cccc(c1Cl)C#N 34a_200009871651_100000210202 [0,1,0,0,0,0|3,0,0]=4 997 B12R1.280 CCOc1cccc(c1Cl)C#N 7a_200009871651_100000210202 [0,1,0,0,0,0|3,0,0]=4 998 B12R1.280 CCOc1cccc(c1Cl)OC 34a_100000087810_100000210202 [0,1,0,0,0,0|1,0,0]=2 999 B12R1.280 CCOc1cccc(c1Cl)OC 7a_100000087810_100000210202 [0,1,0,0,0,0|1,0,0]=2 1000 B12R1.280 CCOc1cccc(c1F)C#N 34a_200000094591_100000210202 [0,1,0,0,0,0|3,0,0]=4 1001 B12R1.280 CCOc1cccc(c1F)C#N 7a_200000094591_100000210202 [0,1,0,0,0,0|3,0,0]=4 1002 B12R1.280 CCOc1cccc(c1F)CN 34a_100025773512_100000210202 [0,1,0,0,0,0|3,0,0]=4 1003 B12R1.280 CCOc1cccc(c1F)OC 34a_100000102366_100000210202 [0,1,0,0,0,0|1,0,0]=2 1004 B12R1.280 CCOc1cccc(c1F)OC 7a_100000102366_100000210202 [0,1,0,0,0,0|1,0,0]=2 1005 B12R1.280 CCOc1cccc(c1I)OC 34a_200010201982_100000210202 [0,1,0,0,0,0|1,0,0]=2 1006 B12R1.280 CCOc1cccc(c1I)OC 7a_200010201982_100000210202 [0,1,0,0,0,0|1,0,0]=2 1007 B12R1.280 CCOc1cccc(c1N)OC 34a_100012022766_100000210202 [0,1,0,0,0,0|1,0,0]=2 1008 B12R1.280 CCOc1cccc(c1N)OC 7a_100012022766_100000210202 [0,1,0,0,0,0|1,0,0]=2 1009 B12R1.280 CCOc1cccc(c1N)SC 62a_200103155331_200000210301 [0,1,0,0,0,0|1,1,0]=3 1010 B12R1.280 CCOc1cccc(c1N)S[13CH3] 62a_200103155331_200025704644 [0,1,0,0,0,0|1,1,0]=3 1011 B12R1.280 CCSc1cccc(c1Br)OC 62a_100000210202_100010146559 [0,1,0,0,0,0|1,1,0]=3 1012 B12R1.280 CCSc1cccc(c1Br)OC 62a_100010146559_100000210202 [0,1,0,0,0,0|1,1,0]=3 1013 B12R1.280 CCSc1cccc(c1C)OC 62a_100000210202_100010002647 [0,1,0,0,0,0|1,1,0]=3 1014 B12R1.280 CCSc1cccc(c1C)OC 62a_100010002647_100000210202 [0,1,0,0,0,0|1,1,0]=3 1015 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100000210202_100010147677 [0,1,0,0,0,0|1,1,0]=3 1016 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100010147677_100000210202 [0,1,0,0,0,0|1,1,0]=3 1017 B12R1.280 CCSc1cccc(c1F)OC 62a_100000210202_100010185846 [0,1,0,0,0,0|1,1,0]=3 1018 B12R1.280 CCSc1cccc(c1F)OC 62a_100010185846_100000210202 [0,1,0,0,0,0|1,1,0]=3 1019 B12R1.280 CCSc1cccc(c1N)NC 62a_100000695761_100000210202 [0,1,0,0,0,0|2,1,0]=4 1020 B12R1.280 CCSc1cccc(c1N)OC 62a_100000708083_100000210202 [0,1,0,0,0,0|1,1,0]=3 1021 B12R1.280 CCSc1cccc(c1O)C#N 62a_100000210202_100009817103 [0,1,0,0,0,0|2,1,0]=4 1022 B12R1.280 CCSc1cccc(c1O)C=O 62a_100000210202_100010171435 [0,1,0,0,0,0|2,1,0]=4 1023 B12R1.280 CCSc1cccc(c1O)CC 62a_100000210202_200010001580 [0,1,0,0,0,0|1,1,0]=3 1024 B12R1.280 CCSc1cccc(c1O)CC 62a_200010001580_100000210202 [0,1,0,0,0,0|1,1,0]=3 1025 B12R1.280 CCSc1cccc(c1O)OC 62a_100000210202_100000686866 [0,1,0,0,0,0|0,1,0]=2 1026 B12R1.280 CCSc1ccnc(c1C)OC 62a_100000210202_100010068544 [0,1,0,0,0,0|2,1,0]=4 1027 B12R1.280 CCSc1ccnc(c1C)OC 62a_100010068544_100000210202 [0,1,0,0,0,0|2,1,0]=4 1028 B12R1.280 CCSc1ccnc(c1F)OC 62a_100000210202_100009885657 [0,1,0,0,0,0|2,1,0]=4 1029 B12R1.280 CCSc1ccnc(c1F)OC 62a_100009885657_100000210202 [0,1,0,0,0,0|2,1,0]=4 1030 B12R1.280 CCSc1cncc(c1C)OC 62a_100000210202_100010136163 [0,1,0,0,0,0|2,1,0]=4 1031 B12R1.280 CCSc1cncc(c1C)OC 62a_100010136163_100000210202 [0,1,0,0,0,0|2,1,0]=4 1032 B12R1.280 CCSc1nccc(c1C)OC 62a_100000210202_100010067686 [0,1,0,0,0,0|2,1,0]=4 1033 B12R1.280 CCSc1nccc(c1C)OC 62a_100010067686_100000210202 [0,1,0,0,0,0|2,1,0]=4 1034 B12R1.280 CCSc1nccc(c1F)OC 62a_100000210202_200010136267 [0,1,0,0,0,0|2,1,0]=4 1035 B12R1.280 CCSc1nccc(c1F)OC 62a_200010136267_100000210202 [0,1,0,0,0,0|2,1,0]=4 1036 B12R1.280 CCSc1nccc(c1N)OC 62a_100000210202_100000100113 [0,1,0,0,0,0|2,1,0]=4 1037 B12R1.280 CCSc1nccc(c1N)OC 62a_100010233645_100000210202 [0,1,0,0,0,0|2,1,0]=4 1038 B12R1.280 CCc1cccc(c1O)SCF 62a_100015361967_200010001580 [0,1,0,0,0,0|1,1,0]=3 1039 B12R1.280 CCc1cccc(c1O)SCF 62a_200010001580_100015361967 [0,1,0,0,0,0|1,1,0]=3 1040 B12R1.280 CNCc1cccc(c1Br)OC 207a_100102657272_100010209554 [0,1,0,0,0,0|2,0,0]=3 1041 B12R1.280 CNCc1cccc(c1Br)OC 26a_100102657272_100010202623 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.280 CNCc1cccc(c1Br)OC 270004a_106832991635_100010209554 [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.280 CNCc1cccc(c1C)OC 207a_100102657272_100000101217 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.280 CNCc1cccc(c1C)OC 2230a_106832991635_100009876938 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.280 CNCc1cccc(c1C)OC 270004a_106832991635_100000101217 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.280 CNCc1cccc(c1C)OC 34a_100102657272_100009876938 [0,1,0,0,0,0|2,0,0]=3 1047 B12R1.280 CNCc1cccc(c1C)OC 7a_106832991635_100009876938 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.280 CNCc1cccc(c1Cl)OC 207a_100102657272_100000068750 [0,1,0,0,0,0|2,0,0]=3 1049 B12R1.280 CNCc1cccc(c1Cl)OC 2230a_106832991635_200010147866 [0,1,0,0,0,0|2,0,0]=3 1050 B12R1.280 CNCc1cccc(c1Cl)OC 26a_100102657272_100000087810 [0,1,0,0,0,0|2,0,0]=3 1051 B12R1.280 CNCc1cccc(c1Cl)OC 270004a_106832991635_100000068750 [0,1,0,0,0,0|2,0,0]=3 1052 B12R1.280 CNCc1cccc(c1Cl)OC 34a_100102657272_200010147866 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.280 CNCc1cccc(c1Cl)OC 7a_106832991635_200010147866 [0,1,0,0,0,0|2,0,0]=3 1054 B12R1.280 CNCc1cccc(c1F)OC 207a_100102657272_100000692048 [0,1,0,0,0,0|2,0,0]=3 1055 B12R1.280 CNCc1cccc(c1F)OC 2230a_106832991635_100011260763 [0,1,0,0,0,0|2,0,0]=3 1056 B12R1.280 CNCc1cccc(c1F)OC 270004a_106832991635_100000692048 [0,1,0,0,0,0|2,0,0]=3 1057 B12R1.280 CNCc1cccc(c1F)OC 34a_100102657272_100011260763 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.280 CNCc1cccc(c1F)OC 34a_100137345169_200000210301 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.280 CNCc1cccc(c1F)OC 7a_106832991635_100011260763 [0,1,0,0,0,0|2,0,0]=3 1060 B12R1.280 CNCc1cccc(c1F)SC 62a_114873767014_200000210301 [0,1,0,0,0,0|2,1,0]=4 1061 B12R1.280 CNCc1cccc(c1F)SC 62a_200000210301_114873767014 [0,1,0,0,0,0|2,1,0]=4 1062 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_114873767014_200025704644 [0,1,0,0,0,0|2,1,0]=4 1063 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_200025704644_114873767014 [0,1,0,0,0,0|2,1,0]=4 1064 B12R1.280 CNCc1ccnc(c1Cl)OC 207a_100102657272_200000087872 [0,1,0,0,0,0|3,0,0]=4 1065 B12R1.280 CNCc1ccnc(c1Cl)OC 270004a_106832991635_200000087872 [0,1,0,0,0,0|3,0,0]=4 1066 B12R1.280 CNCc1nccc(c1C)OC 2230a_106832991635_100016994983 [0,1,0,0,0,0|3,0,0]=4 1067 B12R1.280 CNCc1nccc(c1C)OC 34a_100102657272_100016994983 [0,1,0,0,0,0|3,0,0]=4 1068 B12R1.280 CNCc1nccc(c1C)OC 7a_106832991635_100016994983 [0,1,0,0,0,0|3,0,0]=4 1069 B12R1.280 CNc1cccc(c1N)SCF 62a_100000695761_100015361967 [0,1,0,0,0,0|2,1,0]=4 1070 B12R1.280 COCc1cccc(c1Br)C#N 34a_100138415774_100010145452 [0,1,0,0,0,0|3,0,0]=4 1071 B12R1.280 COCc1cccc(c1Br)OC 34a_100010146792_200000210301 [0,1,0,0,0,0|1,0,0]=2 1072 B12R1.280 COCc1cccc(c1Br)OC 7a_100010146792_200000210301 [0,1,0,0,0,0|1,0,0]=2 1073 B12R1.280 COCc1cccc(c1C)OC 34a_100009871736_200000210301 [0,1,0,0,0,0|1,0,0]=2 1074 B12R1.280 COCc1cccc(c1C)OC 34a_100138415774_100009876938 [0,1,0,0,0,0|1,0,0]=2 1075 B12R1.280 COCc1cccc(c1C)OC 7a_100009871736_200000210301 [0,1,0,0,0,0|1,0,0]=2 1076 B12R1.280 COCc1cccc(c1C)SC 62a_100102485947_200000210301 [0,1,0,0,0,0|1,1,0]=3 1077 B12R1.280 COCc1cccc(c1C)SC 62a_200000210301_100102485947 [0,1,0,0,0,0|1,1,0]=3 1078 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_100102485947_200025704644 [0,1,0,0,0,0|1,1,0]=3 1079 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_200025704644_100102485947 [0,1,0,0,0,0|1,1,0]=3 1080 B12R1.280 COCc1cccc(c1Cl)OC 34a_100138415774_200010147866 [0,1,0,0,0,0|1,0,0]=2 1081 B12R1.280 COCc1cccc(c1F)C#N 34a_100012181476_200000210301 [0,1,0,0,0,0|3,0,0]=4 1082 B12R1.280 COCc1cccc(c1F)C#N 34a_100138415774_100000695645 [0,1,0,0,0,0|3,0,0]=4 1083 B12R1.280 COCc1cccc(c1F)C#N 7a_100012181476_200000210301 [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.280 COCc1cccc(c1F)OC 34a_100011935170_200000210301 [0,1,0,0,0,0|1,0,0]=2 1085 B12R1.280 COCc1cccc(c1F)OC 34a_100138415774_100011260763 [0,1,0,0,0,0|1,0,0]=2 1086 B12R1.280 COCc1cccc(c1F)OC 7a_100011935170_200000210301 [0,1,0,0,0,0|1,0,0]=2 1087 B12R1.280 COCc1cccc(c1I)OC 34a_100010236476_200000210301 [0,1,0,0,0,0|1,0,0]=2 1088 B12R1.280 COCc1cccc(c1I)OC 7a_100010236476_200000210301 [0,1,0,0,0,0|1,0,0]=2 1089 B12R1.280 COCc1cccc(c1N)OC 34a_100011999522_200000210301 [0,1,0,0,0,0|1,0,0]=2 1090 B12R1.280 COCc1ccnc(c1Cl)OC 34a_100009844655_200000210301 [0,1,0,0,0,0|2,0,0]=3 1091 B12R1.280 COCc1nccc(c1C)OC 34a_100000087669_200000210301 [0,1,0,0,0,0|2,0,0]=3 1092 B12R1.280 COCc1nccc(c1C)OC 34a_100138415774_100016994983 [0,1,0,0,0,0|2,0,0]=3 1093 B12R1.280 COc1cccc(c1Br)CO[13CH3] 34a_100010146792_200025704644 [0,1,0,0,0,0|1,0,0]=2 1094 B12R1.280 COc1cccc(c1Br)CO[13CH3] 7a_100010146792_200025704644 [0,1,0,0,0,0|1,0,0]=2 1095 B12R1.280 COc1cccc(c1Br)NCF 34a_100000703447_100015361967 [0,1,0,0,0,0|2,0,0]=3 1096 B12R1.280 COc1cccc(c1Br)OCF 34a_100010202623_100015361967 [0,1,0,0,0,0|1,0,0]=2 1097 B12R1.280 COc1cccc(c1Br)OCF 7a_100010202623_100015361967 [0,1,0,0,0,0|1,0,0]=2 1098 B12R1.280 COc1cccc(c1Br)SCF 62a_100010146559_100015361967 [0,1,0,0,0,0|1,1,0]=3 1099 B12R1.280 COc1cccc(c1Br)SCF 62a_100015361967_100010146559 [0,1,0,0,0,0|1,1,0]=3 1100 B12R1.280 COc1cccc(c1C)CO[13CH3] 34a_100009871736_200025704644 [0,1,0,0,0,0|1,0,0]=2 1101 B12R1.280 COc1cccc(c1C)CO[13CH3] 7a_100009871736_200025704644 [0,1,0,0,0,0|1,0,0]=2 1102 B12R1.280 COc1cccc(c1C)CSC 62a_100009876938_200000210301 [0,1,0,0,0,0|1,1,0]=3 1103 B12R1.280 COc1cccc(c1C)CSC 62a_200000210301_100009876938 [0,1,0,0,0,0|1,1,0]=3 1104 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_100009876938_200025704644 [0,1,0,0,0,0|1,1,0]=3 1105 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_200025704644_100009876938 [0,1,0,0,0,0|1,1,0]=3 1106 B12R1.280 COc1cccc(c1C)NCF 34a_100011244893_100015361967 [0,1,0,0,0,0|2,0,0]=3 1107 B12R1.280 COc1cccc(c1C)NCF 7a_100011244893_100015361967 [0,1,0,0,0,0|2,0,0]=3 1108 B12R1.280 COc1cccc(c1C)SCF 62a_100010002647_100015361967 [0,1,0,0,0,0|1,1,0]=3 1109 B12R1.280 COc1cccc(c1C)SCF 62a_100015361967_100010002647 [0,1,0,0,0,0|1,1,0]=3 1110 B12R1.280 COc1cccc(c1Cl)CSC 62a_200000210301_200010147866 [0,1,0,0,0,0|1,1,0]=3 1111 B12R1.280 COc1cccc(c1Cl)CSC 62a_200010147866_200000210301 [0,1,0,0,0,0|1,1,0]=3 1112 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200010147866_200025704644 [0,1,0,0,0,0|1,1,0]=3 1113 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200025704644_200010147866 [0,1,0,0,0,0|1,1,0]=3 1114 B12R1.280 COc1cccc(c1Cl)NCF 34a_100000089720_100015361967 [0,1,0,0,0,0|2,0,0]=3 1115 B12R1.280 COc1cccc(c1Cl)OCF 34a_100000087810_100015361967 [0,1,0,0,0,0|1,0,0]=2 1116 B12R1.280 COc1cccc(c1Cl)OCF 7a_100000087810_100015361967 [0,1,0,0,0,0|1,0,0]=2 1117 B12R1.280 COc1cccc(c1Cl)SCF 62a_100010147677_100015361967 [0,1,0,0,0,0|1,1,0]=3 1118 B12R1.280 COc1cccc(c1Cl)SCF 62a_100015361967_100010147677 [0,1,0,0,0,0|1,1,0]=3 1119 B12R1.280 COc1cccc(c1F)CN[13CH3] 34a_100137345169_200025704644 [0,1,0,0,0,0|2,0,0]=3 1120 B12R1.280 COc1cccc(c1F)CO[13CH3] 34a_100011935170_200025704644 [0,1,0,0,0,0|1,0,0]=2 1121 B12R1.280 COc1cccc(c1F)CO[13CH3] 7a_100011935170_200025704644 [0,1,0,0,0,0|1,0,0]=2 1122 B12R1.280 COc1cccc(c1F)CSC 62a_100011260763_200000210301 [0,1,0,0,0,0|1,1,0]=3 1123 B12R1.280 COc1cccc(c1F)CSC 62a_200000210301_100011260763 [0,1,0,0,0,0|1,1,0]=3 1124 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_100011260763_200025704644 [0,1,0,0,0,0|1,1,0]=3 1125 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_200025704644_100011260763 [0,1,0,0,0,0|1,1,0]=3 1126 B12R1.280 COc1cccc(c1F)NCF 34a_100000100910_100015361967 [0,1,0,0,0,0|2,0,0]=3 1127 B12R1.280 COc1cccc(c1F)OCF 34a_100000102366_100015361967 [0,1,0,0,0,0|1,0,0]=2 1128 B12R1.280 COc1cccc(c1F)OCF 7a_100000102366_100015361967 [0,1,0,0,0,0|1,0,0]=2 1129 B12R1.280 COc1cccc(c1F)SCF 62a_100010185846_100015361967 [0,1,0,0,0,0|1,1,0]=3 1130 B12R1.280 COc1cccc(c1F)SCF 62a_100015361967_100010185846 [0,1,0,0,0,0|1,1,0]=3 1131 B12R1.280 COc1cccc(c1I)CO[13CH3] 34a_100010236476_200025704644 [0,1,0,0,0,0|1,0,0]=2 1132 B12R1.280 COc1cccc(c1I)CO[13CH3] 7a_100010236476_200025704644 [0,1,0,0,0,0|1,0,0]=2 1133 B12R1.280 COc1cccc(c1I)NCF 34a_100010245509_100015361967 [0,1,0,0,0,0|2,0,0]=3 1134 B12R1.280 COc1cccc(c1I)OCF 34a_200010201982_100015361967 [0,1,0,0,0,0|1,0,0]=2 1135 B12R1.280 COc1cccc(c1I)OCF 7a_200010201982_100015361967 [0,1,0,0,0,0|1,0,0]=2 1136 B12R1.280 COc1cccc(c1N)CO[13CH3] 34a_100011999522_200025704644 [0,1,0,0,0,0|1,0,0]=2 1137 B12R1.280 COc1cccc(c1N)OCF 34a_100012022766_100015361967 [0,1,0,0,0,0|1,0,0]=2 1138 B12R1.280 COc1cccc(c1N)OCF 7a_100012022766_100015361967 [0,1,0,0,0,0|1,0,0]=2 1139 B12R1.280 COc1cccc(c1N)SCF 62a_100000708083_100015361967 [0,1,0,0,0,0|1,1,0]=3 1140 B12R1.280 COc1cccc(c1O)NCF 34a_100000123586_100015361967 [0,1,0,0,0,0|1,0,0]=2 1141 B12R1.280 COc1cccc(c1O)SCF 62a_100015361967_100000686866 [0,1,0,0,0,0|0,1,0]=2 1142 B12R1.280 COc1ccnc(c1C)CO[13CH3] 34a_100000087669_200025704644 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.280 COc1ccnc(c1C)CSC 62a_100016994983_200000210301 [0,1,0,0,0,0|2,1,0]=4 1144 B12R1.280 COc1ccnc(c1C)CSC 62a_200000210301_100016994983 [0,1,0,0,0,0|2,1,0]=4 1145 B12R1.280 COc1ccnc(c1C)CS[13CH3] 62a_100016994983_200025704644 [0,1,0,0,0,0|2,1,0]=4 1146 B12R1.280 COc1ccnc(c1C)CS[13CH3] 62a_200025704644_100016994983 [0,1,0,0,0,0|2,1,0]=4 1147 B12R1.280 COc1ccnc(c1C)SCF 62a_100010067686_100015361967 [0,1,0,0,0,0|2,1,0]=4 1148 B12R1.280 COc1ccnc(c1C)SCF 62a_100015361967_100010067686 [0,1,0,0,0,0|2,1,0]=4 1149 B12R1.280 COc1ccnc(c1F)SCF 62a_100015361967_200010136267 [0,1,0,0,0,0|2,1,0]=4 1150 B12R1.280 COc1ccnc(c1F)SCF 62a_200010136267_100015361967 [0,1,0,0,0,0|2,1,0]=4 1151 B12R1.280 COc1ccnc(c1N)SCF 62a_100010233645_100015361967 [0,1,0,0,0,0|2,1,0]=4 1152 B12R1.280 COc1ccnc(c1N)SCF 62a_100015361967_100000100113 [0,1,0,0,0,0|2,1,0]=4 1153 B12R1.280 COc1cncc(c1C)SCF 62a_100010136163_100015361967 [0,1,0,0,0,0|2,1,0]=4 1154 B12R1.280 COc1cncc(c1C)SCF 62a_100015361967_100010136163 [0,1,0,0,0,0|2,1,0]=4 1155 B12R1.280 COc1nccc(c1C)SCF 62a_100010068544_100015361967 [0,1,0,0,0,0|2,1,0]=4 1156 B12R1.280 COc1nccc(c1C)SCF 62a_100015361967_100010068544 [0,1,0,0,0,0|2,1,0]=4 1157 B12R1.280 COc1nccc(c1Cl)CO[13CH3] 34a_100009844655_200025704644 [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.280 COc1nccc(c1F)SCF 62a_100009885657_100015361967 [0,1,0,0,0,0|2,1,0]=4 1159 B12R1.280 COc1nccc(c1F)SCF 62a_100015361967_100009885657 [0,1,0,0,0,0|2,1,0]=4 1160 B12R1.280 CSc1cccc(c1C)CCN 62a_100161000114_200000210301 [0,1,0,0,0,0|2,1,0]=4 1161 B12R1.280 CSc1cccc(c1C)CCN 62a_200000210301_100161000114 [0,1,0,0,0,0|2,1,0]=4 1162 B12R1.280 Cc1c(cccc1OCF)C#N 34a_100000079589_100015361967 [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.280 Cc1c(cccc1OCF)C#N 7a_100000079589_100015361967 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.280 Cc1c(cccc1OCF)CO 34a_200000084602_100015361967 [0,1,0,0,0,0|3,0,0]=4 1165 B12R1.280 Cc1c(cccc1OCF)CO 7a_200000084602_100015361967 [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_100161000114_200025704644 [0,1,0,0,0,0|2,1,0]=4 1167 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_200025704644_100161000114 [0,1,0,0,0,0|2,1,0]=4 1168 B12R1.280 N#Cc1cccc(c1Br)OCF 34a_100009818990_100015361967 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.280 N#Cc1cccc(c1Br)OCF 7a_100009818990_100015361967 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.280 N#Cc1cccc(c1Cl)OCF 34a_200009871651_100015361967 [0,1,0,0,0,0|3,0,0]=4 1171 B12R1.280 N#Cc1cccc(c1Cl)OCF 7a_200009871651_100015361967 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.280 N#Cc1cccc(c1F)OCF 34a_200000094591_100015361967 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.280 N#Cc1cccc(c1F)OCF 7a_200000094591_100015361967 [0,1,0,0,0,0|3,0,0]=4 1174 B12R1.280 N#Cc1cccc(c1O)SCF 62a_100015361967_100009817103 [0,1,0,0,0,0|2,1,0]=4 1175 B12R1.280 NCc1cccc(c1F)OCF 34a_100025773512_100015361967 [0,1,0,0,0,0|3,0,0]=4 1176 B12R1.280 O=Cc1cccc(c1O)SCF 62a_100015361967_100010171435 [0,1,0,0,0,0|2,1,0]=4 1177 B12R1.280 [13CH3]OCc1cccc(c1F)C#N 34a_100012181476_200025704644 [0,1,0,0,0,0|3,0,0]=4 1178 B12R1.280 [13CH3]OCc1cccc(c1F)C#N 7a_100012181476_200025704644 [0,1,0,0,0,0|3,0,0]=4 1179 B12R1.440 C=C(C)c1cccc(c1C)OC 271570a_100000694244_100010002647 [0,1,0,0,0,0|2,0,0]=3 1180 B12R1.440 C=C(C)c1cccc(c1Cl)OC 271570a_100000694244_100010147677 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.440 C=C(C)c1cccc(c1F)OC 271570a_100000694244_100010185846 [0,1,0,0,0,0|2,0,0]=3 1182 B12R1.440 C=C(C)c1cccc(c1N)NC 271570a_100000694244_100000695761 [0,1,0,0,0,0|3,0,0]=4 1183 B12R1.440 C=C(C)c1cccc(c1N)OC 271570a_100000694244_100000708083 [0,1,0,0,0,0|2,0,0]=3 1184 B12R1.440 C=C(C)c1cccc(c1O)C#N 271570a_100000694244_100009817103 [0,1,0,0,0,0|3,0,0]=4 1185 B12R1.440 C=C(C)c1cccc(c1O)C=O 271570a_100000694244_100000737635 [0,1,0,0,0,0|3,0,0]=4 1186 B12R1.440 C=C(C)c1cccc(c1O)CC 271570a_100000694244_200010001580 [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.440 C=C(C)c1cccc(c1O)OC 271570a_100000694244_100000686866 [0,1,0,0,0,0|1,0,0]=2 1188 B12R1.440 C=C(C)c1ccnc(c1C)OC 271570a_100000694244_100010068544 [0,1,0,0,0,0|3,0,0]=4 1189 B12R1.440 C=C(C)c1ccnc(c1F)OC 271570a_100000694244_100009885657 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.440 C=C(C)c1cncc(c1C)OC 271570a_100000694244_100010136163 [0,1,0,0,0,0|3,0,0]=4 1191 B12R1.440 C=C(C)c1nccc(c1C)OC 271570a_100000694244_100010067686 [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.440 C=C(C)c1nccc(c1F)OC 271570a_100000694244_200010136267 [0,1,0,0,0,0|3,0,0]=4 1193 B12R1.440 C=C(C)c1nccc(c1N)OC 271570a_100000694244_100000100113 [0,1,0,0,0,0|3,0,0]=4 1194 B12R1.440 C=Cc1cccc(c1O)C(=O)C 271570a_100011290941_100009815558 [0,1,0,0,0,0|2,0,1]=4 1195 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_100012706834_200025704644 [0,1,0,0,0,0|2,1,0]=4 1198 B12R1.440 CC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012706834 [0,1,0,0,0,0|2,1,0]=4 1199 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [0,1,0,0,0,0|2,0,0]=3 1200 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_100012355707_200025704644 [0,1,0,0,0,0|2,1,0]=4 1202 B12R1.440 CC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355707 [0,1,0,0,0,0|2,1,0]=4 1203 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [0,1,0,0,0,0|2,0,0]=3 1204 B12R1.440 CC(=O)c1cccc(c1O)C#N 1458a_100009886288_200000210301 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.440 CC(C)c1cccc(c1F)N[13CH3] 34a_100021981578_200025704644 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.440 CC(C)c1cccc(c1F)N[13CH3] 7a_100021981578_200025704644 [0,1,0,0,0,0|3,0,0]=4 1207 B12R1.440 CC(C)c1cccc(c1N)S[13CH3] 62a_100010571509_200025704644 [0,1,0,0,0,0|2,1,0]=4 1208 B12R1.440 CC(C)c1cccc(c1N)S[13CH3] 62a_200025704644_100010571509 [0,1,0,0,0,0|2,1,0]=4 1209 B12R1.440 CC(O)c1cccc(c1F)S[13CH3] 62a_200012356376_200025704644 [0,1,0,0,0,0|2,1,0]=4 1210 B12R1.440 CC(O)c1cccc(c1F)S[13CH3] 62a_200025704644_200012356376 [0,1,0,0,0,0|2,1,0]=4 1211 B12R1.440 CNc1cccc(c1F)C(C)C 34a_100021981578_200000210301 [0,1,0,0,0,0|3,0,0]=4 1212 B12R1.440 CNc1cccc(c1F)C(C)C 7a_100021981578_200000210301 [0,1,0,0,0,0|3,0,0]=4 1213 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [0,1,0,0,0,0|2,0,0]=3 1214 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [0,1,0,0,0,0|2,0,0]=3 1215 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200000210301 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.440 COc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200000210301 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [0,1,0,0,0,0|2,0,0]=3 1221 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 34a_100000740326_200000210301 [0,1,0,0,0,0|3,0,0]=4 1222 B12R1.440 COc1cccc(c1C)[N+](=O)[O-] 7a_100000740326_200000210301 [0,1,0,0,0,0|3,0,0]=4 1223 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [0,1,0,0,0,0|2,0,0]=3 1224 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [0,1,0,0,0,0|2,0,0]=3 1225 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200000210301 [0,1,0,0,0,0|3,0,0]=4 1226 B12R1.440 COc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200000210301 [0,1,0,0,0,0|3,0,0]=4 1227 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.440 COc1cccc(c1F)C(=O)N 34a_100009841371_200000210301 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.440 COc1cccc(c1F)C(=O)N 7a_100009841371_200000210301 [0,1,0,0,0,0|3,0,0]=4 1232 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200000210301 [0,1,0,0,0,0|3,0,0]=4 1234 B12R1.440 COc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200000210301 [0,1,0,0,0,0|3,0,0]=4 1235 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [0,1,0,0,0,0|2,0,0]=3 1236 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [0,1,0,0,0,0|2,0,0]=3 1237 B12R1.440 COc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200000210301 [0,1,0,0,0,0|3,0,0]=4 1238 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [0,1,0,0,0,0|2,0,0]=3 1239 B12R1.440 COc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200000210301 [0,1,0,0,0,0|3,0,0]=4 1240 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [0,1,0,0,0,0|1,0,0]=2 1241 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [0,1,0,0,0,0|1,0,0]=2 1242 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_100012706834_200000210301 [0,1,0,0,0,0|2,1,0]=4 1243 B12R1.440 CSc1cccc(c1C)C(=O)C 62a_200000210301_100012706834 [0,1,0,0,0,0|2,1,0]=4 1244 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_100012355707_200000210301 [0,1,0,0,0,0|2,1,0]=4 1245 B12R1.440 CSc1cccc(c1F)C(=O)C 62a_200000210301_100012355707 [0,1,0,0,0,0|2,1,0]=4 1246 B12R1.440 CSc1cccc(c1F)C(C)O 62a_200000210301_200012356376 [0,1,0,0,0,0|2,1,0]=4 1247 B12R1.440 CSc1cccc(c1F)C(C)O 62a_200012356376_200000210301 [0,1,0,0,0,0|2,1,0]=4 1248 B12R1.440 CSc1cccc(c1N)C(C)C 62a_100010571509_200000210301 [0,1,0,0,0,0|2,1,0]=4 1249 B12R1.440 CSc1cccc(c1N)C(C)C 62a_200000210301_100010571509 [0,1,0,0,0,0|2,1,0]=4 1250 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 34a_100000740326_200025704644 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.440 Cc1c(cccc1[N+](=O)[O-])O[13CH3] 7a_100000740326_200025704644 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.440 [13CH3]C(=O)c1cccc(c1O)C#N 1458a_100009886288_200025704644 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 34a_100010197803_200025704644 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.440 [13CH3]Oc1cccc(c1Br)[N+](=O)[O-] 7a_100010197803_200025704644 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 34a_100012001863_200025704644 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.440 [13CH3]Oc1cccc(c1Cl)[N+](=O)[O-] 7a_100012001863_200025704644 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 34a_100009841371_200025704644 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 7a_100009841371_200025704644 [0,1,0,0,0,0|3,0,0]=4 1259 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 34a_100000100933_200025704644 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.440 [13CH3]Oc1cccc(c1F)[N+](=O)[O-] 7a_100000100933_200025704644 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.440 [13CH3]Oc1cccc(c1I)[N+](=O)[O-] 7a_100010176071_200025704644 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.440 [13CH3]Oc1cccc(c1N)[N+](=O)[O-] 7a_100000739591_200025704644 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.654 C=Cc1c(ccc(c1C)OC)C 271570a_100011290941_100016151084 [0,1,0,0,0,0|2,0,1]=4 1264 B12R1.654 C=Cc1c(ccc(c1F)OC)F 271570a_100011290941_100010946477 [0,1,0,0,0,0|2,0,1]=4 1265 B12R1.654 C=Cc1ccc(c(c1F)OC)Cl 271570a_100011290941_200135222481 [0,1,0,0,0,0|2,0,1]=4 1266 B12R1.654 C=Cc1ccc(c(c1F)OC)N 271570a_100011290941_100010734149 [0,1,0,0,0,0|2,0,1]=4 1267 B12R1.654 CNc1c(ccc(c1C)OC)C 34a_100000089760_200000210301 [0,1,0,0,0,0|2,0,0]=3 1268 B12R1.654 CNc1c(ccc(c1C)OC)C 7a_100000089760_200000210301 [0,1,0,0,0,0|2,0,0]=3 1269 B12R1.654 CNc1c(ccc(c1Cl)OC)Cl 34a_100009956855_200000210301 [0,1,0,0,0,0|2,0,0]=3 1270 B12R1.654 CNc1c(ccc(c1Cl)OC)F 34a_100000061512_200000210301 [0,1,0,0,0,0|2,0,0]=3 1271 B12R1.654 CNc1c(ccc(c1F)OC)Cl 34a_100000061519_200000210301 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.654 CNc1c(ccc(c1F)OC)F 34a_200000062051_200000210301 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.654 CNc1ccc(c(c1F)OC)F 34a_100137314619_200000210301 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.654 COc1c(ccc(c1F)C#N)O 271570a_203496583355_200010764284 [0,1,0,0,0,0|3,0,0]=4 1275 B12R1.654 COc1c(ccc(c1F)C=O)O 271570a_203496583355_200010981996 [0,1,0,0,0,0|3,0,0]=4 1276 B12R1.654 COc1c(ccc(c1F)N[13CH3])F 34a_100137314619_200025704644 [0,1,0,0,0,0|2,0,0]=3 1277 B12R1.654 COc1c(ccc(c1F)O[13CH3])F 34a_100000062073_200025704644 [0,1,0,0,0,0|1,0,0]=2 1278 B12R1.654 COc1c(ccc(c1F)O[13CH3])F 7a_100000062073_200025704644 [0,1,0,0,0,0|1,0,0]=2 1279 B12R1.654 COc1c(ccc(c1F)SC)Cl 62a_200000210301_200135222481 [0,1,0,0,0,0|1,1,0]=3 1280 B12R1.654 COc1c(ccc(c1F)SC)Cl 62a_200135222481_200000210301 [0,1,0,0,0,0|1,1,0]=3 1281 B12R1.654 COc1c(ccc(c1F)SC)N 62a_100010734149_200000210301 [0,1,0,0,0,0|1,1,0]=3 1282 B12R1.654 COc1c(ccc(c1F)SC)N 62a_200000210301_100010734149 [0,1,0,0,0,0|1,1,0]=3 1283 B12R1.654 COc1c(ccc(c1F)S[13CH3])Cl 62a_200025704644_200135222481 [0,1,0,0,0,0|1,1,0]=3 1284 B12R1.654 COc1c(ccc(c1F)S[13CH3])Cl 62a_200135222481_200025704644 [0,1,0,0,0,0|1,1,0]=3 1285 B12R1.654 COc1c(ccc(c1F)S[13CH3])N 62a_100010734149_200025704644 [0,1,0,0,0,0|1,1,0]=3 1286 B12R1.654 COc1c(ccc(c1F)S[13CH3])N 62a_200025704644_100010734149 [0,1,0,0,0,0|1,1,0]=3 1287 B12R1.654 COc1ccc(c(c1Br)OC)Cl 34a_200020794976_200000210301 [0,1,0,0,0,0|1,0,0]=2 1288 B12R1.654 COc1ccc(c(c1Br)OC)Cl 7a_200020794976_200000210301 [0,1,0,0,0,0|1,0,0]=2 1289 B12R1.654 COc1ccc(c(c1Br)O[13CH3])Cl 34a_200020794976_200025704644 [0,1,0,0,0,0|1,0,0]=2 1290 B12R1.654 COc1ccc(c(c1Br)O[13CH3])Cl 7a_200020794976_200025704644 [0,1,0,0,0,0|1,0,0]=2 1291 B12R1.654 COc1ccc(c(c1Br)SC)F 62a_200000210301_200055343962 [0,1,0,0,0,0|1,1,0]=3 1292 B12R1.654 COc1ccc(c(c1Br)SC)F 62a_200055343962_200000210301 [0,1,0,0,0,0|1,1,0]=3 1293 B12R1.654 COc1ccc(c(c1Br)S[13CH3])F 62a_200025704644_200055343962 [0,1,0,0,0,0|1,1,0]=3 1294 B12R1.654 COc1ccc(c(c1Br)S[13CH3])F 62a_200055343962_200025704644 [0,1,0,0,0,0|1,1,0]=3 1295 B12R1.654 COc1ccc(c(c1C)N[13CH3])C 34a_100000089760_200025704644 [0,1,0,0,0,0|2,0,0]=3 1296 B12R1.654 COc1ccc(c(c1C)N[13CH3])C 7a_100000089760_200025704644 [0,1,0,0,0,0|2,0,0]=3 1297 B12R1.654 COc1ccc(c(c1C)OC)O 271570a_203496583355_100010234078 [0,1,0,0,0,0|1,0,0]=2 1298 B12R1.654 COc1ccc(c(c1C)SC)C 62a_100016151084_200000210301 [0,1,0,0,0,0|1,1,0]=3 1299 B12R1.654 COc1ccc(c(c1C)SC)C 62a_200000210301_100016151084 [0,1,0,0,0,0|1,1,0]=3 1300 B12R1.654 COc1ccc(c(c1C)S[13CH3])C 62a_100016151084_200025704644 [0,1,0,0,0,0|1,1,0]=3 1301 B12R1.654 COc1ccc(c(c1C)S[13CH3])C 62a_200025704644_100016151084 [0,1,0,0,0,0|1,1,0]=3 1302 B12R1.654 COc1ccc(c(c1Cl)N[13CH3])Cl 34a_100009956855_200025704644 [0,1,0,0,0,0|2,0,0]=3 1303 B12R1.654 COc1ccc(c(c1Cl)N[13CH3])F 34a_100000061512_200025704644 [0,1,0,0,0,0|2,0,0]=3 1304 B12R1.654 COc1ccc(c(c1Cl)OC)F 34a_200000061507_200000210301 [0,1,0,0,0,0|1,0,0]=2 1305 B12R1.654 COc1ccc(c(c1Cl)OC)F 7a_200000061507_200000210301 [0,1,0,0,0,0|1,0,0]=2 1306 B12R1.654 COc1ccc(c(c1Cl)O[13CH3])F 34a_200000061507_200025704644 [0,1,0,0,0,0|1,0,0]=2 1307 B12R1.654 COc1ccc(c(c1Cl)O[13CH3])F 7a_200000061507_200025704644 [0,1,0,0,0,0|1,0,0]=2 1308 B12R1.654 COc1ccc(c(c1F)C=O)O 271570a_203496583355_100010204294 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.654 COc1ccc(c(c1F)N[13CH3])Cl 34a_100000061519_200025704644 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.654 COc1ccc(c(c1F)N[13CH3])F 34a_200000062051_200025704644 [0,1,0,0,0,0|2,0,0]=3 1311 B12R1.654 COc1ccc(c(c1F)OC)F 34a_100000062056_200000210301 [0,1,0,0,0,0|1,0,0]=2 1312 B12R1.654 COc1ccc(c(c1F)OC)F 34a_100000062073_200000210301 [0,1,0,0,0,0|1,0,0]=2 1313 B12R1.654 COc1ccc(c(c1F)OC)F 7a_100000062056_200000210301 [0,1,0,0,0,0|1,0,0]=2 1314 B12R1.654 COc1ccc(c(c1F)OC)F 7a_100000062073_200000210301 [0,1,0,0,0,0|1,0,0]=2 1315 B12R1.654 COc1ccc(c(c1F)OC)O 271570a_203496583355_200010341284 [0,1,0,0,0,0|1,0,0]=2 1316 B12R1.654 COc1ccc(c(c1F)O[13CH3])F 34a_100000062056_200025704644 [0,1,0,0,0,0|1,0,0]=2 1317 B12R1.654 COc1ccc(c(c1F)O[13CH3])F 7a_100000062056_200025704644 [0,1,0,0,0,0|1,0,0]=2 1318 B12R1.654 COc1ccc(c(c1F)SC)F 62a_100010946477_200000210301 [0,1,0,0,0,0|1,1,0]=3 1319 B12R1.654 COc1ccc(c(c1F)SC)F 62a_200000210301_100010946477 [0,1,0,0,0,0|1,1,0]=3 1320 B12R1.654 COc1ccc(c(c1F)SC)O 271570a_203496583355_200011099385 [0,1,0,0,0,0|1,1,0]=3 1321 B12R1.654 COc1ccc(c(c1F)S[13CH3])F 62a_100010946477_200025704644 [0,1,0,0,0,0|1,1,0]=3 1322 B12R1.654 COc1ccc(c(c1F)S[13CH3])F 62a_200025704644_100010946477 [0,1,0,0,0,0|1,1,0]=3 1323 B12R1.654 COc1ccc(c(c1O)C=O)F 271570a_203496583355_200010245882 [0,1,0,0,0,0|2,0,0]=3 1324 B12R1.654 COc1ccc(c(c1O)C=O)O 271570a_203496583355_100009813834 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.654 COc1ccc(c(c1O)CO)F 271570a_203496583355_200010942130 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.654 COc1ccc(c(c1O)SC)F 271570a_203496583355_200021624531 [0,1,0,0,0,0|0,1,0]=2 1327 B12R1.654 CSc1c(ccc(c1F)S[13CH3])F 62a_200025704644_202125771753 [0,1,0,0,0,0|1,2,0]=4 1328 B12R1.654 CSc1c(ccc(c1F)S[13CH3])F 62a_202125771753_200025704644 [0,1,0,0,0,0|1,2,0]=4 1329 B12R1.654 CSc1c(ccc(c1O)C#N)F 62a_200000210301_100010128267 [0,1,0,0,0,0|2,1,0]=4 1330 B12R1.654 CSc1ccc(c(c1F)SC)F 62a_200000210301_202125771753 [0,1,0,0,0,0|1,2,0]=4 1331 B12R1.654 CSc1ccc(c(c1F)SC)F 62a_202125771753_200000210301 [0,1,0,0,0,0|1,2,0]=4 1332 B12R1.654 [13CH3]Sc1c(ccc(c1O)C#N)F 62a_200025704644_100010128267 [0,1,0,0,0,0|2,1,0]=4 1333 B12R1.1879 C=Cc1c(cccc1CC)CC 271570a_100011290941_100010212195 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.1879 C=Cc1c(cccc1OC)CO 271570a_100011290941_100010236476 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.1879 C=Cc1c(cccc1OC)OC 271570a_100011290941_100000050062 [0,1,0,0,0,0|1,0,0]=2 1336 B12R1.1879 C=Cc1c(ccnc1OC)OC 271570a_100011290941_100010114374 [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.1879 C=Cc1c(cncc1OC)OC 271570a_100011290941_200010191558 [0,1,0,0,0,0|2,0,0]=3 1338 B12R1.1879 C=Cc1c(cnnc1OC)OC 271570a_100011290941_100009871623 [0,1,0,0,0,0|3,0,0]=4 1339 B12R1.1879 C=Cc1c(ncnc1OC)OC 271570a_100011290941_100009995502 [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.1879 C=Cc1cccc(c1C#N)OC 271570a_100011290941_100012356440 [0,1,0,0,0,0|2,0,1]=4 1341 B12R1.1879 C=Cc1cccc(c1C=O)OC 271570a_100011290941_100009814803 [0,1,0,0,0,0|1,0,2]=4 1342 B12R1.1879 C=Cc1cccc(c1OC)OC 271570a_100011290941_100009815961 [0,1,0,0,0,0|1,0,1]=3 1343 B12R1.1879 CCc1cccc(c1NC)CC 2230a_100000211307_200000210301 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.1879 CCc1cccc(c1NC)CC 34a_100000211307_200000210301 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.1879 CCc1cccc(c1NC)CC 7a_100000211307_200000210301 [0,1,0,0,0,0|3,0,0]=4 1346 B12R1.1879 CCc1cccc(c1N[13CH3])CC 2230a_100000211307_200025704644 [0,1,0,0,0,0|3,0,0]=4 1347 B12R1.1879 CCc1cccc(c1N[13CH3])CC 34a_100000211307_200025704644 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.1879 CCc1cccc(c1N[13CH3])CC 7a_100000211307_200025704644 [0,1,0,0,0,0|3,0,0]=4 1349 B12R1.1879 CCc1cccc(c1OC)CC 34a_100000078057_200000210301 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.1879 CCc1cccc(c1OC)CC 7a_100000078057_200000210301 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.1879 CCc1cccc(c1O[13CH3])CC 34a_100000078057_200025704644 [0,1,0,0,0,0|2,0,0]=3 1352 B12R1.1879 CCc1cccc(c1O[13CH3])CC 7a_100000078057_200025704644 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.1879 CCc1cccc(c1SC)CC 62a_100010212195_200000210301 [0,1,0,0,0,0|2,1,0]=4 1354 B12R1.1879 CCc1cccc(c1SC)CC 62a_200000210301_100010212195 [0,1,0,0,0,0|2,1,0]=4 1355 B12R1.1879 CCc1cccc(c1S[13CH3])CC 62a_100010212195_200025704644 [0,1,0,0,0,0|2,1,0]=4 1356 B12R1.1879 CCc1cccc(c1S[13CH3])CC 62a_200025704644_100010212195 [0,1,0,0,0,0|2,1,0]=4 1357 B12R1.1879 CNc1c(cccc1OC)C#N 2230a_100000722693_200000210301 [0,1,0,0,0,0|3,0,0]=4 1358 B12R1.1879 CNc1c(cccc1OC)CO 34a_100011999522_200000210301 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.1879 CNc1c(cccc1OC)OC 2230a_100011218430_200000210301 [0,1,0,0,0,0|1,0,0]=2 1360 B12R1.1879 CNc1c(cccc1OC)OC 34a_100011218430_200000210301 [0,1,0,0,0,0|1,0,0]=2 1361 B12R1.1879 CNc1c(cccc1SC)OC 2230a_200012283368_200000210301 [0,1,0,0,0,0|1,1,0]=3 1362 B12R1.1879 CNc1c(cccc1SC)OC 34a_200012283368_200000210301 [0,1,0,0,0,0|1,1,0]=3 1363 B12R1.1879 CNc1cccc(c1C#N)SC 62a_200000210301_200012769483 [0,1,0,0,0,0|2,1,0]=4 1364 B12R1.1879 CNc1cccc(c1C#N)S[13CH3] 62a_200025704644_200012769483 [0,1,0,0,0,0|2,1,0]=4 1365 B12R1.1879 CNc1cccc(c1OC)C#N 34a_100000128487_200000210301 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.1879 CNc1cccc(c1OC)OC 34a_100011217386_200000210301 [0,1,0,0,0,0|1,0,0]=2 1367 B12R1.1879 CNc1ccnc(c1C#N)OC 27a_100102657272_200009870389 [0,1,0,0,0,0|3,0,0]=4 1368 B12R1.1879 CNc1nccc(c1C#N)OC 27a_100102657272_100000047147 [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.1879 CNc1ncnc(c1OC)OC 27a_100102657272_100012964862 [0,1,0,0,0,0|3,0,0]=4 1370 B12R1.1879 COc1c(cccc1N[13CH3])C#N 34a_100000128487_200025704644 [0,1,0,0,0,0|3,0,0]=4 1371 B12R1.1879 COc1c(cccc1O[13CH3])C#N 34a_200009874251_200025704644 [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.1879 COc1c(cccc1SC)C#N 62a_200000210301_100009817008 [0,1,0,0,0,0|2,1,0]=4 1373 B12R1.1879 COc1c(cccc1SC)C=O 62a_100000692592_200000210301 [0,1,0,0,0,0|2,1,0]=4 1374 B12R1.1879 COc1c(cccc1SC)C=O 62a_200000210301_100000692592 [0,1,0,0,0,0|2,1,0]=4 1375 B12R1.1879 COc1c(cccc1SC)CO 62a_100000704359_200000210301 [0,1,0,0,0,0|2,1,0]=4 1376 B12R1.1879 COc1c(cccc1SC)CO 62a_200000210301_100000704359 [0,1,0,0,0,0|2,1,0]=4 1377 B12R1.1879 COc1c(cccc1S[13CH3])C#N 62a_200025704644_100009817008 [0,1,0,0,0,0|2,1,0]=4 1378 B12R1.1879 COc1c(cccc1S[13CH3])C=O 62a_100000692592_200025704644 [0,1,0,0,0,0|2,1,0]=4 1379 B12R1.1879 COc1c(cccc1S[13CH3])C=O 62a_200025704644_100000692592 [0,1,0,0,0,0|2,1,0]=4 1380 B12R1.1879 COc1c(cccc1S[13CH3])CO 62a_100000704359_200025704644 [0,1,0,0,0,0|2,1,0]=4 1381 B12R1.1879 COc1c(cccc1S[13CH3])CO 62a_200025704644_100000704359 [0,1,0,0,0,0|2,1,0]=4 1382 B12R1.1879 COc1cccc(c1C#N)SC 62a_200000210301_100012356440 [0,1,0,0,0,0|1,1,0]=3 1383 B12R1.1879 COc1cccc(c1C#N)S[13CH3] 62a_200025704644_100012356440 [0,1,0,0,0,0|1,1,0]=3 1384 B12R1.1879 COc1cccc(c1C=O)SC 62a_100009814803_200000210301 [0,1,0,0,0,0|0,1,1]=3 1385 B12R1.1879 COc1cccc(c1C=O)S[13CH3] 62a_100009814803_200025704644 [0,1,0,0,0,0|0,1,1]=3 1386 B12R1.1879 COc1cccc(c1N[13CH3])C#N 2230a_100000722693_200025704644 [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.1879 COc1cccc(c1N[13CH3])CO 34a_100011999522_200025704644 [0,1,0,0,0,0|3,0,0]=4 1388 B12R1.1879 COc1cccc(c1N[13CH3])OC 2230a_100011218430_200025704644 [0,1,0,0,0,0|1,0,0]=2 1389 B12R1.1879 COc1cccc(c1N[13CH3])OC 34a_100011218430_200025704644 [0,1,0,0,0,0|1,0,0]=2 1390 B12R1.1879 COc1cccc(c1N[13CH3])SC 2230a_200012283368_200025704644 [0,1,0,0,0,0|1,1,0]=3 1391 B12R1.1879 COc1cccc(c1N[13CH3])SC 34a_200012283368_200025704644 [0,1,0,0,0,0|1,1,0]=3 1392 B12R1.1879 COc1cccc(c1OC)C#N 34a_100011934230_200000210301 [0,1,0,0,0,0|2,0,0]=3 1393 B12R1.1879 COc1cccc(c1OC)C#N 34a_200009874251_200000210301 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.1879 COc1cccc(c1OC)CO 34a_100011218668_200000210301 [0,1,0,0,0,0|2,0,0]=3 1395 B12R1.1879 COc1cccc(c1OC)N[13CH3] 34a_100011217386_200025704644 [0,1,0,0,0,0|1,0,0]=2 1396 B12R1.1879 COc1cccc(c1OC)OC 34a_100000032319_200000210301 [0,1,0,0,0,0|0,0,0]=1 1397 B12R1.1879 COc1cccc(c1OC)OC 34a_100000211025_200000210301 [0,1,0,0,0,0|0,0,0]=1 1398 B12R1.1879 COc1cccc(c1OC)O[13CH3] 34a_100000032319_200025704644 [0,1,0,0,0,0|0,0,0]=1 1399 B12R1.1879 COc1cccc(c1OC)SC 62a_200000210301_100010163134 [0,1,0,0,0,0|0,1,0]=2 1400 B12R1.1879 COc1cccc(c1OC)S[13CH3] 62a_200025704644_100010163134 [0,1,0,0,0,0|0,1,0]=2 1401 B12R1.1879 COc1cccc(c1O[13CH3])C#N 34a_100011934230_200025704644 [0,1,0,0,0,0|2,0,0]=3 1402 B12R1.1879 COc1cccc(c1O[13CH3])CO 34a_100011218668_200025704644 [0,1,0,0,0,0|2,0,0]=3 1403 B12R1.1879 COc1cccc(c1O[13CH3])OC 34a_100000211025_200025704644 [0,1,0,0,0,0|0,0,0]=1 1404 B12R1.1879 COc1cccc(c1SC)C=O 62a_100010209554_200000210301 [0,1,0,0,0,0|2,1,0]=4 1405 B12R1.1879 COc1cccc(c1SC)C=O 62a_200000210301_100010209554 [0,1,0,0,0,0|2,1,0]=4 1406 B12R1.1879 COc1cccc(c1SC)CO 62a_100010236476_200000210301 [0,1,0,0,0,0|2,1,0]=4 1407 B12R1.1879 COc1cccc(c1SC)CO 62a_200000210301_100010236476 [0,1,0,0,0,0|2,1,0]=4 1408 B12R1.1879 COc1cccc(c1SC)OC 62a_100000690108_200000210301 [0,1,0,0,0,0|0,1,0]=2 1409 B12R1.1879 COc1cccc(c1SC)OC 62a_200000210301_100000690108 [0,1,0,0,0,0|0,1,0]=2 1410 B12R1.1879 COc1cccc(c1S[13CH3])C=O 62a_100010209554_200025704644 [0,1,0,0,0,0|2,1,0]=4 1411 B12R1.1879 COc1cccc(c1S[13CH3])C=O 62a_200025704644_100010209554 [0,1,0,0,0,0|2,1,0]=4 1412 B12R1.1879 COc1cccc(c1S[13CH3])CO 62a_100010236476_200025704644 [0,1,0,0,0,0|2,1,0]=4 1413 B12R1.1879 COc1cccc(c1S[13CH3])CO 62a_200025704644_100010236476 [0,1,0,0,0,0|2,1,0]=4 1414 B12R1.1879 COc1cccc(c1S[13CH3])OC 62a_100000690108_200025704644 [0,1,0,0,0,0|0,1,0]=2 1415 B12R1.1879 COc1cccc(c1S[13CH3])OC 62a_200025704644_100000690108 [0,1,0,0,0,0|0,1,0]=2 1416 B12R1.1879 COc1ccnc(c1C#N)SC 62a_200000210301_100000047147 [0,1,0,0,0,0|2,1,0]=4 1417 B12R1.1879 COc1ccnc(c1C#N)S[13CH3] 62a_200025704644_100000047147 [0,1,0,0,0,0|2,1,0]=4 1418 B12R1.1879 COc1ccnc(c1C=O)SC 62a_200000210301_100009860067 [0,1,0,0,0,0|1,1,1]=4 1419 B12R1.1879 COc1ccnc(c1C=O)S[13CH3] 62a_200025704644_100009860067 [0,1,0,0,0,0|1,1,1]=4 1420 B12R1.1879 COc1ccnc(c1SC)OC 62a_100010114374_200000210301 [0,1,0,0,0,0|1,1,0]=3 1421 B12R1.1879 COc1ccnc(c1SC)OC 62a_200000210301_100010114374 [0,1,0,0,0,0|1,1,0]=3 1422 B12R1.1879 COc1ccnc(c1S[13CH3])OC 62a_100010114374_200025704644 [0,1,0,0,0,0|1,1,0]=3 1423 B12R1.1879 COc1ccnc(c1S[13CH3])OC 62a_200025704644_100010114374 [0,1,0,0,0,0|1,1,0]=3 1424 B12R1.1879 COc1cncc(c1SC)OC 62a_200000210301_200010191558 [0,1,0,0,0,0|1,1,0]=3 1425 B12R1.1879 COc1cncc(c1SC)OC 62a_200010191558_200000210301 [0,1,0,0,0,0|1,1,0]=3 1426 B12R1.1879 COc1cncc(c1S[13CH3])OC 62a_200010191558_200025704644 [0,1,0,0,0,0|1,1,0]=3 1427 B12R1.1879 COc1cncc(c1S[13CH3])OC 62a_200025704644_200010191558 [0,1,0,0,0,0|1,1,0]=3 1428 B12R1.1879 COc1cnnc(c1SC)OC 62a_200000210301_100009871623 [0,1,0,0,0,0|2,1,0]=4 1429 B12R1.1879 COc1cnnc(c1S[13CH3])OC 62a_200025704644_100009871623 [0,1,0,0,0,0|2,1,0]=4 1430 B12R1.1879 COc1nccc(c1C#N)SC 62a_200000210301_200009870389 [0,1,0,0,0,0|2,1,0]=4 1431 B12R1.1879 COc1nccc(c1C#N)S[13CH3] 62a_200025704644_200009870389 [0,1,0,0,0,0|2,1,0]=4 1432 B12R1.1879 COc1nccc(c1C=O)SC 62a_100010160771_200000210301 [0,1,0,0,0,0|1,1,1]=4 1433 B12R1.1879 COc1nccc(c1C=O)SC 62a_200000210301_100010160771 [0,1,0,0,0,0|1,1,1]=4 1434 B12R1.1879 COc1nccc(c1C=O)S[13CH3] 62a_100010160771_200025704644 [0,1,0,0,0,0|1,1,1]=4 1435 B12R1.1879 COc1nccc(c1C=O)S[13CH3] 62a_200025704644_100010160771 [0,1,0,0,0,0|1,1,1]=4 1436 B12R1.1879 COc1ncnc(c1OC)SC 62a_200000210301_100012964862 [0,1,0,0,0,0|2,1,0]=4 1437 B12R1.1879 COc1ncnc(c1OC)S[13CH3] 62a_200025704644_100012964862 [0,1,0,0,0,0|2,1,0]=4 1438 B12R1.1879 COc1ncnc(c1SC)OC 62a_100009995502_200000210301 [0,1,0,0,0,0|2,1,0]=4 1439 B12R1.1879 COc1ncnc(c1SC)OC 62a_200000210301_100009995502 [0,1,0,0,0,0|2,1,0]=4 1440 B12R1.1879 COc1ncnc(c1S[13CH3])OC 62a_100009995502_200025704644 [0,1,0,0,0,0|2,1,0]=4 1441 B12R1.1879 COc1ncnc(c1S[13CH3])OC 62a_200025704644_100009995502 [0,1,0,0,0,0|2,1,0]=4 1442 B12R2.315 C=Cc1cccc2c1CCO2 271570a_100011290941_100009819624 [0,0,0,1,0,0|2,0,1]=4 1443 B12R2.315 C=Cc1cccc2c1OCC2 271570a_100011290941_100009818991 [0,0,0,1,0,0|2,0,1]=4 1444 B12R2.315 C=Cc1cccc2c1OCO2 271570a_100011290941_100009814252 [0,0,0,1,0,0|1,0,1]=3 1445 B12R2.315 CNc1cccc2c1CCC2 2230a_100000043548_200000210301 [0,0,0,1,0,0|3,0,0]=4 1446 B12R2.315 CNc1cccc2c1CCC2 34a_100000043548_200000210301 [0,0,0,1,0,0|3,0,0]=4 1447 B12R2.315 CNc1cccc2c1CCO2 2230a_100000084147_200000210301 [0,0,0,1,0,0|2,0,0]=3 1448 B12R2.315 CNc1cccc2c1CCO2 34a_100000084147_200000210301 [0,0,0,1,0,0|2,0,0]=3 1449 B12R2.315 CNc1cccc2c1OCC2 2230a_100000102157_200000210301 [0,0,0,1,0,0|2,0,0]=3 1450 B12R2.315 CNc1cccc2c1OCC2 34a_100000102157_200000210301 [0,0,0,1,0,0|2,0,0]=3 1451 B12R2.315 CNc1cccc2c1OCO2 2230a_100000699912_200000210301 [0,0,0,1,0,0|1,0,0]=2 1452 B12R2.315 CNc1cccc2c1OCO2 34a_100000699912_200000210301 [0,0,0,1,0,0|1,0,0]=2 1453 B12R2.315 CNc1cccc2c1nco2 34a_100000717946_200000210301 [0,0,0,1,0,0|2,0,1]=4 1454 B12R2.315 COc1cccc2c1CCC2 34a_100000074356_200000210301 [0,0,0,1,0,0|2,0,0]=3 1455 B12R2.315 COc1cccc2c1CCC2 7a_100000074356_200000210301 [0,0,0,1,0,0|2,0,0]=3 1456 B12R2.315 COc1cccc2c1CCN2 34a_100000703684_200000210301 [0,0,0,1,0,0|2,0,0]=3 1457 B12R2.315 COc1cccc2c1CCO2 34a_100000090053_200000210301 [0,0,0,1,0,0|1,0,0]=2 1458 B12R2.315 COc1cccc2c1CCO2 7a_100000090053_200000210301 [0,0,0,1,0,0|1,0,0]=2 1459 B12R2.315 COc1cccc2c1CNC2 34a_100015191671_200000210301 [0,0,0,1,0,0|3,0,0]=4 1460 B12R2.315 COc1cccc2c1OCO2 34a_100000046630_200000210301 [0,0,0,1,0,0|0,0,0]=1 1461 B12R2.315 COc1cccc2c1OCO2 7a_100000046630_200000210301 [0,0,0,1,0,0|0,0,0]=1 1462 B12R2.315 COc1cccc2c1cc[nH]2 34a_100000763377_200000210301 [0,0,0,1,0,0|2,0,1]=4 1463 B12R2.315 COc1cccc2c1ccs2 34a_100000077759_200000210301 [0,0,0,1,0,0|1,1,1]=4 1464 B12R2.315 COc1cccc2c1ccs2 7a_100000077759_200000210301 [0,0,0,1,0,0|1,1,1]=4 1465 B12R2.315 COc1cccc2c1ncs2 34a_100000101385_200000210301 [0,0,0,1,0,0|1,1,1]=4 1466 B12R2.315 COc1cccc2c1ncs2 7a_100000101385_200000210301 [0,0,0,1,0,0|1,1,1]=4 1467 B12R2.315 CSc1cccc2c1CCC2 62a_100010343934_200000210301 [0,0,0,1,0,0|2,1,0]=4 1468 B12R2.315 CSc1cccc2c1CCC2 62a_200000210301_100010343934 [0,0,0,1,0,0|2,1,0]=4 1469 B12R2.315 CSc1cccc2c1CCN2 62a_100009817896_200000210301 [0,0,0,1,0,0|2,1,0]=4 1470 B12R2.315 CSc1cccc2c1CCN2 62a_200000210301_100009817896 [0,0,0,1,0,0|2,1,0]=4 1471 B12R2.315 CSc1cccc2c1CCO2 62a_100009819624_200000210301 [0,0,0,1,0,0|1,1,0]=3 1472 B12R2.315 CSc1cccc2c1CCO2 62a_200000210301_100009819624 [0,0,0,1,0,0|1,1,0]=3 1473 B12R2.315 CSc1cccc2c1NCC2 62a_100016995435_200000210301 [0,0,0,1,0,0|2,1,0]=4 1474 B12R2.315 CSc1cccc2c1NCC2 62a_200000210301_100016995435 [0,0,0,1,0,0|2,1,0]=4 1475 B12R2.315 CSc1cccc2c1OCC2 62a_100009818991_200000210301 [0,0,0,1,0,0|1,1,0]=3 1476 B12R2.315 CSc1cccc2c1OCC2 62a_200000210301_100009818991 [0,0,0,1,0,0|1,1,0]=3 1477 B12R2.315 CSc1cccc2c1cco2 62a_200000210301_100000756496 [0,0,0,1,0,0|1,1,1]=4 1478 B12R2.315 CSc1cccc2c1cno2 62a_200000210301_100009818589 [0,0,0,1,0,0|2,1,0]=4 1479 B12R2.315 CSc1cccc2c1nco2 62a_200000210301_100009816834 [0,0,0,1,0,0|1,1,1]=4 1480 B12R2.315 CSc1cccc2c1occ2 62a_200000210301_100011935138 [0,0,0,1,0,0|1,1,1]=4 1481 B12R2.315 CSc1cccc2c1ocn2 62a_200000210301_100000728214 [0,0,0,1,0,0|1,1,1]=4 1482 B12R2.315 CSc1cccc2c1onc2 62a_200000210301_100000765530 [0,0,0,1,0,0|2,1,0]=4 1483 B12R2.315 [13CH3]Nc1cccc2c1CCC2 2230a_100000043548_200025704644 [0,0,0,1,0,0|3,0,0]=4 1484 B12R2.315 [13CH3]Nc1cccc2c1CCC2 34a_100000043548_200025704644 [0,0,0,1,0,0|3,0,0]=4 1485 B12R2.315 [13CH3]Nc1cccc2c1CCO2 2230a_100000084147_200025704644 [0,0,0,1,0,0|2,0,0]=3 1486 B12R2.315 [13CH3]Nc1cccc2c1CCO2 34a_100000084147_200025704644 [0,0,0,1,0,0|2,0,0]=3 1487 B12R2.315 [13CH3]Nc1cccc2c1OCC2 2230a_100000102157_200025704644 [0,0,0,1,0,0|2,0,0]=3 1488 B12R2.315 [13CH3]Nc1cccc2c1OCC2 34a_100000102157_200025704644 [0,0,0,1,0,0|2,0,0]=3 1489 B12R2.315 [13CH3]Nc1cccc2c1OCO2 2230a_100000699912_200025704644 [0,0,0,1,0,0|1,0,0]=2 1490 B12R2.315 [13CH3]Nc1cccc2c1OCO2 34a_100000699912_200025704644 [0,0,0,1,0,0|1,0,0]=2 1491 B12R2.315 [13CH3]Nc1cccc2c1nco2 34a_100000717946_200025704644 [0,0,0,1,0,0|2,0,1]=4 1492 B12R2.315 [13CH3]Oc1cccc2c1CCC2 34a_100000074356_200025704644 [0,0,0,1,0,0|2,0,0]=3 1493 B12R2.315 [13CH3]Oc1cccc2c1CCC2 7a_100000074356_200025704644 [0,0,0,1,0,0|2,0,0]=3 1494 B12R2.315 [13CH3]Oc1cccc2c1CCN2 34a_100000703684_200025704644 [0,0,0,1,0,0|2,0,0]=3 1495 B12R2.315 [13CH3]Oc1cccc2c1CCO2 34a_100000090053_200025704644 [0,0,0,1,0,0|1,0,0]=2 1496 B12R2.315 [13CH3]Oc1cccc2c1CCO2 7a_100000090053_200025704644 [0,0,0,1,0,0|1,0,0]=2 1497 B12R2.315 [13CH3]Oc1cccc2c1CNC2 34a_100015191671_200025704644 [0,0,0,1,0,0|3,0,0]=4 1498 B12R2.315 [13CH3]Oc1cccc2c1OCO2 34a_100000046630_200025704644 [0,0,0,1,0,0|0,0,0]=1 1499 B12R2.315 [13CH3]Oc1cccc2c1OCO2 7a_100000046630_200025704644 [0,0,0,1,0,0|0,0,0]=1 1500 B12R2.315 [13CH3]Oc1cccc2c1cc[nH]2 34a_100000763377_200025704644 [0,0,0,1,0,0|2,0,1]=4 1501 B12R2.315 [13CH3]Oc1cccc2c1ccs2 34a_100000077759_200025704644 [0,0,0,1,0,0|1,1,1]=4 1502 B12R2.315 [13CH3]Oc1cccc2c1ccs2 7a_100000077759_200025704644 [0,0,0,1,0,0|1,1,1]=4 1503 B12R2.315 [13CH3]Oc1cccc2c1ncs2 34a_100000101385_200025704644 [0,0,0,1,0,0|1,1,1]=4 1504 B12R2.315 [13CH3]Oc1cccc2c1ncs2 7a_100000101385_200025704644 [0,0,0,1,0,0|1,1,1]=4 1505 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_100010343934_200025704644 [0,0,0,1,0,0|2,1,0]=4 1506 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_200025704644_100010343934 [0,0,0,1,0,0|2,1,0]=4 1507 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_100009817896_200025704644 [0,0,0,1,0,0|2,1,0]=4 1508 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_200025704644_100009817896 [0,0,0,1,0,0|2,1,0]=4 1509 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_100009819624_200025704644 [0,0,0,1,0,0|1,1,0]=3 1510 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_200025704644_100009819624 [0,0,0,1,0,0|1,1,0]=3 1511 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_100016995435_200025704644 [0,0,0,1,0,0|2,1,0]=4 1512 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_200025704644_100016995435 [0,0,0,1,0,0|2,1,0]=4 1513 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_100009818991_200025704644 [0,0,0,1,0,0|1,1,0]=3 1514 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_200025704644_100009818991 [0,0,0,1,0,0|1,1,0]=3 1515 B12R2.315 [13CH3]Sc1cccc2c1cco2 62a_200025704644_100000756496 [0,0,0,1,0,0|1,1,1]=4 1516 B12R2.315 [13CH3]Sc1cccc2c1cno2 62a_200025704644_100009818589 [0,0,0,1,0,0|2,1,0]=4 1517 B12R2.315 [13CH3]Sc1cccc2c1nco2 62a_200025704644_100009816834 [0,0,0,1,0,0|1,1,1]=4 1518 B12R2.315 [13CH3]Sc1cccc2c1occ2 62a_200025704644_100011935138 [0,0,0,1,0,0|1,1,1]=4 1519 B12R2.315 [13CH3]Sc1cccc2c1ocn2 62a_200025704644_100000728214 [0,0,0,1,0,0|1,1,1]=4 1520 B12R2.315 [13CH3]Sc1cccc2c1onc2 62a_200025704644_100000765530 [0,0,0,1,0,0|2,1,0]=4 1521 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|1,0,1]=4 1522 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|1,0,1]=4 1523 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [2,0,0,0,0,0|2,0,0]=4 1524 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|1,0,0]=3 1525 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [2,0,0,0,0,0|2,0,0]=4 1526 B9R1.2 CCc1ccnc(c1)O 271570a_203496583355_100009817561 [2,0,0,0,0,0|2,0,0]=4 1527 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [2,0,0,0,0,0|2,0,0]=4 1528 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [2,0,0,0,0,0|2,0,0]=4 1529 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 1530 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,0,0,0,0,0|1,0,0]=3 1531 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,0,0,0,0,0|1,0,0]=3 1532 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,0,0,0,0,0|2,0,0]=4 1533 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,0,0,0,0,0|2,0,0]=4 1534 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,0,0,0,0,0|2,0,0]=4 1535 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,0,0,0,0,0|1,0,0]=3 1536 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,0,0,0,0,0|1,0,0]=3 1537 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [2,0,0,0,0,0|2,0,0]=4 1538 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [2,0,0,0,0,0|2,0,0]=4 1539 B9R1.2 CNc1ccnc(c1)O 271570a_203496583355_100009869472 [2,0,0,0,0,0|2,0,0]=4 1540 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [2,0,0,0,0,0|2,0,0]=4 1541 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [2,0,0,0,0,0|1,0,0]=3 1542 B9R1.2 COc1cc(cnn1)C 34a_100000766097_200000210301 [2,0,0,0,0,0|2,0,0]=4 1543 B9R1.2 COc1cc(ncn1)O 271570a_203496583355_100012187182 [2,0,0,0,0,0|2,0,0]=4 1544 B9R1.2 COc1cc[nH]c(=O)c1 34a_100000032262_200000210301 [2,0,0,0,0,0|1,0,1]=4 1545 B9R1.2 COc1ccc[n+](c1)[O-] 34a_100000039713_200000210301 [2,0,0,0,0,0|1,0,1]=4 1546 B9R1.2 COc1ccc[n+](c1)[O-] 7a_100000039713_200000210301 [2,0,0,0,0,0|1,0,1]=4 1547 B9R1.2 COc1cccc(=O)[nH]1 34a_100000033347_200000210301 [2,0,0,0,0,0|1,0,1]=4 1548 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,0,0,0,0,0|1,0,0]=3 1549 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,0,0,0,0,0|1,0,0]=3 1550 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,0,0,0,0,0|0,0,0]=2 1551 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,0,0,0,0,0|0,0,0]=2 1552 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,0,0,0,0,0|1,0,0]=3 1553 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,0,0,0,0,0|1,0,0]=3 1554 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,0,0,0,0,0|1,0,0]=3 1555 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,0,0,0,0,0|1,0,0]=3 1556 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,0,0,0,0,0|1,0,0]=3 1557 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,0,0,0,0,0|1,0,0]=3 1558 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,0,0,0,0,0|1,0,0]=3 1559 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,0,0,0,0,0|0,0,0]=2 1560 B9R1.2 COc1cccc(n1)F 34a_100011432558_200000210301 [2,0,0,0,0,0|2,0,0]=4 1561 B9R1.2 COc1cccc(n1)O 271570a_203496583355_100000760917 [2,0,0,0,0,0|1,0,0]=3 1562 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [2,0,0,0,0,0|1,0,0]=3 1563 B9R1.2 COc1ccnc(c1)Cl 34a_100000762945_200000210301 [2,0,0,0,0,0|2,0,0]=4 1564 B9R1.2 COc1ccnc(c1)F 34a_100000732698_200000210301 [2,0,0,0,0,0|2,0,0]=4 1565 B9R1.2 COc1ccnc(c1)N 34a_100011834064_200000210301 [2,0,0,0,0,0|2,0,0]=4 1566 B9R1.2 COc1ccnc(c1)O 271570a_203496583355_100011216251 [2,0,0,0,0,0|1,0,0]=3 1567 B9R1.2 COc1ccnc(n1)O 271570a_203496583355_100000182009 [2,0,0,0,0,0|2,0,0]=4 1568 B9R1.2 COc1cncc(c1)Br 34a_100000754920_200000210301 [2,0,0,0,0,0|2,0,0]=4 1569 B9R1.2 COc1cncc(c1)Br 7a_100000754920_200000210301 [2,0,0,0,0,0|2,0,0]=4 1570 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [2,0,0,0,0,0|1,0,0]=3 1571 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [2,0,0,0,0,0|1,0,0]=3 1572 B9R1.2 COc1cncc(c1)Cl 7a_100000032511_200000210301 [2,0,0,0,0,0|2,0,0]=4 1573 B9R1.2 COc1cncc(c1)F 34a_100011830296_200000210301 [2,0,0,0,0,0|2,0,0]=4 1574 B9R1.2 COc1cncc(c1)F 7a_100011830296_200000210301 [2,0,0,0,0,0|2,0,0]=4 1575 B9R1.2 COc1cncc(c1)N 34a_100011997051_200000210301 [2,0,0,0,0,0|2,0,0]=4 1576 B9R1.2 COc1cncc(c1)O 271570a_203496583355_100000684773 [2,0,0,0,0,0|1,0,0]=3 1577 B9R1.2 COc1cncc(n1)O 271570a_203496583355_100000756030 [2,0,0,0,0,0|2,0,0]=4 1578 B9R1.2 COc1cnnc(c1)O 271570a_203496583355_100000087634 [2,0,0,0,0,0|2,0,0]=4 1579 B9R1.2 COc1nccc(n1)O 271570a_203496583355_100000069072 [2,0,0,0,0,0|2,0,0]=4 1580 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [2,0,0,0,0,0|1,1,0]=4 1581 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [2,0,0,0,0,0|1,1,0]=4 1582 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [2,0,0,0,0,0|1,1,0]=4 1583 B9R1.2 CSc1ccc[n+](c1)C 62a_100009996589_200000210301 [2,0,0,0,0,0|1,1,0]=4 1584 B9R1.2 CSc1ccc[n+](c1)C 62a_200000210301_100009996589 [2,0,0,0,0,0|1,1,0]=4 1585 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,0,0,0,0,0|1,1,0]=4 1586 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,0,0,0,0,0|1,1,0]=4 1587 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,0,0,0,0,0|0,1,0]=3 1588 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,0,0,0,0,0|0,1,0]=3 1589 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,0,0,0,0,0|1,1,0]=4 1590 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,0,0,0,0,0|1,1,0]=4 1591 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,0,0,0,0,0|1,1,0]=4 1592 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,0,0,0,0,0|1,1,0]=4 1593 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,0,0,0,0,0|1,1,0]=4 1594 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,0,0,0,0,0|1,1,0]=4 1595 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,0,0,0,0,0|0,1,0]=3 1596 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,0,0,0,0,0|0,1,0]=3 1597 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,0,0,0,0,0|0,2,0]=4 1598 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,0,0,0,0,0|0,2,0]=4 1599 B9R1.2 CSc1cccc(n1)C 62a_100000742759_200000210301 [2,0,0,0,0,0|1,1,0]=4 1600 B9R1.2 CSc1cccc(n1)C 62a_200000210301_100000742759 [2,0,0,0,0,0|1,1,0]=4 1601 B9R1.2 CSc1cccc(n1)O 271570a_203496583355_100011960944 [2,0,0,0,0,0|1,1,0]=4 1602 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [2,0,0,0,0,0|1,1,0]=4 1603 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [2,0,0,0,0,0|1,1,0]=4 1604 B9R1.2 CSc1ccnc(c1)O 271570a_203496583355_100010883326 [2,0,0,0,0,0|1,1,0]=4 1605 B9R1.2 CSc1cncc(c1)C 62a_100000760492_200000210301 [2,0,0,0,0,0|1,1,0]=4 1606 B9R1.2 CSc1cncc(c1)C 62a_200000210301_100000760492 [2,0,0,0,0,0|1,1,0]=4 1607 B9R1.2 CSc1cncc(c1)O 271570a_203496583355_100009816972 [2,0,0,0,0,0|1,1,0]=4 1608 B9R1.2 CSc1cncc(c1)O 62a_100000754920_200000210301 [2,0,0,0,0,0|1,1,0]=4 1609 B9R1.2 CSc1cncc(c1)O 62a_200000210301_100000754920 [2,0,0,0,0,0|1,1,0]=4 1610 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_100009996589_200025704644 [2,0,0,0,0,0|1,1,0]=4 1611 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_200025704644_100009996589 [2,0,0,0,0,0|1,1,0]=4 1612 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [2,0,0,0,0,0|1,0,0]=3 1613 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [2,0,0,0,0,0|1,1,0]=4 1614 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [2,0,0,0,0,0|1,1,0]=4 1615 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,0,0,0,0,0|1,0,0]=3 1616 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,0,0,0,0,0|1,0,0]=3 1617 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,0,0,0,0,0|0,0,0]=2 1618 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,0,0,0,0,0|0,0,0]=2 1619 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,0,0,0,0,0|0,1,0]=3 1620 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,0,0,0,0,0|0,1,0]=3 1621 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_100000742759_200025704644 [2,0,0,0,0,0|1,1,0]=4 1622 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_200025704644_100000742759 [2,0,0,0,0,0|1,1,0]=4 1623 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [2,0,0,0,0,0|1,1,0]=4 1624 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [2,0,0,0,0,0|1,1,0]=4 1625 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [2,0,0,0,0,0|1,0,0]=3 1626 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [2,0,0,0,0,0|1,0,0]=3 1627 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_100000760492_200025704644 [2,0,0,0,0,0|1,1,0]=4 1628 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_200025704644_100000760492 [2,0,0,0,0,0|1,1,0]=4 1629 B9R1.2 Cc1cnnc(c1)O[13CH3] 34a_100000766097_200025704644 [2,0,0,0,0,0|2,0,0]=4 1630 B9R1.2 N#Cc1cccc(c1)O 271570a_203496583355_100000189340 [2,0,0,0,0,0|2,0,0]=4 1631 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,0,0,0,0,0|2,0,0]=4 1632 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [2,0,0,0,0,0|2,0,0]=4 1633 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|2,0,0]=4 1634 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,0,0,0,0,0|2,0,0]=4 1635 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,0,0,0,0,0|2,0,0]=4 1636 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 1637 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,0,0,0,0,0|2,0,0]=4 1638 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,0,0,0,0,0|2,0,0]=4 1639 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,0,0,0,0,0|2,0,0]=4 1640 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,0,0,0,0,0|1,0,0]=3 1641 B9R1.2 [13CH3]Oc1cc[nH]c(=O)c1 34a_100000032262_200025704644 [2,0,0,0,0,0|1,0,1]=4 1642 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 34a_100000039713_200025704644 [2,0,0,0,0,0|1,0,1]=4 1643 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 7a_100000039713_200025704644 [2,0,0,0,0,0|1,0,1]=4 1644 B9R1.2 [13CH3]Oc1cccc(=O)[nH]1 34a_100000033347_200025704644 [2,0,0,0,0,0|1,0,1]=4 1645 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,0,0,0,0,0|1,0,0]=3 1646 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,0,0,0,0,0|1,0,0]=3 1647 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,0,0,0,0,0|1,0,0]=3 1648 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,0,0,0,0,0|1,0,0]=3 1649 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,0,0,0,0,0|1,0,0]=3 1650 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,0,0,0,0,0|1,0,0]=3 1651 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,0,0,0,0,0|1,0,0]=3 1652 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,0,0,0,0,0|1,0,0]=3 1653 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,0,0,0,0,0|1,0,0]=3 1654 B9R1.2 [13CH3]Oc1cccc(n1)F 34a_100011432558_200025704644 [2,0,0,0,0,0|2,0,0]=4 1655 B9R1.2 [13CH3]Oc1ccnc(c1)Cl 34a_100000762945_200025704644 [2,0,0,0,0,0|2,0,0]=4 1656 B9R1.2 [13CH3]Oc1ccnc(c1)F 34a_100000732698_200025704644 [2,0,0,0,0,0|2,0,0]=4 1657 B9R1.2 [13CH3]Oc1ccnc(c1)N 34a_100011834064_200025704644 [2,0,0,0,0,0|2,0,0]=4 1658 B9R1.2 [13CH3]Oc1cncc(c1)Br 34a_100000754920_200025704644 [2,0,0,0,0,0|2,0,0]=4 1659 B9R1.2 [13CH3]Oc1cncc(c1)Br 7a_100000754920_200025704644 [2,0,0,0,0,0|2,0,0]=4 1660 B9R1.2 [13CH3]Oc1cncc(c1)Cl 7a_100000032511_200025704644 [2,0,0,0,0,0|2,0,0]=4 1661 B9R1.2 [13CH3]Oc1cncc(c1)F 34a_100011830296_200025704644 [2,0,0,0,0,0|2,0,0]=4 1662 B9R1.2 [13CH3]Oc1cncc(c1)F 7a_100011830296_200025704644 [2,0,0,0,0,0|2,0,0]=4 1663 B9R1.2 [13CH3]Oc1cncc(c1)N 34a_100011997051_200025704644 [2,0,0,0,0,0|2,0,0]=4 1664 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [2,0,0,0,0,0|1,1,0]=4 1665 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,0,0,0,0,0|1,1,0]=4 1666 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,0,0,0,0,0|1,1,0]=4 1667 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,0,0,0,0,0|1,1,0]=4 1668 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,0,0,0,0,0|1,1,0]=4 1669 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,0,0,0,0,0|1,1,0]=4 1670 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,0,0,0,0,0|1,1,0]=4 1671 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,0,0,0,0,0|1,1,0]=4 1672 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,0,0,0,0,0|1,1,0]=4 1673 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,0,0,0,0,0|0,1,0]=3 1674 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,0,0,0,0,0|0,2,0]=4 1675 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,0,0,0,0,0|0,2,0]=4 1676 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_100000754920_200025704644 [2,0,0,0,0,0|1,1,0]=4 1677 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_200025704644_100000754920 [2,0,0,0,0,0|1,1,0]=4 1678 B9R1.3 Cc1c(cccc1Br)O 271570a_203496583355_100012353703 [2,0,0,0,0,0|2,0,0]=4 1679 B9R1.3 Cc1c(cccc1Cl)O 271570a_203496583355_100000726075 [2,0,0,0,0,0|2,0,0]=4 1680 B9R1.3 Cc1c(cccc1F)O 271570a_203496583355_100011216893 [2,0,0,0,0,0|2,0,0]=4 1681 B9R1.3 Cc1c(cccc1O)N 271570a_203496583355_100000761887 [2,0,0,0,0,0|2,0,0]=4 1682 B9R1.3 Cc1c(cccc1O)O 271570a_203496583355_100012002258 [2,0,0,0,0,0|1,0,0]=3 1683 B9R1.3 Cc1c(ccnc1O)O 271570a_203496583355_100009858498 [2,0,0,0,0,0|2,0,0]=4 1684 B9R1.3 Cc1ccc[n+](c1O)[O-] 271570a_203496583355_100116209805 [2,0,0,0,0,0|1,0,1]=4 1685 B9R1.3 Cc1cccc(c1C)O 271570a_203496583355_100011214922 [2,0,0,0,0,0|1,0,0]=3 1686 B9R1.3 Cc1cccc(c1Cl)O 271570a_203496583355_200012352035 [2,0,0,0,0,0|1,0,0]=3 1687 B9R1.3 Cc1cccc(c1F)O 271570a_203496583355_100000717567 [2,0,0,0,0,0|1,0,0]=3 1688 B9R1.3 Cc1cccc(c1N)O 271570a_203496583355_100011834072 [2,0,0,0,0,0|1,0,0]=3 1689 B9R1.3 Cc1cccc(c1O)C 271570a_203496583355_100000033847 [2,0,0,0,0,0|0,0,0]=2 1690 B9R1.3 Cc1cccc(c1O)Cl 271570a_203496583355_100000043165 [2,0,0,0,0,0|1,0,0]=3 1691 B9R1.3 Cc1cccc(c1O)F 271570a_203496583355_100012349962 [2,0,0,0,0,0|1,0,0]=3 1692 B9R1.3 Cc1cccc(c1O)N 271570a_203496583355_100000684715 [2,0,0,0,0,0|1,0,0]=3 1693 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100000686692 [2,0,0,0,0,0|0,0,0]=2 1694 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100009817157 [2,0,0,0,0,0|0,0,0]=2 1695 B9R1.3 Cc1ccnc(c1C)O 271570a_203496583355_100009847204 [2,0,0,0,0,0|2,0,0]=4 1696 B9R1.3 Cc1ccnc(c1F)O 271570a_203496583355_100009817629 [2,0,0,0,0,0|2,0,0]=4 1697 B9R1.3 Cc1ccnc(c1N)O 271570a_203496583355_100000763560 [2,0,0,0,0,0|2,0,0]=4 1698 B9R1.3 Cc1ccnc(c1O)C 271570a_203496583355_100012000501 [2,0,0,0,0,0|1,0,0]=3 1699 B9R1.3 Cc1ccnc(c1O)F 271570a_203496583355_100009818256 [2,0,0,0,0,0|2,0,0]=4 1700 B9R1.3 Cc1ccnc(c1O)N 271570a_203496583355_100011998619 [2,0,0,0,0,0|2,0,0]=4 1701 B9R1.3 Cc1ccnc(c1O)O 271570a_203496583355_100000696282 [2,0,0,0,0,0|1,0,0]=3 1702 B9R1.3 Cc1ccnc(c1O)O 271570a_203496583355_100012000493 [2,0,0,0,0,0|1,0,0]=3 1703 B9R1.3 Cc1cncc(c1C)O 271570a_203496583355_100009864703 [2,0,0,0,0,0|2,0,0]=4 1704 B9R1.3 Cc1cncc(c1N)O 271570a_203496583355_100009818025 [2,0,0,0,0,0|2,0,0]=4 1705 B9R1.3 Cc1cncc(c1O)C 271570a_203496583355_100009817138 [2,0,0,0,0,0|1,0,0]=3 1706 B9R1.3 Cc1nccc(c1C)O 271570a_203496583355_100009846815 [2,0,0,0,0,0|2,0,0]=4 1707 B9R1.3 Cc1nccc(c1Cl)O 271570a_203496583355_100000698670 [2,0,0,0,0,0|2,0,0]=4 1708 B9R1.3 Cc1nccc(c1F)O 271570a_203496583355_100009849794 [2,0,0,0,0,0|2,0,0]=4 1709 B9R1.3 Cc1nccc(c1N)O 271570a_203496583355_100009885578 [2,0,0,0,0,0|2,0,0]=4 1710 B9R1.3 Cc1nccc(c1O)N 271570a_203496583355_100010243816 [2,0,0,0,0,0|2,0,0]=4 1711 B9R1.3 Cc1ncnc(c1O)C 271570a_203496583355_100009820708 [2,0,0,0,0,0|2,0,0]=4 1712 B9R1.3 Cn1cccc(c1=O)O 271570a_203496583355_100000687173 [2,0,0,0,0,0|1,0,1]=4 1713 B9R1.3 Nc1c(cccc1Br)O 271570a_203496583355_100010146558 [2,0,0,0,0,0|2,0,0]=4 1714 B9R1.3 Nc1c(cccc1Cl)O 271570a_203496583355_100010190421 [2,0,0,0,0,0|2,0,0]=4 1715 B9R1.3 Nc1c(cccc1F)O 271570a_203496583355_100000042321 [2,0,0,0,0,0|2,0,0]=4 1716 B9R1.3 Nc1c(cccc1O)O 271570a_203496583355_100011934926 [2,0,0,0,0,0|1,0,0]=3 1717 B9R1.3 Nc1c(ccnc1O)O 271570a_203496583355_100000128729 [2,0,0,0,0,0|2,0,0]=4 1718 B9R1.3 Nc1cccc(c1F)O 271570a_203496583355_100011935091 [2,0,0,0,0,0|2,0,0]=4 1719 B9R1.3 Nc1cccc(c1N)O 271570a_203496583355_100015191791 [2,0,0,0,0,0|2,0,0]=4 1720 B9R1.3 Nc1cccc(c1O)Br 271570a_203496583355_100020590159 [2,0,0,0,0,0|2,0,0]=4 1721 B9R1.3 Nc1cccc(c1O)Cl 271570a_203496583355_100000049713 [2,0,0,0,0,0|2,0,0]=4 1722 B9R1.3 Nc1cccc(c1O)F 271570a_203496583355_100011934729 [2,0,0,0,0,0|2,0,0]=4 1723 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100011934915 [2,0,0,0,0,0|1,0,0]=3 1724 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100012183704 [2,0,0,0,0,0|1,0,0]=3 1725 B9R1.3 Oc1c(cccc1Br)Br 271570a_203496583355_100009994525 [2,0,0,0,0,0|2,0,0]=4 1726 B9R1.3 Oc1c(cccc1Br)Cl 271570a_203496583355_100010214488 [2,0,0,0,0,0|2,0,0]=4 1727 B9R1.3 Oc1c(cccc1Br)F 271570a_203496583355_100011219512 [2,0,0,0,0,0|2,0,0]=4 1728 B9R1.3 Oc1c(cccc1Cl)Cl 271570a_203496583355_100000034237 [2,0,0,0,0,0|2,0,0]=4 1729 B9R1.3 Oc1c(cccc1Cl)F 271570a_203496583355_100000050007 [2,0,0,0,0,0|2,0,0]=4 1730 B9R1.3 Oc1c(cccc1F)F 271570a_203496583355_100000693133 [2,0,0,0,0,0|2,0,0]=4 1731 B9R1.3 Oc1cccc(c1Br)O 271570a_203496583355_100010187914 [2,0,0,0,0,0|1,0,0]=3 1732 B9R1.3 Oc1cccc(c1Cl)Br 271570a_203496583355_100010142854 [2,0,0,0,0,0|2,0,0]=4 1733 B9R1.3 Oc1cccc(c1Cl)Cl 271570a_203496583355_100011215384 [2,0,0,0,0,0|2,0,0]=4 1734 B9R1.3 Oc1cccc(c1Cl)F 271570a_203496583355_200010234923 [2,0,0,0,0,0|2,0,0]=4 1735 B9R1.3 Oc1cccc(c1Cl)O 271570a_203496583355_100000049636 [2,0,0,0,0,0|1,0,0]=3 1736 B9R1.3 Oc1cccc(c1F)Br 271570a_203496583355_100000702267 [2,0,0,0,0,0|2,0,0]=4 1737 B9R1.3 Oc1cccc(c1F)Cl 271570a_203496583355_100011217346 [2,0,0,0,0,0|2,0,0]=4 1738 B9R1.3 Oc1cccc(c1F)F 271570a_203496583355_100000694657 [2,0,0,0,0,0|2,0,0]=4 1739 B9R1.3 Oc1cccc(c1F)O 271570a_203496583355_100009817021 [2,0,0,0,0,0|1,0,0]=3 1740 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010084509 [2,0,0,0,0,0|1,0,0]=3 1741 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010187912 [2,0,0,0,0,0|1,0,0]=3 1742 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100000050174 [2,0,0,0,0,0|1,0,0]=3 1743 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100010202889 [2,0,0,0,0,0|1,0,0]=3 1744 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009813666 [2,0,0,0,0,0|1,0,0]=3 1745 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009820682 [2,0,0,0,0,0|1,0,0]=3 1746 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100009815950 [2,0,0,0,0,0|0,0,0]=2 1747 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100010205330 [2,0,0,0,0,0|0,0,0]=2 1748 B9R1.3 Oc1ccnc(c1F)O 271570a_203496583355_100009876375 [2,0,0,0,0,0|2,0,0]=4 1749 B9R1.3 Oc1ccnc(c1O)O 271570a_203496583355_200009817435 [2,0,0,0,0,0|1,0,0]=3 1750 B9R1.3 Oc1nccc(c1O)F 271570a_203496583355_100009867227 [2,0,0,0,0,0|2,0,0]=4 1751 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,0,0,0,0,0|1,0,1]=4 1752 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [2,0,0,0,0,0|1,0,0]=3 1753 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [2,0,0,0,0,0|2,0,0]=4 1754 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [2,0,0,0,0,0|2,0,0]=4 1755 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [2,0,0,0,0,0|2,0,0]=4 1756 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [2,0,0,0,0,0|2,0,0]=4 1757 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [2,0,0,0,0,0|2,0,0]=4 1758 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [2,0,0,0,0,0|2,0,0]=4 1759 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [2,0,0,0,0,0|2,0,0]=4 1760 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [2,0,0,0,0,0|2,0,0]=4 1761 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [2,0,0,0,0,0|1,0,0]=3 1762 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [2,0,0,0,0,0|1,0,0]=3 1763 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [2,0,0,0,0,0|2,0,0]=4 1764 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [2,0,0,0,0,0|2,0,0]=4 1765 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [2,0,0,0,0,0|2,0,0]=4 1766 B9R1.15 COc1cccc[n+]1[O-] 7a_100000211761_200000210301 [2,0,0,0,0,0|1,0,1]=4 1767 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [2,0,0,0,0,0|1,0,0]=3 1768 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [2,0,0,0,0,0|1,0,0]=3 1769 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [2,0,0,0,0,0|1,0,0]=3 1770 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [2,0,0,0,0,0|1,0,0]=3 1771 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [2,0,0,0,0,0|1,0,0]=3 1772 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [2,0,0,0,0,0|1,0,0]=3 1773 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [2,0,0,0,0,0|1,0,0]=3 1774 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [2,0,0,0,0,0|1,0,0]=3 1775 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [2,0,0,0,0,0|1,0,0]=3 1776 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [2,0,0,0,0,0|1,0,0]=3 1777 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [2,0,0,0,0,0|1,0,0]=3 1778 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [2,0,0,0,0,0|1,0,0]=3 1779 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [2,0,0,0,0,0|0,0,0]=2 1780 B9R1.15 COc1cccnc1Br 34a_100000744436_200000210301 [2,0,0,0,0,0|2,0,0]=4 1781 B9R1.15 COc1cccnc1Br 7a_100000744436_200000210301 [2,0,0,0,0,0|2,0,0]=4 1782 B9R1.15 COc1cccnc1C 34a_100000745507_200000210301 [2,0,0,0,0,0|2,0,0]=4 1783 B9R1.15 COc1cccnc1C 7a_100000745507_200000210301 [2,0,0,0,0,0|2,0,0]=4 1784 B9R1.15 COc1cccnc1Cl 34a_100000757616_200000210301 [2,0,0,0,0,0|2,0,0]=4 1785 B9R1.15 COc1cccnc1Cl 7a_100000757616_200000210301 [2,0,0,0,0,0|2,0,0]=4 1786 B9R1.15 COc1cccnc1F 34a_100000061740_200000210301 [2,0,0,0,0,0|2,0,0]=4 1787 B9R1.15 COc1cccnc1F 7a_100000061740_200000210301 [2,0,0,0,0,0|2,0,0]=4 1788 B9R1.15 COc1cccnc1I 34a_100000034122_200000210301 [2,0,0,0,0,0|2,0,0]=4 1789 B9R1.15 COc1cccnc1I 7a_100000034122_200000210301 [2,0,0,0,0,0|2,0,0]=4 1790 B9R1.15 COc1cccnc1N 34a_100000211975_200000210301 [2,0,0,0,0,0|2,0,0]=4 1791 B9R1.15 COc1cccnc1N 7a_100000211975_200000210301 [2,0,0,0,0,0|2,0,0]=4 1792 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [2,0,0,0,0,0|1,0,0]=3 1793 B9R1.15 COc1cccoc1=O 34a_100000077404_200000210301 [2,0,0,0,0,0|1,0,1]=4 1794 B9R1.15 COc1cccoc1=O 7a_100000077404_200000210301 [2,0,0,0,0,0|1,0,1]=4 1795 B9R1.15 COc1ccncc1Br 34a_100011996408_200000210301 [2,0,0,0,0,0|2,0,0]=4 1796 B9R1.15 COc1ccncc1C 34a_100000694293_200000210301 [2,0,0,0,0,0|2,0,0]=4 1797 B9R1.15 COc1ccncc1Cl 34a_100011997054_200000210301 [2,0,0,0,0,0|2,0,0]=4 1798 B9R1.15 COc1ccncc1F 34a_200000081243_200000210301 [2,0,0,0,0,0|2,0,0]=4 1799 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [2,0,0,0,0,0|1,0,0]=3 1800 B9R1.15 COc1cnccc1C 34a_100011997053_200000210301 [2,0,0,0,0,0|2,0,0]=4 1801 B9R1.15 COc1cnccc1C 7a_100011997053_200000210301 [2,0,0,0,0,0|2,0,0]=4 1802 B9R1.15 COc1cnccc1Cl 34a_100011996695_200000210301 [2,0,0,0,0,0|2,0,0]=4 1803 B9R1.15 COc1cnccc1I 34a_100000050107_200000210301 [2,0,0,0,0,0|2,0,0]=4 1804 B9R1.15 COc1cnccc1N 34a_100000753702_200000210301 [2,0,0,0,0,0|2,0,0]=4 1805 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [2,0,0,0,0,0|1,0,0]=3 1806 B9R1.15 COc1cncnc1O 271570a_203496583355_100012001275 [2,0,0,0,0,0|2,0,0]=4 1807 B9R1.15 COc1coccc1=O 34a_100000060831_200000210301 [2,0,0,0,0,0|1,0,1]=4 1808 B9R1.15 COc1ncccc1Cl 34a_100011290957_200000210301 [2,0,0,0,0,0|2,0,0]=4 1809 B9R1.15 COc1ncccc1F 34a_100011219419_200000210301 [2,0,0,0,0,0|2,0,0]=4 1810 B9R1.15 COc1ncccc1N 34a_100000746358_200000210301 [2,0,0,0,0,0|2,0,0]=4 1811 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [2,0,0,0,0,0|1,0,0]=3 1812 B9R1.15 COc1nccnc1O 271570a_203496583355_100000749998 [2,0,0,0,0,0|2,0,0]=4 1813 B9R1.15 COc1ncncc1O 271570a_203496583355_100000719902 [2,0,0,0,0,0|2,0,0]=4 1814 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [2,0,0,0,0,0|1,1,0]=4 1815 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [2,0,0,0,0,0|1,1,0]=4 1816 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [2,0,0,0,0,0|1,1,0]=4 1817 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [2,0,0,0,0,0|1,1,0]=4 1818 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [2,0,0,0,0,0|1,1,0]=4 1819 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [2,0,0,0,0,0|1,1,0]=4 1820 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [2,0,0,0,0,0|1,1,0]=4 1821 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [2,0,0,0,0,0|1,1,0]=4 1822 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [2,0,0,0,0,0|1,1,0]=4 1823 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [2,0,0,0,0,0|1,1,0]=4 1824 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [2,0,0,0,0,0|0,1,0]=3 1825 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [2,0,0,0,0,0|0,1,0]=3 1826 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [2,0,0,0,0,0|0,1,0]=3 1827 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [2,0,0,0,0,0|1,1,0]=4 1828 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [2,0,0,0,0,0|1,1,0]=4 1829 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [2,0,0,0,0,0|1,1,0]=4 1830 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [2,0,0,0,0,0|1,1,0]=4 1831 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [2,0,0,0,0,0|1,1,0]=4 1832 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [2,0,0,0,0,0|1,1,0]=4 1833 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [2,0,0,0,0,0|1,1,0]=4 1834 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [2,0,0,0,0,0|2,0,0]=4 1835 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [2,0,0,0,0,0|1,0,0]=3 1836 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [2,0,0,0,0,0|1,0,0]=3 1837 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [2,0,0,0,0,0|1,1,0]=4 1838 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [2,0,0,0,0,0|1,1,0]=4 1839 B9R1.15 Cc1ccncc1O[13CH3] 34a_100011997053_200025704644 [2,0,0,0,0,0|2,0,0]=4 1840 B9R1.15 Cc1ccncc1O[13CH3] 7a_100011997053_200025704644 [2,0,0,0,0,0|2,0,0]=4 1841 B9R1.15 Cc1cnccc1O[13CH3] 34a_100000694293_200025704644 [2,0,0,0,0,0|2,0,0]=4 1842 B9R1.15 Cc1ncccc1O[13CH3] 34a_100000745507_200025704644 [2,0,0,0,0,0|2,0,0]=4 1843 B9R1.15 Cc1ncccc1O[13CH3] 7a_100000745507_200025704644 [2,0,0,0,0,0|2,0,0]=4 1844 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [2,0,0,0,0,0|2,0,0]=4 1845 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [2,0,0,0,0,0|2,0,0]=4 1846 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [2,0,0,0,0,0|2,0,0]=4 1847 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,0,0,0,0,0|2,0,0]=4 1848 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [2,0,0,0,0,0|2,0,0]=4 1849 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [2,0,0,0,0,0|2,0,0]=4 1850 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [2,0,0,0,0,0|2,0,0]=4 1851 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [2,0,0,0,0,0|2,0,0]=4 1852 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [2,0,0,0,0,0|2,0,0]=4 1853 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [2,0,0,0,0,0|1,0,0]=3 1854 B9R1.15 [13CH3]Oc1cccc[n+]1[O-] 7a_100000211761_200025704644 [2,0,0,0,0,0|1,0,1]=4 1855 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [2,0,0,0,0,0|1,0,0]=3 1856 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [2,0,0,0,0,0|1,0,0]=3 1857 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [2,0,0,0,0,0|1,0,0]=3 1858 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [2,0,0,0,0,0|1,0,0]=3 1859 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [2,0,0,0,0,0|1,0,0]=3 1860 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [2,0,0,0,0,0|1,0,0]=3 1861 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [2,0,0,0,0,0|1,0,0]=3 1862 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [2,0,0,0,0,0|1,0,0]=3 1863 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [2,0,0,0,0,0|1,0,0]=3 1864 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [2,0,0,0,0,0|1,0,0]=3 1865 B9R1.15 [13CH3]Oc1cccnc1Br 34a_100000744436_200025704644 [2,0,0,0,0,0|2,0,0]=4 1866 B9R1.15 [13CH3]Oc1cccnc1Br 7a_100000744436_200025704644 [2,0,0,0,0,0|2,0,0]=4 1867 B9R1.15 [13CH3]Oc1cccnc1Cl 34a_100000757616_200025704644 [2,0,0,0,0,0|2,0,0]=4 1868 B9R1.15 [13CH3]Oc1cccnc1Cl 7a_100000757616_200025704644 [2,0,0,0,0,0|2,0,0]=4 1869 B9R1.15 [13CH3]Oc1cccnc1F 34a_100000061740_200025704644 [2,0,0,0,0,0|2,0,0]=4 1870 B9R1.15 [13CH3]Oc1cccnc1F 7a_100000061740_200025704644 [2,0,0,0,0,0|2,0,0]=4 1871 B9R1.15 [13CH3]Oc1cccnc1I 34a_100000034122_200025704644 [2,0,0,0,0,0|2,0,0]=4 1872 B9R1.15 [13CH3]Oc1cccnc1I 7a_100000034122_200025704644 [2,0,0,0,0,0|2,0,0]=4 1873 B9R1.15 [13CH3]Oc1cccnc1N 34a_100000211975_200025704644 [2,0,0,0,0,0|2,0,0]=4 1874 B9R1.15 [13CH3]Oc1cccnc1N 7a_100000211975_200025704644 [2,0,0,0,0,0|2,0,0]=4 1875 B9R1.15 [13CH3]Oc1cccoc1=O 34a_100000077404_200025704644 [2,0,0,0,0,0|1,0,1]=4 1876 B9R1.15 [13CH3]Oc1cccoc1=O 7a_100000077404_200025704644 [2,0,0,0,0,0|1,0,1]=4 1877 B9R1.15 [13CH3]Oc1ccncc1Br 34a_100011996408_200025704644 [2,0,0,0,0,0|2,0,0]=4 1878 B9R1.15 [13CH3]Oc1ccncc1Cl 34a_100011997054_200025704644 [2,0,0,0,0,0|2,0,0]=4 1879 B9R1.15 [13CH3]Oc1ccncc1F 34a_200000081243_200025704644 [2,0,0,0,0,0|2,0,0]=4 1880 B9R1.15 [13CH3]Oc1cnccc1Cl 34a_100011996695_200025704644 [2,0,0,0,0,0|2,0,0]=4 1881 B9R1.15 [13CH3]Oc1cnccc1I 34a_100000050107_200025704644 [2,0,0,0,0,0|2,0,0]=4 1882 B9R1.15 [13CH3]Oc1cnccc1N 34a_100000753702_200025704644 [2,0,0,0,0,0|2,0,0]=4 1883 B9R1.15 [13CH3]Oc1coccc1=O 34a_100000060831_200025704644 [2,0,0,0,0,0|1,0,1]=4 1884 B9R1.15 [13CH3]Oc1ncccc1Cl 34a_100011290957_200025704644 [2,0,0,0,0,0|2,0,0]=4 1885 B9R1.15 [13CH3]Oc1ncccc1F 34a_100011219419_200025704644 [2,0,0,0,0,0|2,0,0]=4 1886 B9R1.15 [13CH3]Oc1ncccc1N 34a_100000746358_200025704644 [2,0,0,0,0,0|2,0,0]=4 1887 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [2,0,0,0,0,0|1,1,0]=4 1888 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [2,0,0,0,0,0|1,1,0]=4 1889 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [2,0,0,0,0,0|1,1,0]=4 1890 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [2,0,0,0,0,0|1,1,0]=4 1891 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [2,0,0,0,0,0|1,1,0]=4 1892 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [2,0,0,0,0,0|1,1,0]=4 1893 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [2,0,0,0,0,0|1,1,0]=4 1894 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [2,0,0,0,0,0|1,1,0]=4 1895 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [2,0,0,0,0,0|0,1,0]=3 1896 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [2,0,0,0,0,0|0,1,0]=3 1897 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [2,0,0,0,0,0|1,1,0]=4 1898 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [2,0,0,0,0,0|1,1,0]=4 1899 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [2,0,0,0,0,0|1,1,0]=4 1900 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [2,0,0,0,0,0|1,1,0]=4 1901 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [2,0,0,0,0,0|1,1,0]=4 1902 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [2,0,0,0,0,0|1,1,0]=4 1903 B11R1.8 C=Cc1cc(cc(c1O)C)C 271570a_100011290941_100011934984 [1,1,0,0,0,0|1,0,1]=4 1904 B11R1.8 C=Cc1cc(cc(c1O)C)Cl 271570a_100011290941_100012343667 [1,1,0,0,0,0|1,0,1]=4 1905 B11R1.8 C=Cc1cc(cc(c1O)C)N 271570a_100011290941_100010064301 [1,1,0,0,0,0|1,0,1]=4 1906 B11R1.8 CCc1cc(cc(c1N)C)O 271570a_203496583355_200000186424 [1,1,0,0,0,0|2,0,0]=4 1907 B11R1.8 CCc1cc(cc(c1O)C)O 271570a_203496583355_100010659108 [1,1,0,0,0,0|1,0,0]=3 1908 B11R1.8 CNc1cc(cc(c1C)C)C 2230a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 1909 B11R1.8 CNc1cc(cc(c1C)C)C 34a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 1910 B11R1.8 CNc1cc(cc(c1C)C)C 7a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 1911 B11R1.8 CNc1cc(cc(c1F)C)Br 34a_100010381932_200000210301 [1,1,0,0,0,0|2,0,0]=4 1912 B11R1.8 CNc1cc(cc(c1F)C)Br 7a_100010381932_200000210301 [1,1,0,0,0,0|2,0,0]=4 1913 B11R1.8 CNc1cc(cc(c1I)C)Cl 34a_100000698757_200000210301 [1,1,0,0,0,0|2,0,0]=4 1914 B11R1.8 CNc1cc(cc(c1I)C)Cl 7a_100000698757_200000210301 [1,1,0,0,0,0|2,0,0]=4 1915 B11R1.8 CNc1cc(cc(c1N)O)F 271570a_203496583355_200102954750 [1,1,0,0,0,0|2,0,0]=4 1916 B11R1.8 CNc1cc(cc(c1O)Br)Br 34a_100010781877_200000210301 [1,1,0,0,0,0|2,0,0]=4 1917 B11R1.8 CNc1cc(cc(c1O)Br)Cl 34a_106741647128_200000210301 [1,1,0,0,0,0|2,0,0]=4 1918 B11R1.8 CNc1cc(cc(c1O)Br)F 34a_200011217456_200000210301 [1,1,0,0,0,0|2,0,0]=4 1919 B11R1.8 CNc1cc(cc(c1O)C)Br 34a_100011825904_200000210301 [1,1,0,0,0,0|1,0,0]=3 1920 B11R1.8 CNc1cc(cc(c1O)C)Br 7a_100011825904_200000210301 [1,1,0,0,0,0|1,0,0]=3 1921 B11R1.8 CNc1cc(cc(c1O)C)C 34a_100011216242_200000210301 [1,1,0,0,0,0|1,0,0]=3 1922 B11R1.8 CNc1cc(cc(c1O)C)C 7a_100011216242_200000210301 [1,1,0,0,0,0|1,0,0]=3 1923 B11R1.8 CNc1cc(cc(c1O)C)F 34a_100000130126_200000210301 [1,1,0,0,0,0|1,0,0]=3 1924 B11R1.8 CNc1cc(cc(c1O)C)F 7a_100000130126_200000210301 [1,1,0,0,0,0|1,0,0]=3 1925 B11R1.8 CNc1cc(cc(c1O)Cl)Br 34a_100000694353_200000210301 [1,1,0,0,0,0|2,0,0]=4 1926 B11R1.8 CNc1cc(cc(c1O)Cl)Cl 34a_100000695819_200000210301 [1,1,0,0,0,0|2,0,0]=4 1927 B11R1.8 CNc1cc(cc(c1O)F)Br 34a_100011217383_200000210301 [1,1,0,0,0,0|2,0,0]=4 1928 B11R1.8 CNc1cc(cc(c1O)F)Br 7a_100011217383_200000210301 [1,1,0,0,0,0|2,0,0]=4 1929 B11R1.8 CNc1cc(cc(c1O)F)F 34a_100015205836_200000210301 [1,1,0,0,0,0|2,0,0]=4 1930 B11R1.8 COc1cc(=O)[nH]c(c1C)C 34a_200000102741_200000210301 [1,1,0,0,0,0|2,0,0]=4 1931 B11R1.8 COc1cc(=O)[nH]c(c1C)C 7a_200000102741_200000210301 [1,1,0,0,0,0|2,0,0]=4 1932 B11R1.8 COc1cc(cc(c1Br)C)C 34a_100010342985_200000210301 [1,1,0,0,0,0|1,0,0]=3 1933 B11R1.8 COc1cc(cc(c1Br)C)C 7a_100010342985_200000210301 [1,1,0,0,0,0|1,0,0]=3 1934 B11R1.8 COc1cc(cc(c1Br)F)Cl 34a_100015539415_200000210301 [1,1,0,0,0,0|2,0,0]=4 1935 B11R1.8 COc1cc(cc(c1Br)F)Cl 7a_100015539415_200000210301 [1,1,0,0,0,0|2,0,0]=4 1936 B11R1.8 COc1cc(cc(c1Br)F)F 34a_100009815984_200000210301 [1,1,0,0,0,0|2,0,0]=4 1937 B11R1.8 COc1cc(cc(c1Br)F)F 7a_100009815984_200000210301 [1,1,0,0,0,0|2,0,0]=4 1938 B11R1.8 COc1cc(cc(c1C)C)C 34a_100000230004_200000210301 [1,1,0,0,0,0|1,0,0]=3 1939 B11R1.8 COc1cc(cc(c1C)C)C 7a_100000230004_200000210301 [1,1,0,0,0,0|1,0,0]=3 1940 B11R1.8 COc1cc(cc(c1Cl)C)C 34a_100000094344_200000210301 [1,1,0,0,0,0|1,0,0]=3 1941 B11R1.8 COc1cc(cc(c1Cl)C)C 7a_100000094344_200000210301 [1,1,0,0,0,0|1,0,0]=3 1942 B11R1.8 COc1cc(cc(c1Cl)Cl)N 34a_100015839415_200000210301 [1,1,0,0,0,0|2,0,0]=4 1943 B11R1.8 COc1cc(cc(c1Cl)Cl)N 7a_100015839415_200000210301 [1,1,0,0,0,0|2,0,0]=4 1944 B11R1.8 COc1cc(cc(c1Cl)F)Br 34a_100010981968_200000210301 [1,1,0,0,0,0|2,0,0]=4 1945 B11R1.8 COc1cc(cc(c1Cl)F)Br 7a_100010981968_200000210301 [1,1,0,0,0,0|2,0,0]=4 1946 B11R1.8 COc1cc(cc(c1Cl)F)F 34a_200000037661_200000210301 [1,1,0,0,0,0|2,0,0]=4 1947 B11R1.8 COc1cc(cc(c1Cl)F)F 7a_200000037661_200000210301 [1,1,0,0,0,0|2,0,0]=4 1948 B11R1.8 COc1cc(cc(c1F)C)O 271570a_203496583355_100010271686 [1,1,0,0,0,0|1,0,0]=3 1949 B11R1.8 COc1cc(cc(c1F)Cl)Br 34a_100010077842_200000210301 [1,1,0,0,0,0|2,0,0]=4 1950 B11R1.8 COc1cc(cc(c1F)Cl)Br 7a_100010077842_200000210301 [1,1,0,0,0,0|2,0,0]=4 1951 B11R1.8 COc1cc(cc(c1F)F)Br 34a_100000709865_200000210301 [1,1,0,0,0,0|2,0,0]=4 1952 B11R1.8 COc1cc(cc(c1F)F)Br 7a_100000709865_200000210301 [1,1,0,0,0,0|2,0,0]=4 1953 B11R1.8 COc1cc(cc(c1F)F)F 34a_200011215507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1954 B11R1.8 COc1cc(cc(c1F)F)F 7a_200011215507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1955 B11R1.8 COc1cc(cc(c1F)F)O 271570a_203496583355_100011218012 [1,1,0,0,0,0|2,0,0]=4 1956 B11R1.8 COc1cc(cc(c1F)O)O 271570a_203496583355_200015524394 [1,1,0,0,0,0|1,0,0]=3 1957 B11R1.8 COc1cc(cc(c1I)C)Cl 34a_100010254216_200000210301 [1,1,0,0,0,0|1,0,0]=3 1958 B11R1.8 COc1cc(cc(c1I)C)Cl 7a_100010254216_200000210301 [1,1,0,0,0,0|1,0,0]=3 1959 B11R1.8 COc1cc(cc(c1N)Br)Cl 34a_100015696055_200000210301 [1,1,0,0,0,0|2,0,0]=4 1960 B11R1.8 COc1cc(cc(c1N)Br)Cl 7a_100015696055_200000210301 [1,1,0,0,0,0|2,0,0]=4 1961 B11R1.8 COc1cc(cc(c1N)C)Br 34a_100010371313_200000210301 [1,1,0,0,0,0|1,0,0]=3 1962 B11R1.8 COc1cc(cc(c1N)C)Br 7a_100010371313_200000210301 [1,1,0,0,0,0|1,0,0]=3 1963 B11R1.8 COc1cc(cc(c1N)C)O 271570a_203496583355_100000741850 [1,1,0,0,0,0|1,0,0]=3 1964 B11R1.8 COc1cc(cc(c1N)Cl)C 34a_100015906060_200000210301 [1,1,0,0,0,0|2,0,0]=4 1965 B11R1.8 COc1cc(cc(c1N)Cl)C 7a_100015906060_200000210301 [1,1,0,0,0,0|2,0,0]=4 1966 B11R1.8 COc1cc(cc(c1N)F)Br 34a_100015475841_200000210301 [1,1,0,0,0,0|2,0,0]=4 1967 B11R1.8 COc1cc(cc(c1N)F)Br 7a_100015475841_200000210301 [1,1,0,0,0,0|2,0,0]=4 1968 B11R1.8 COc1cc(cc(c1N)F)Cl 34a_100010883250_200000210301 [1,1,0,0,0,0|2,0,0]=4 1969 B11R1.8 COc1cc(cc(c1N)F)Cl 7a_100010883250_200000210301 [1,1,0,0,0,0|2,0,0]=4 1970 B11R1.8 COc1cc(cc(c1N)F)F 34a_100011217947_200000210301 [1,1,0,0,0,0|2,0,0]=4 1971 B11R1.8 COc1cc(cc(c1N)F)F 7a_100011217947_200000210301 [1,1,0,0,0,0|2,0,0]=4 1972 B11R1.8 COc1cc(cc(c1N)O)F 271570a_203496583355_100011004115 [1,1,0,0,0,0|1,0,0]=3 1973 B11R1.8 COc1cc(cc(c1O)Br)Cl 271570a_203496583355_100025705407 [1,1,0,0,0,0|1,0,0]=3 1974 B11R1.8 COc1cc(cc(c1O)Cl)Cl 271570a_203496583355_100010292537 [1,1,0,0,0,0|1,0,0]=3 1975 B11R1.8 COc1cc(cc(c1O)F)Br 271570a_203496583355_100010713143 [1,1,0,0,0,0|1,0,0]=3 1976 B11R1.8 COc1cc(cc(c1O)O)F 271570a_203496583355_200010391102 [1,1,0,0,0,0|0,0,0]=2 1977 B11R1.8 COc1nc(nc(c1O)C)N 271570a_203496583355_200011180307 [1,1,0,0,0,0|2,0,0]=4 1978 B11R1.8 CSc1cc(cc(c1C)C)N 62a_100010368239_200000210301 [1,1,0,0,0,0|1,1,0]=4 1979 B11R1.8 CSc1cc(cc(c1C)C)N 62a_200000210301_100010368239 [1,1,0,0,0,0|1,1,0]=4 1980 B11R1.8 CSc1cc(cc(c1C)C)O 62a_100010068915_200000210301 [1,1,0,0,0,0|1,1,0]=4 1981 B11R1.8 CSc1cc(cc(c1C)C)O 62a_200000210301_100010068915 [1,1,0,0,0,0|1,1,0]=4 1982 B11R1.8 CSc1cc(cc(c1F)C)C 62a_200000210301_200010204574 [1,1,0,0,0,0|1,1,0]=4 1983 B11R1.8 CSc1cc(cc(c1F)C)C 62a_200010204574_200000210301 [1,1,0,0,0,0|1,1,0]=4 1984 B11R1.8 CSc1cc(cc(c1F)C)F 62a_100010291795_200000210301 [1,1,0,0,0,0|1,1,0]=4 1985 B11R1.8 CSc1cc(cc(c1F)C)F 62a_200000210301_100010291795 [1,1,0,0,0,0|1,1,0]=4 1986 B11R1.8 CSc1cc(cc(c1N)C)Br 62a_200000210301_200000690823 [1,1,0,0,0,0|1,1,0]=4 1987 B11R1.8 CSc1cc(cc(c1N)C)Br 62a_200000690823_200000210301 [1,1,0,0,0,0|1,1,0]=4 1988 B11R1.8 CSc1cc(cc(c1N)C)C 62a_100000688863_200000210301 [1,1,0,0,0,0|1,1,0]=4 1989 B11R1.8 CSc1cc(cc(c1N)C)C 62a_200000210301_100000688863 [1,1,0,0,0,0|1,1,0]=4 1990 B11R1.8 CSc1cc(cc(c1N)C)Cl 62a_100012344046_200000210301 [1,1,0,0,0,0|1,1,0]=4 1991 B11R1.8 CSc1cc(cc(c1N)C)Cl 62a_200000210301_100012344046 [1,1,0,0,0,0|1,1,0]=4 1992 B11R1.8 CSc1cc(cc(c1N)C)F 62a_100011216670_200000210301 [1,1,0,0,0,0|1,1,0]=4 1993 B11R1.8 CSc1cc(cc(c1N)C)F 62a_200000210301_100011216670 [1,1,0,0,0,0|1,1,0]=4 1994 B11R1.8 CSc1cc(cc(c1O)Br)F 62a_200000210301_200013085147 [1,1,0,0,0,0|1,1,0]=4 1995 B11R1.8 CSc1cc(cc(c1O)Br)F 62a_200013085147_200000210301 [1,1,0,0,0,0|1,1,0]=4 1996 B11R1.8 CSc1cc(cc(c1O)C)C 62a_100011934984_200000210301 [1,1,0,0,0,0|0,1,0]=3 1997 B11R1.8 CSc1cc(cc(c1O)C)C 62a_200000210301_100011934984 [1,1,0,0,0,0|0,1,0]=3 1998 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_100012343667_200000210301 [1,1,0,0,0,0|0,1,0]=3 1999 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_200000210301_100012343667 [1,1,0,0,0,0|0,1,0]=3 2000 B11R1.8 CSc1cc(cc(c1O)C)N 62a_100010064301_200000210301 [1,1,0,0,0,0|0,1,0]=3 2001 B11R1.8 CSc1cc(cc(c1O)C)N 62a_200000210301_100010064301 [1,1,0,0,0,0|0,1,0]=3 2002 B11R1.8 CSc1cc(cc(c1O)Cl)Cl 62a_200000210301_200012339341 [1,1,0,0,0,0|1,1,0]=4 2003 B11R1.8 CSc1cc(cc(c1O)Cl)Cl 62a_200012339341_200000210301 [1,1,0,0,0,0|1,1,0]=4 2004 B11R1.8 CSc1cc(cc(c1O)F)Br 62a_100013354677_200000210301 [1,1,0,0,0,0|1,1,0]=4 2005 B11R1.8 CSc1cc(cc(c1O)F)Br 62a_200000210301_100013354677 [1,1,0,0,0,0|1,1,0]=4 2006 B11R1.8 CSc1cc(cc(c1O)F)C 62a_200000210301_200135191068 [1,1,0,0,0,0|1,1,0]=4 2007 B11R1.8 CSc1cc(cc(c1O)F)C 62a_200135191068_200000210301 [1,1,0,0,0,0|1,1,0]=4 2008 B11R1.8 CSc1cc(cc(c1O)F)F 62a_100000688693_200000210301 [1,1,0,0,0,0|1,1,0]=4 2009 B11R1.8 CSc1cc(cc(c1O)F)F 62a_200000210301_100000688693 [1,1,0,0,0,0|1,1,0]=4 2010 B11R1.8 CSc1cc(cc(c1O)N)Br 62a_100016071998_200000210301 [1,1,0,0,0,0|1,1,0]=4 2011 B11R1.8 CSc1cc(cc(c1O)N)Br 62a_200000210301_100016071998 [1,1,0,0,0,0|1,1,0]=4 2012 B11R1.8 CSc1cc(cc(c1O)N)F 62a_200000210301_200011217456 [1,1,0,0,0,0|1,1,0]=4 2013 B11R1.8 CSc1cc(cc(c1O)N)F 62a_200011217456_200000210301 [1,1,0,0,0,0|1,1,0]=4 2014 B11R1.8 Cc1[nH]c(=O)cc(c1C)O[13CH3] 34a_200000102741_200025704644 [1,1,0,0,0,0|2,0,0]=4 2015 B11R1.8 Cc1[nH]c(=O)cc(c1C)O[13CH3] 7a_200000102741_200025704644 [1,1,0,0,0,0|2,0,0]=4 2016 B11R1.8 Cc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000698970 [1,1,0,0,0,0|2,0,0]=4 2017 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 2230a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2018 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 34a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2019 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 7a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2020 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 34a_100011216242_200025704644 [1,1,0,0,0,0|1,0,0]=3 2021 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 7a_100011216242_200025704644 [1,1,0,0,0,0|1,0,0]=3 2022 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Br)C 34a_100010342985_200025704644 [1,1,0,0,0,0|1,0,0]=3 2023 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Br)C 7a_100010342985_200025704644 [1,1,0,0,0,0|1,0,0]=3 2024 B11R1.8 Cc1cc(c(c(c1)O[13CH3])C)C 34a_100000230004_200025704644 [1,1,0,0,0,0|1,0,0]=3 2025 B11R1.8 Cc1cc(c(c(c1)O[13CH3])C)C 7a_100000230004_200025704644 [1,1,0,0,0,0|1,0,0]=3 2026 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Cl)C 34a_100000094344_200025704644 [1,1,0,0,0,0|1,0,0]=3 2027 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Cl)C 7a_100000094344_200025704644 [1,1,0,0,0,0|1,0,0]=3 2028 B11R1.8 Cc1cc(c(c(c1)O[13CH3])N)Cl 34a_100015906060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2029 B11R1.8 Cc1cc(c(c(c1)O[13CH3])N)Cl 7a_100015906060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2030 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)C 62a_200010204574_200025704644 [1,1,0,0,0,0|1,1,0]=4 2031 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)C 62a_200025704644_200010204574 [1,1,0,0,0,0|1,1,0]=4 2032 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)C 62a_100000688863_200025704644 [1,1,0,0,0,0|1,1,0]=4 2033 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)C 62a_200025704644_100000688863 [1,1,0,0,0,0|1,1,0]=4 2034 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_100011934984_200025704644 [1,1,0,0,0,0|0,1,0]=3 2035 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_200025704644_100011934984 [1,1,0,0,0,0|0,1,0]=3 2036 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)F 62a_200025704644_200135191068 [1,1,0,0,0,0|1,1,0]=4 2037 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)F 62a_200135191068_200025704644 [1,1,0,0,0,0|1,1,0]=4 2038 B11R1.8 Cc1cc(cc(c1C)S[13CH3])N 62a_100010368239_200025704644 [1,1,0,0,0,0|1,1,0]=4 2039 B11R1.8 Cc1cc(cc(c1C)S[13CH3])N 62a_200025704644_100010368239 [1,1,0,0,0,0|1,1,0]=4 2040 B11R1.8 Cc1cc(cc(c1C)S[13CH3])O 62a_100010068915_200025704644 [1,1,0,0,0,0|1,1,0]=4 2041 B11R1.8 Cc1cc(cc(c1C)S[13CH3])O 62a_200025704644_100010068915 [1,1,0,0,0,0|1,1,0]=4 2042 B11R1.8 Cc1cc(cc(c1F)N[13CH3])Br 34a_100010381932_200025704644 [1,1,0,0,0,0|2,0,0]=4 2043 B11R1.8 Cc1cc(cc(c1F)N[13CH3])Br 7a_100010381932_200025704644 [1,1,0,0,0,0|2,0,0]=4 2044 B11R1.8 Cc1cc(cc(c1F)S[13CH3])F 62a_100010291795_200025704644 [1,1,0,0,0,0|1,1,0]=4 2045 B11R1.8 Cc1cc(cc(c1F)S[13CH3])F 62a_200025704644_100010291795 [1,1,0,0,0,0|1,1,0]=4 2046 B11R1.8 Cc1cc(cc(c1I)N[13CH3])Cl 34a_100000698757_200025704644 [1,1,0,0,0,0|2,0,0]=4 2047 B11R1.8 Cc1cc(cc(c1I)N[13CH3])Cl 7a_100000698757_200025704644 [1,1,0,0,0,0|2,0,0]=4 2048 B11R1.8 Cc1cc(cc(c1I)O[13CH3])Cl 34a_100010254216_200025704644 [1,1,0,0,0,0|1,0,0]=3 2049 B11R1.8 Cc1cc(cc(c1I)O[13CH3])Cl 7a_100010254216_200025704644 [1,1,0,0,0,0|1,0,0]=3 2050 B11R1.8 Cc1cc(cc(c1N)O[13CH3])Br 34a_100010371313_200025704644 [1,1,0,0,0,0|1,0,0]=3 2051 B11R1.8 Cc1cc(cc(c1N)O[13CH3])Br 7a_100010371313_200025704644 [1,1,0,0,0,0|1,0,0]=3 2052 B11R1.8 Cc1cc(cc(c1N)S[13CH3])Br 62a_200000690823_200025704644 [1,1,0,0,0,0|1,1,0]=4 2053 B11R1.8 Cc1cc(cc(c1N)S[13CH3])Br 62a_200025704644_200000690823 [1,1,0,0,0,0|1,1,0]=4 2054 B11R1.8 Cc1cc(cc(c1N)S[13CH3])Cl 62a_100012344046_200025704644 [1,1,0,0,0,0|1,1,0]=4 2055 B11R1.8 Cc1cc(cc(c1N)S[13CH3])Cl 62a_200025704644_100012344046 [1,1,0,0,0,0|1,1,0]=4 2056 B11R1.8 Cc1cc(cc(c1N)S[13CH3])F 62a_100011216670_200025704644 [1,1,0,0,0,0|1,1,0]=4 2057 B11R1.8 Cc1cc(cc(c1N)S[13CH3])F 62a_200025704644_100011216670 [1,1,0,0,0,0|1,1,0]=4 2058 B11R1.8 Cc1cc(cc(c1O)C#N)O 271570a_203496583355_100010195408 [1,1,0,0,0,0|2,0,0]=4 2059 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 34a_100011825904_200025704644 [1,1,0,0,0,0|1,0,0]=3 2060 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 7a_100011825904_200025704644 [1,1,0,0,0,0|1,0,0]=3 2061 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 34a_100000130126_200025704644 [1,1,0,0,0,0|1,0,0]=3 2062 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 7a_100000130126_200025704644 [1,1,0,0,0,0|1,0,0]=3 2063 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_100012343667_200025704644 [1,1,0,0,0,0|0,1,0]=3 2064 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_200025704644_100012343667 [1,1,0,0,0,0|0,1,0]=3 2065 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_100010064301_200025704644 [1,1,0,0,0,0|0,1,0]=3 2066 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_200025704644_100010064301 [1,1,0,0,0,0|0,1,0]=3 2067 B11R1.8 N#Cc1cc(cc(c1O)O)F 271570a_203496583355_100010674538 [1,1,0,0,0,0|2,0,0]=4 2068 B11R1.8 O=Cc1cc(cc(c1O)O)F 271570a_203496583355_100011659637 [1,1,0,0,0,0|2,0,0]=4 2069 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)Br 34a_100010781877_200025704644 [1,1,0,0,0,0|2,0,0]=4 2070 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)Cl 34a_106741647128_200025704644 [1,1,0,0,0,0|2,0,0]=4 2071 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)F 34a_200011217456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2072 B11R1.8 [13CH3]Nc1cc(cc(c1O)Cl)Br 34a_100000694353_200025704644 [1,1,0,0,0,0|2,0,0]=4 2073 B11R1.8 [13CH3]Nc1cc(cc(c1O)Cl)Cl 34a_100000695819_200025704644 [1,1,0,0,0,0|2,0,0]=4 2074 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)Br 34a_100011217383_200025704644 [1,1,0,0,0,0|2,0,0]=4 2075 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)Br 7a_100011217383_200025704644 [1,1,0,0,0,0|2,0,0]=4 2076 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)F 34a_100015205836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2077 B11R1.8 [13CH3]Oc1cc(cc(c1Br)F)Cl 34a_100015539415_200025704644 [1,1,0,0,0,0|2,0,0]=4 2078 B11R1.8 [13CH3]Oc1cc(cc(c1Br)F)Cl 7a_100015539415_200025704644 [1,1,0,0,0,0|2,0,0]=4 2079 B11R1.8 [13CH3]Oc1cc(cc(c1Br)F)F 34a_100009815984_200025704644 [1,1,0,0,0,0|2,0,0]=4 2080 B11R1.8 [13CH3]Oc1cc(cc(c1Br)F)F 7a_100009815984_200025704644 [1,1,0,0,0,0|2,0,0]=4 2081 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)Cl)N 34a_100015839415_200025704644 [1,1,0,0,0,0|2,0,0]=4 2082 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)Cl)N 7a_100015839415_200025704644 [1,1,0,0,0,0|2,0,0]=4 2083 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)F)Br 34a_100010981968_200025704644 [1,1,0,0,0,0|2,0,0]=4 2084 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)F)Br 7a_100010981968_200025704644 [1,1,0,0,0,0|2,0,0]=4 2085 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)F)F 34a_200000037661_200025704644 [1,1,0,0,0,0|2,0,0]=4 2086 B11R1.8 [13CH3]Oc1cc(cc(c1Cl)F)F 7a_200000037661_200025704644 [1,1,0,0,0,0|2,0,0]=4 2087 B11R1.8 [13CH3]Oc1cc(cc(c1F)Cl)Br 34a_100010077842_200025704644 [1,1,0,0,0,0|2,0,0]=4 2088 B11R1.8 [13CH3]Oc1cc(cc(c1F)Cl)Br 7a_100010077842_200025704644 [1,1,0,0,0,0|2,0,0]=4 2089 B11R1.8 [13CH3]Oc1cc(cc(c1F)F)Br 34a_100000709865_200025704644 [1,1,0,0,0,0|2,0,0]=4 2090 B11R1.8 [13CH3]Oc1cc(cc(c1F)F)Br 7a_100000709865_200025704644 [1,1,0,0,0,0|2,0,0]=4 2091 B11R1.8 [13CH3]Oc1cc(cc(c1F)F)F 34a_200011215507_200025704644 [1,1,0,0,0,0|2,0,0]=4 2092 B11R1.8 [13CH3]Oc1cc(cc(c1F)F)F 7a_200011215507_200025704644 [1,1,0,0,0,0|2,0,0]=4 2093 B11R1.8 [13CH3]Oc1cc(cc(c1N)Br)Cl 34a_100015696055_200025704644 [1,1,0,0,0,0|2,0,0]=4 2094 B11R1.8 [13CH3]Oc1cc(cc(c1N)Br)Cl 7a_100015696055_200025704644 [1,1,0,0,0,0|2,0,0]=4 2095 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)Br 34a_100015475841_200025704644 [1,1,0,0,0,0|2,0,0]=4 2096 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)Br 7a_100015475841_200025704644 [1,1,0,0,0,0|2,0,0]=4 2097 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)Cl 34a_100010883250_200025704644 [1,1,0,0,0,0|2,0,0]=4 2098 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)Cl 7a_100010883250_200025704644 [1,1,0,0,0,0|2,0,0]=4 2099 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)F 34a_100011217947_200025704644 [1,1,0,0,0,0|2,0,0]=4 2100 B11R1.8 [13CH3]Oc1cc(cc(c1N)F)F 7a_100011217947_200025704644 [1,1,0,0,0,0|2,0,0]=4 2101 B11R1.8 [13CH3]Sc1cc(cc(c1O)Br)F 62a_200013085147_200025704644 [1,1,0,0,0,0|1,1,0]=4 2102 B11R1.8 [13CH3]Sc1cc(cc(c1O)Br)F 62a_200025704644_200013085147 [1,1,0,0,0,0|1,1,0]=4 2103 B11R1.8 [13CH3]Sc1cc(cc(c1O)Cl)Cl 62a_200012339341_200025704644 [1,1,0,0,0,0|1,1,0]=4 2104 B11R1.8 [13CH3]Sc1cc(cc(c1O)Cl)Cl 62a_200025704644_200012339341 [1,1,0,0,0,0|1,1,0]=4 2105 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)Br 62a_100013354677_200025704644 [1,1,0,0,0,0|1,1,0]=4 2106 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)Br 62a_200025704644_100013354677 [1,1,0,0,0,0|1,1,0]=4 2107 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)F 62a_100000688693_200025704644 [1,1,0,0,0,0|1,1,0]=4 2108 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)F 62a_200025704644_100000688693 [1,1,0,0,0,0|1,1,0]=4 2109 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)Br 62a_100016071998_200025704644 [1,1,0,0,0,0|1,1,0]=4 2110 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)Br 62a_200025704644_100016071998 [1,1,0,0,0,0|1,1,0]=4 2111 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)F 62a_200011217456_200025704644 [1,1,0,0,0,0|1,1,0]=4 2112 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)F 62a_200025704644_200011217456 [1,1,0,0,0,0|1,1,0]=4 2113 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [1,1,0,0,0,0|1,0,1]=4 2114 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [1,1,0,0,0,0|1,0,1]=4 2115 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,1,0,0,0,0|2,0,0]=4 2116 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [1,1,0,0,0,0|2,0,0]=4 2117 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,1,0,0,0,0|2,0,0]=4 2118 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [1,1,0,0,0,0|2,0,0]=4 2119 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,1,0,0,0,0|2,0,0]=4 2120 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [1,1,0,0,0,0|2,0,0]=4 2121 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,1,0,0,0,0|2,0,0]=4 2122 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [1,1,0,0,0,0|2,0,0]=4 2123 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,1,0,0,0,0|2,0,0]=4 2124 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [1,1,0,0,0,0|2,0,0]=4 2125 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [1,1,0,0,0,0|1,0,0]=3 2126 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [1,1,0,0,0,0|2,0,0]=4 2127 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [1,1,0,0,0,0|2,0,0]=4 2128 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [1,1,0,0,0,0|2,0,0]=4 2129 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,1,0,0,0,0|1,0,0]=3 2130 B11R1.13 CC=Cc1nccc(c1O)C 271570a_100016259895_100000696282 [1,1,0,0,0,0|2,0,0]=4 2131 B11R1.13 CCNc1cccc(c1Br)C 34a_100000684715_100000210202 [1,1,0,0,0,0|2,0,0]=4 2132 B11R1.13 CCNc1cccc(c1Br)O 34a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 2133 B11R1.13 CCNc1cccc(c1Br)O 7a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 2134 B11R1.13 CCNc1cccc(c1C)C 2230a_100000210026_100000210202 [1,1,0,0,0,0|2,0,0]=4 2135 B11R1.13 CCNc1cccc(c1C)C 34a_100000210026_100000210202 [1,1,0,0,0,0|2,0,0]=4 2136 B11R1.13 CCNc1cccc(c1C)C 7a_100000210026_100000210202 [1,1,0,0,0,0|2,0,0]=4 2137 B11R1.13 CCNc1cccc(c1C)O 34a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 2138 B11R1.13 CCNc1cccc(c1C)O 7a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 2139 B11R1.13 CCNc1cccc(c1Cl)C 34a_100000765562_100000210202 [1,1,0,0,0,0|2,0,0]=4 2140 B11R1.13 CCNc1cccc(c1Cl)C 7a_100000765562_100000210202 [1,1,0,0,0,0|2,0,0]=4 2141 B11R1.13 CCNc1cccc(c1Cl)O 34a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 2142 B11R1.13 CCNc1cccc(c1Cl)O 7a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 2143 B11R1.13 CCNc1cccc(c1F)C 2230a_100000697159_100000210202 [1,1,0,0,0,0|2,0,0]=4 2144 B11R1.13 CCNc1cccc(c1F)C 34a_100000697159_100000210202 [1,1,0,0,0,0|2,0,0]=4 2145 B11R1.13 CCNc1cccc(c1F)C 7a_100000697159_100000210202 [1,1,0,0,0,0|2,0,0]=4 2146 B11R1.13 CCNc1cccc(c1I)C 34a_100000761888_100000210202 [1,1,0,0,0,0|2,0,0]=4 2147 B11R1.13 CCNc1cccc(c1O)Br 34a_100011934915_100000210202 [1,1,0,0,0,0|2,0,0]=4 2148 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [1,1,0,0,0,0|1,0,0]=3 2149 B11R1.13 CCNc1cccc(c1O)Cl 34a_100000754742_100000210202 [1,1,0,0,0,0|2,0,0]=4 2150 B11R1.13 CCNc1cccc(c1O)F 34a_100011934987_100000210202 [1,1,0,0,0,0|2,0,0]=4 2151 B11R1.13 CCOc1cccc(c1Br)Br 34a_100010187966_100000210202 [1,1,0,0,0,0|2,0,0]=4 2152 B11R1.13 CCOc1cccc(c1Br)Br 7a_100010187966_100000210202 [1,1,0,0,0,0|2,0,0]=4 2153 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [1,1,0,0,0,0|1,0,0]=3 2154 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [1,1,0,0,0,0|1,0,0]=3 2155 B11R1.13 CCOc1cccc(c1Br)Cl 34a_100012348804_100000210202 [1,1,0,0,0,0|2,0,0]=4 2156 B11R1.13 CCOc1cccc(c1Br)Cl 7a_100012348804_100000210202 [1,1,0,0,0,0|2,0,0]=4 2157 B11R1.13 CCOc1cccc(c1Br)F 34a_100009820682_100000210202 [1,1,0,0,0,0|2,0,0]=4 2158 B11R1.13 CCOc1cccc(c1Br)F 7a_100009820682_100000210202 [1,1,0,0,0,0|2,0,0]=4 2159 B11R1.13 CCOc1cccc(c1Br)I 34a_100010187914_100000210202 [1,1,0,0,0,0|2,0,0]=4 2160 B11R1.13 CCOc1cccc(c1Br)I 7a_100010187914_100000210202 [1,1,0,0,0,0|2,0,0]=4 2161 B11R1.13 CCOc1cccc(c1Br)N 34a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 2162 B11R1.13 CCOc1cccc(c1Br)N 7a_100012183704_100000210202 [1,1,0,0,0,0|2,0,0]=4 2163 B11R1.13 CCOc1cccc(c1C)Br 34a_100012002258_100000210202 [1,1,0,0,0,0|2,0,0]=4 2164 B11R1.13 CCOc1cccc(c1C)Br 7a_100012002258_100000210202 [1,1,0,0,0,0|2,0,0]=4 2165 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [1,1,0,0,0,0|1,0,0]=3 2166 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [1,1,0,0,0,0|1,0,0]=3 2167 B11R1.13 CCOc1cccc(c1C)Cl 34a_100011265684_100000210202 [1,1,0,0,0,0|2,0,0]=4 2168 B11R1.13 CCOc1cccc(c1C)Cl 7a_100011265684_100000210202 [1,1,0,0,0,0|2,0,0]=4 2169 B11R1.13 CCOc1cccc(c1C)F 34a_100011217231_100000210202 [1,1,0,0,0,0|2,0,0]=4 2170 B11R1.13 CCOc1cccc(c1C)F 7a_100011217231_100000210202 [1,1,0,0,0,0|2,0,0]=4 2171 B11R1.13 CCOc1cccc(c1C)N 34a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 2172 B11R1.13 CCOc1cccc(c1C)N 7a_100011216573_100000210202 [1,1,0,0,0,0|2,0,0]=4 2173 B11R1.13 CCOc1cccc(c1Cl)Br 34a_100010187913_100000210202 [1,1,0,0,0,0|2,0,0]=4 2174 B11R1.13 CCOc1cccc(c1Cl)Br 7a_100010187913_100000210202 [1,1,0,0,0,0|2,0,0]=4 2175 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [1,1,0,0,0,0|1,0,0]=3 2176 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [1,1,0,0,0,0|1,0,0]=3 2177 B11R1.13 CCOc1cccc(c1Cl)Cl 34a_100000211076_100000210202 [1,1,0,0,0,0|2,0,0]=4 2178 B11R1.13 CCOc1cccc(c1Cl)Cl 7a_100000211076_100000210202 [1,1,0,0,0,0|2,0,0]=4 2179 B11R1.13 CCOc1cccc(c1Cl)F 34a_100000087408_100000210202 [1,1,0,0,0,0|2,0,0]=4 2180 B11R1.13 CCOc1cccc(c1Cl)F 7a_100000087408_100000210202 [1,1,0,0,0,0|2,0,0]=4 2181 B11R1.13 CCOc1cccc(c1Cl)I 34a_100000049636_100000210202 [1,1,0,0,0,0|2,0,0]=4 2182 B11R1.13 CCOc1cccc(c1Cl)I 7a_100000049636_100000210202 [1,1,0,0,0,0|2,0,0]=4 2183 B11R1.13 CCOc1cccc(c1Cl)N 34a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 2184 B11R1.13 CCOc1cccc(c1Cl)N 7a_100012002038_100000210202 [1,1,0,0,0,0|2,0,0]=4 2185 B11R1.13 CCOc1cccc(c1F)Br 34a_100009817021_100000210202 [1,1,0,0,0,0|2,0,0]=4 2186 B11R1.13 CCOc1cccc(c1F)Br 7a_100009817021_100000210202 [1,1,0,0,0,0|2,0,0]=4 2187 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [1,1,0,0,0,0|1,0,0]=3 2188 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [1,1,0,0,0,0|1,0,0]=3 2189 B11R1.13 CCOc1cccc(c1F)Cl 34a_100000687438_100000210202 [1,1,0,0,0,0|2,0,0]=4 2190 B11R1.13 CCOc1cccc(c1F)Cl 7a_100000687438_100000210202 [1,1,0,0,0,0|2,0,0]=4 2191 B11R1.13 CCOc1cccc(c1F)F 34a_100000751161_100000210202 [1,1,0,0,0,0|2,0,0]=4 2192 B11R1.13 CCOc1cccc(c1F)F 7a_100000751161_100000210202 [1,1,0,0,0,0|2,0,0]=4 2193 B11R1.13 CCOc1cccc(c1I)Br 34a_100010187912_100000210202 [1,1,0,0,0,0|2,0,0]=4 2194 B11R1.13 CCOc1cccc(c1I)Br 7a_100010187912_100000210202 [1,1,0,0,0,0|2,0,0]=4 2195 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [1,1,0,0,0,0|1,0,0]=3 2196 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [1,1,0,0,0,0|1,0,0]=3 2197 B11R1.13 CCOc1cccc(c1I)Cl 34a_100000050174_100000210202 [1,1,0,0,0,0|2,0,0]=4 2198 B11R1.13 CCOc1cccc(c1I)Cl 7a_100000050174_100000210202 [1,1,0,0,0,0|2,0,0]=4 2199 B11R1.13 CCOc1cccc(c1I)F 34a_100000690913_100000210202 [1,1,0,0,0,0|2,0,0]=4 2200 B11R1.13 CCOc1cccc(c1I)F 7a_100000690913_100000210202 [1,1,0,0,0,0|2,0,0]=4 2201 B11R1.13 CCOc1cccc(c1N)Br 34a_100011934926_100000210202 [1,1,0,0,0,0|2,0,0]=4 2202 B11R1.13 CCOc1cccc(c1N)Br 7a_100011934926_100000210202 [1,1,0,0,0,0|2,0,0]=4 2203 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [1,1,0,0,0,0|1,0,0]=3 2204 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [1,1,0,0,0,0|1,0,0]=3 2205 B11R1.13 CCOc1cccc(c1N)Cl 34a_100012022510_100000210202 [1,1,0,0,0,0|2,0,0]=4 2206 B11R1.13 CCOc1cccc(c1N)Cl 7a_100012022510_100000210202 [1,1,0,0,0,0|2,0,0]=4 2207 B11R1.13 CCOc1cccc(c1N)F 34a_100020591140_100000210202 [1,1,0,0,0,0|2,0,0]=4 2208 B11R1.13 CCOc1cccc(c1N)F 7a_100020591140_100000210202 [1,1,0,0,0,0|2,0,0]=4 2209 B11R1.13 CCOc1cccc(c1N)I 34a_200000049512_100000210202 [1,1,0,0,0,0|2,0,0]=4 2210 B11R1.13 CCOc1cccc(c1N)I 7a_200000049512_100000210202 [1,1,0,0,0,0|2,0,0]=4 2211 B11R1.13 CCOc1cccc(c1N)N 34a_100000033209_100000210202 [1,1,0,0,0,0|2,0,0]=4 2212 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [1,1,0,0,0,0|1,0,0]=3 2213 B11R1.13 CCOc1cccn(c1=O)C 34a_100000117616_100000210202 [1,1,0,0,0,0|1,0,1]=4 2214 B11R1.13 CCOc1cccn(c1=O)C 7a_100000117616_100000210202 [1,1,0,0,0,0|1,0,1]=4 2215 B11R1.13 CCOc1nccc(c1Br)C 34a_100012000493_100000210202 [1,1,0,0,0,0|2,0,0]=4 2216 B11R1.13 CCSc1cccc(c1Br)C 62a_100000210202_100012362457 [1,1,0,0,0,0|1,1,0]=4 2217 B11R1.13 CCSc1cccc(c1Br)C 62a_100012362457_100000210202 [1,1,0,0,0,0|1,1,0]=4 2218 B11R1.13 CCSc1cccc(c1Br)O 62a_100000210202_100010187914 [1,1,0,0,0,0|1,1,0]=4 2219 B11R1.13 CCSc1cccc(c1Br)O 62a_100010187914_100000210202 [1,1,0,0,0,0|1,1,0]=4 2220 B11R1.13 CCSc1cccc(c1C)C 62a_100000210202_100011214922 [1,1,0,0,0,0|1,1,0]=4 2221 B11R1.13 CCSc1cccc(c1C)C 62a_100011214922_100000210202 [1,1,0,0,0,0|1,1,0]=4 2222 B11R1.13 CCSc1cccc(c1C)O 62a_100000210202_100012002258 [1,1,0,0,0,0|1,1,0]=4 2223 B11R1.13 CCSc1cccc(c1C)O 62a_100012002258_100000210202 [1,1,0,0,0,0|1,1,0]=4 2224 B11R1.13 CCSc1cccc(c1Cl)C 62a_100000210202_200012352035 [1,1,0,0,0,0|1,1,0]=4 2225 B11R1.13 CCSc1cccc(c1Cl)C 62a_200012352035_100000210202 [1,1,0,0,0,0|1,1,0]=4 2226 B11R1.13 CCSc1cccc(c1Cl)O 62a_100000210202_100000049636 [1,1,0,0,0,0|1,1,0]=4 2227 B11R1.13 CCSc1cccc(c1F)C 62a_100000210202_100000717567 [1,1,0,0,0,0|1,1,0]=4 2228 B11R1.13 CCSc1cccc(c1F)C 62a_100000717567_100000210202 [1,1,0,0,0,0|1,1,0]=4 2229 B11R1.13 CCSc1cccc(c1F)O 62a_100000210202_100009817021 [1,1,0,0,0,0|1,1,0]=4 2230 B11R1.13 CCSc1cccc(c1F)O 62a_100009817021_100000210202 [1,1,0,0,0,0|1,1,0]=4 2231 B11R1.13 CCSc1cccc(c1N)C 62a_100000210202_100011834072 [1,1,0,0,0,0|1,1,0]=4 2232 B11R1.13 CCSc1cccc(c1N)C 62a_100011834072_100000210202 [1,1,0,0,0,0|1,1,0]=4 2233 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [1,1,0,0,0,0|1,1,0]=4 2234 B11R1.13 CCSc1cccc(c1O)Br 62a_100000210202_100010084509 [1,1,0,0,0,0|1,1,0]=4 2235 B11R1.13 CCSc1cccc(c1O)Br 62a_100010084509_100000210202 [1,1,0,0,0,0|1,1,0]=4 2236 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [1,1,0,0,0,0|0,1,0]=3 2237 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [1,1,0,0,0,0|0,1,0]=3 2238 B11R1.13 CCSc1cccc(c1O)Cl 62a_100000210202_100010202889 [1,1,0,0,0,0|1,1,0]=4 2239 B11R1.13 CCSc1cccc(c1O)Cl 62a_100010202889_100000210202 [1,1,0,0,0,0|1,1,0]=4 2240 B11R1.13 CCSc1cccc(c1O)F 62a_100000210202_100009813666 [1,1,0,0,0,0|1,1,0]=4 2241 B11R1.13 CCSc1cccc(c1O)F 62a_100009813666_100000210202 [1,1,0,0,0,0|1,1,0]=4 2242 B11R1.13 CCSc1cccc(c1O)N 62a_100000210202_100010084371 [1,1,0,0,0,0|1,1,0]=4 2243 B11R1.13 CCSc1cccc(c1O)N 62a_100011934915_100000210202 [1,1,0,0,0,0|1,1,0]=4 2244 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [1,1,0,0,0,0|0,1,0]=3 2245 B11R1.13 CCSc1nccc(c1O)C 62a_100000210202_100000696282 [1,1,0,0,0,0|1,1,0]=4 2246 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [1,1,0,0,0,0|2,0,0]=4 2247 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [1,1,0,0,0,0|2,0,0]=4 2248 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [1,1,0,0,0,0|2,0,0]=4 2249 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [1,1,0,0,0,0|2,0,0]=4 2250 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [1,1,0,0,0,0|2,0,0]=4 2251 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [1,1,0,0,0,0|2,0,0]=4 2252 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [1,1,0,0,0,0|2,0,0]=4 2253 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 2254 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [1,1,0,0,0,0|2,0,0]=4 2255 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [1,1,0,0,0,0|2,0,0]=4 2256 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 2257 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [1,1,0,0,0,0|2,0,0]=4 2258 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [1,1,0,0,0,0|2,0,0]=4 2259 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [1,1,0,0,0,0|2,0,0]=4 2260 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [1,1,0,0,0,0|2,0,0]=4 2261 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [1,1,0,0,0,0|2,0,0]=4 2262 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [1,1,0,0,0,0|2,0,0]=4 2263 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [1,1,0,0,0,0|2,0,0]=4 2264 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [1,1,0,0,0,0|2,0,0]=4 2265 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [1,1,0,0,0,0|2,0,0]=4 2266 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [1,1,0,0,0,0|2,0,0]=4 2267 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2268 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [1,1,0,0,0,0|2,0,0]=4 2269 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [1,1,0,0,0,0|2,0,0]=4 2270 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2271 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [1,1,0,0,0,0|2,0,0]=4 2272 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [1,1,0,0,0,0|2,0,0]=4 2273 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [1,1,0,0,0,0|2,0,0]=4 2274 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2275 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [1,1,0,0,0,0|1,0,0]=3 2276 B11R1.13 COCc1cccc(c1Br)C 34a_100011659289_200000210301 [1,1,0,0,0,0|1,0,0]=3 2277 B11R1.13 COCc1cccc(c1Br)C 34a_100138415774_200012349612 [1,1,0,0,0,0|1,0,0]=3 2278 B11R1.13 COCc1cccc(c1Br)C 7a_100011659289_200000210301 [1,1,0,0,0,0|1,0,0]=3 2279 B11R1.13 COCc1cccc(c1Br)Cl 34a_100010168166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2280 B11R1.13 COCc1cccc(c1Br)Cl 34a_100138415774_100010145525 [1,1,0,0,0,0|2,0,0]=4 2281 B11R1.13 COCc1cccc(c1Br)Cl 7a_100010168166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2282 B11R1.13 COCc1cccc(c1Br)F 34a_100012351117_200000210301 [1,1,0,0,0,0|2,0,0]=4 2283 B11R1.13 COCc1cccc(c1Br)F 34a_100138415774_100012351116 [1,1,0,0,0,0|2,0,0]=4 2284 B11R1.13 COCc1cccc(c1Br)F 7a_100012351117_200000210301 [1,1,0,0,0,0|2,0,0]=4 2285 B11R1.13 COCc1cccc(c1Br)I 34a_100010240205_200000210301 [1,1,0,0,0,0|2,0,0]=4 2286 B11R1.13 COCc1cccc(c1Br)I 34a_100138415774_100010254545 [1,1,0,0,0,0|2,0,0]=4 2287 B11R1.13 COCc1cccc(c1Br)I 7a_100010240205_200000210301 [1,1,0,0,0,0|2,0,0]=4 2288 B11R1.13 COCc1cccc(c1C)Br 34a_100000694458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2289 B11R1.13 COCc1cccc(c1C)Br 34a_100138415774_100000694682 [1,1,0,0,0,0|2,0,0]=4 2290 B11R1.13 COCc1cccc(c1C)Br 7a_100000694458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2291 B11R1.13 COCc1cccc(c1C)C 34a_100011219135_200000210301 [1,1,0,0,0,0|1,0,0]=3 2292 B11R1.13 COCc1cccc(c1C)C 34a_100138415774_100011273979 [1,1,0,0,0,0|1,0,0]=3 2293 B11R1.13 COCc1cccc(c1C)C 7a_100011219135_200000210301 [1,1,0,0,0,0|1,0,0]=3 2294 B11R1.13 COCc1cccc(c1C)Cl 34a_100012000165_200000210301 [1,1,0,0,0,0|2,0,0]=4 2295 B11R1.13 COCc1cccc(c1C)Cl 34a_100138415774_100012186920 [1,1,0,0,0,0|2,0,0]=4 2296 B11R1.13 COCc1cccc(c1C)Cl 7a_100012000165_200000210301 [1,1,0,0,0,0|2,0,0]=4 2297 B11R1.13 COCc1cccc(c1C)F 34a_100000042775_200000210301 [1,1,0,0,0,0|2,0,0]=4 2298 B11R1.13 COCc1cccc(c1C)F 34a_100138415774_100009813626 [1,1,0,0,0,0|2,0,0]=4 2299 B11R1.13 COCc1cccc(c1C)F 7a_100000042775_200000210301 [1,1,0,0,0,0|2,0,0]=4 2300 B11R1.13 COCc1cccc(c1C)I 34a_100010150139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2301 B11R1.13 COCc1cccc(c1C)I 34a_100138415774_100010150147 [1,1,0,0,0,0|2,0,0]=4 2302 B11R1.13 COCc1cccc(c1C)I 7a_100010150139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2303 B11R1.13 COCc1cccc(c1C)N 34a_102495339961_200000210301 [1,1,0,0,0,0|2,0,0]=4 2304 B11R1.13 COCc1cccc(c1C)N 7a_102495339961_200000210301 [1,1,0,0,0,0|2,0,0]=4 2305 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [1,1,0,0,0,0|1,0,0]=3 2306 B11R1.13 COCc1cccc(c1Cl)Br 34a_100012351182_200000210301 [1,1,0,0,0,0|2,0,0]=4 2307 B11R1.13 COCc1cccc(c1Cl)Br 34a_100138415774_100012349491 [1,1,0,0,0,0|2,0,0]=4 2308 B11R1.13 COCc1cccc(c1Cl)Br 7a_100012351182_200000210301 [1,1,0,0,0,0|2,0,0]=4 2309 B11R1.13 COCc1cccc(c1Cl)C 34a_100000710031_200000210301 [1,1,0,0,0,0|1,0,0]=3 2310 B11R1.13 COCc1cccc(c1Cl)C 7a_100000710031_200000210301 [1,1,0,0,0,0|1,0,0]=3 2311 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100000720469_200000210301 [1,1,0,0,0,0|2,0,0]=4 2312 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100138415774_100000723366 [1,1,0,0,0,0|2,0,0]=4 2313 B11R1.13 COCc1cccc(c1Cl)Cl 7a_100000720469_200000210301 [1,1,0,0,0,0|2,0,0]=4 2314 B11R1.13 COCc1cccc(c1Cl)F 34a_100000696319_200000210301 [1,1,0,0,0,0|2,0,0]=4 2315 B11R1.13 COCc1cccc(c1Cl)F 34a_100138415774_100000696688 [1,1,0,0,0,0|2,0,0]=4 2316 B11R1.13 COCc1cccc(c1Cl)F 7a_100000696319_200000210301 [1,1,0,0,0,0|2,0,0]=4 2317 B11R1.13 COCc1cccc(c1F)Br 34a_100011935076_200000210301 [1,1,0,0,0,0|2,0,0]=4 2318 B11R1.13 COCc1cccc(c1F)Br 34a_100138415774_100012356506 [1,1,0,0,0,0|2,0,0]=4 2319 B11R1.13 COCc1cccc(c1F)Br 7a_100011935076_200000210301 [1,1,0,0,0,0|2,0,0]=4 2320 B11R1.13 COCc1cccc(c1F)C 34a_100138415774_100011216058 [1,1,0,0,0,0|1,0,0]=3 2321 B11R1.13 COCc1cccc(c1F)C 34a_200011219517_200000210301 [1,1,0,0,0,0|1,0,0]=3 2322 B11R1.13 COCc1cccc(c1F)C 7a_200011219517_200000210301 [1,1,0,0,0,0|1,0,0]=3 2323 B11R1.13 COCc1cccc(c1F)Cl 34a_100011216988_200000210301 [1,1,0,0,0,0|2,0,0]=4 2324 B11R1.13 COCc1cccc(c1F)Cl 34a_100138415774_100000716733 [1,1,0,0,0,0|2,0,0]=4 2325 B11R1.13 COCc1cccc(c1F)Cl 7a_100011216988_200000210301 [1,1,0,0,0,0|2,0,0]=4 2326 B11R1.13 COCc1cccc(c1F)F 34a_100011218644_200000210301 [1,1,0,0,0,0|2,0,0]=4 2327 B11R1.13 COCc1cccc(c1F)F 34a_100138415774_100000217499 [1,1,0,0,0,0|2,0,0]=4 2328 B11R1.13 COCc1cccc(c1F)F 7a_100011218644_200000210301 [1,1,0,0,0,0|2,0,0]=4 2329 B11R1.13 COCc1cccc(c1F)I 34a_200010235739_200000210301 [1,1,0,0,0,0|2,0,0]=4 2330 B11R1.13 COCc1cccc(c1F)I 7a_200010235739_200000210301 [1,1,0,0,0,0|2,0,0]=4 2331 B11R1.13 COCc1cccc(c1F)N 34a_100012023829_200000210301 [1,1,0,0,0,0|2,0,0]=4 2332 B11R1.13 COCc1cccc(c1I)Br 34a_100010146604_200000210301 [1,1,0,0,0,0|2,0,0]=4 2333 B11R1.13 COCc1cccc(c1I)Br 7a_100010146604_200000210301 [1,1,0,0,0,0|2,0,0]=4 2334 B11R1.13 COCc1cccc(c1I)C 34a_100012349780_200000210301 [1,1,0,0,0,0|1,0,0]=3 2335 B11R1.13 COCc1cccc(c1I)C 7a_100012349780_200000210301 [1,1,0,0,0,0|1,0,0]=3 2336 B11R1.13 COCc1cccc(c1I)F 34a_100000692438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2337 B11R1.13 COCc1cccc(c1I)F 34a_100138415774_100010149603 [1,1,0,0,0,0|2,0,0]=4 2338 B11R1.13 COCc1cccc(c1I)F 7a_100000692438_200000210301 [1,1,0,0,0,0|2,0,0]=4 2339 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2340 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [1,1,0,0,0,0|1,0,0]=3 2341 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [1,1,0,0,0,0|2,0,0]=4 2342 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [1,1,0,0,0,0|2,0,0]=4 2343 B11R1.13 CSCc1cccc(c1Br)C 62a_200000210301_200012349612 [1,1,0,0,0,0|1,1,0]=4 2344 B11R1.13 CSCc1cccc(c1Br)C 62a_200012349612_200000210301 [1,1,0,0,0,0|1,1,0]=4 2345 B11R1.13 CSCc1cccc(c1C)C 62a_100011515928_200000210301 [1,1,0,0,0,0|1,1,0]=4 2346 B11R1.13 CSCc1cccc(c1C)C 62a_200000210301_100011515928 [1,1,0,0,0,0|1,1,0]=4 2347 B11R1.13 CSCc1cccc(c1F)C 62a_100011216058_200000210301 [1,1,0,0,0,0|1,1,0]=4 2348 B11R1.13 CSCc1cccc(c1F)C 62a_200000210301_100011216058 [1,1,0,0,0,0|1,1,0]=4 2349 B11R1.13 Cc1c(cccc1CCN)O 271570a_203496583355_100161000114 [1,1,0,0,0,0|2,0,0]=4 2350 B11R1.13 Cc1c(cccc1CO[13CH3])Br 34a_100000694458_200025704644 [1,1,0,0,0,0|2,0,0]=4 2351 B11R1.13 Cc1c(cccc1CO[13CH3])Br 7a_100000694458_200025704644 [1,1,0,0,0,0|2,0,0]=4 2352 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 34a_100012000165_200025704644 [1,1,0,0,0,0|2,0,0]=4 2353 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 7a_100012000165_200025704644 [1,1,0,0,0,0|2,0,0]=4 2354 B11R1.13 Cc1c(cccc1CO[13CH3])F 34a_100000042775_200025704644 [1,1,0,0,0,0|2,0,0]=4 2355 B11R1.13 Cc1c(cccc1CO[13CH3])F 7a_100000042775_200025704644 [1,1,0,0,0,0|2,0,0]=4 2356 B11R1.13 Cc1c(cccc1CO[13CH3])I 34a_100010150139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2357 B11R1.13 Cc1c(cccc1CO[13CH3])I 7a_100010150139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2358 B11R1.13 Cc1c(cccc1CO[13CH3])N 34a_102495339961_200025704644 [1,1,0,0,0,0|2,0,0]=4 2359 B11R1.13 Cc1c(cccc1CO[13CH3])N 7a_102495339961_200025704644 [1,1,0,0,0,0|2,0,0]=4 2360 B11R1.13 Cc1c(cccc1NCF)O 34a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 2361 B11R1.13 Cc1c(cccc1NCF)O 7a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 2362 B11R1.13 Cc1c(cccc1OCF)Br 34a_100012002258_100015361967 [1,1,0,0,0,0|2,0,0]=4 2363 B11R1.13 Cc1c(cccc1OCF)Br 7a_100012002258_100015361967 [1,1,0,0,0,0|2,0,0]=4 2364 B11R1.13 Cc1c(cccc1OCF)Cl 34a_100011265684_100015361967 [1,1,0,0,0,0|2,0,0]=4 2365 B11R1.13 Cc1c(cccc1OCF)Cl 7a_100011265684_100015361967 [1,1,0,0,0,0|2,0,0]=4 2366 B11R1.13 Cc1c(cccc1OCF)F 34a_100011217231_100015361967 [1,1,0,0,0,0|2,0,0]=4 2367 B11R1.13 Cc1c(cccc1OCF)F 7a_100011217231_100015361967 [1,1,0,0,0,0|2,0,0]=4 2368 B11R1.13 Cc1c(cccc1OCF)N 34a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 2369 B11R1.13 Cc1c(cccc1OCF)N 7a_100011216573_100015361967 [1,1,0,0,0,0|2,0,0]=4 2370 B11R1.13 Cc1c(cccc1SCF)O 62a_100012002258_100015361967 [1,1,0,0,0,0|1,1,0]=4 2371 B11R1.13 Cc1c(cccc1SCF)O 62a_100015361967_100012002258 [1,1,0,0,0,0|1,1,0]=4 2372 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 34a_100011659289_200025704644 [1,1,0,0,0,0|1,0,0]=3 2373 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 7a_100011659289_200025704644 [1,1,0,0,0,0|1,0,0]=3 2374 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200012349612_200025704644 [1,1,0,0,0,0|1,1,0]=4 2375 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200025704644_200012349612 [1,1,0,0,0,0|1,1,0]=4 2376 B11R1.13 Cc1cccc(c1Br)NCF 34a_100000684715_100015361967 [1,1,0,0,0,0|2,0,0]=4 2377 B11R1.13 Cc1cccc(c1Br)OCF 34a_100000686692_100015361967 [1,1,0,0,0,0|1,0,0]=3 2378 B11R1.13 Cc1cccc(c1Br)OCF 7a_100000686692_100015361967 [1,1,0,0,0,0|1,0,0]=3 2379 B11R1.13 Cc1cccc(c1Br)SCF 62a_100012362457_100015361967 [1,1,0,0,0,0|1,1,0]=4 2380 B11R1.13 Cc1cccc(c1Br)SCF 62a_100015361967_100012362457 [1,1,0,0,0,0|1,1,0]=4 2381 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 2382 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 2383 B11R1.13 Cc1cccc(c1C)CO[13CH3] 34a_100011219135_200025704644 [1,1,0,0,0,0|1,0,0]=3 2384 B11R1.13 Cc1cccc(c1C)CO[13CH3] 7a_100011219135_200025704644 [1,1,0,0,0,0|1,0,0]=3 2385 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_100011515928_200025704644 [1,1,0,0,0,0|1,1,0]=4 2386 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_200025704644_100011515928 [1,1,0,0,0,0|1,1,0]=4 2387 B11R1.13 Cc1cccc(c1C)NCF 34a_100000210026_100015361967 [1,1,0,0,0,0|2,0,0]=4 2388 B11R1.13 Cc1cccc(c1C)NCF 7a_100000210026_100015361967 [1,1,0,0,0,0|2,0,0]=4 2389 B11R1.13 Cc1cccc(c1C)OCF 34a_100000185855_100015361967 [1,1,0,0,0,0|1,0,0]=3 2390 B11R1.13 Cc1cccc(c1C)OCF 7a_100000185855_100015361967 [1,1,0,0,0,0|1,0,0]=3 2391 B11R1.13 Cc1cccc(c1C)SCF 62a_100011214922_100015361967 [1,1,0,0,0,0|1,1,0]=4 2392 B11R1.13 Cc1cccc(c1C)SCF 62a_100015361967_100011214922 [1,1,0,0,0,0|1,1,0]=4 2393 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [1,1,0,0,0,0|2,0,0]=4 2394 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [1,1,0,0,0,0|2,0,0]=4 2395 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 34a_100000710031_200025704644 [1,1,0,0,0,0|1,0,0]=3 2396 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 7a_100000710031_200025704644 [1,1,0,0,0,0|1,0,0]=3 2397 B11R1.13 Cc1cccc(c1Cl)NCF 34a_100000765562_100015361967 [1,1,0,0,0,0|2,0,0]=4 2398 B11R1.13 Cc1cccc(c1Cl)NCF 7a_100000765562_100015361967 [1,1,0,0,0,0|2,0,0]=4 2399 B11R1.13 Cc1cccc(c1Cl)OCF 34a_100000695629_100015361967 [1,1,0,0,0,0|1,0,0]=3 2400 B11R1.13 Cc1cccc(c1Cl)OCF 7a_100000695629_100015361967 [1,1,0,0,0,0|1,0,0]=3 2401 B11R1.13 Cc1cccc(c1Cl)SCF 62a_100015361967_200012352035 [1,1,0,0,0,0|1,1,0]=4 2402 B11R1.13 Cc1cccc(c1Cl)SCF 62a_200012352035_100015361967 [1,1,0,0,0,0|1,1,0]=4 2403 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2404 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2405 B11R1.13 Cc1cccc(c1F)CO[13CH3] 34a_200011219517_200025704644 [1,1,0,0,0,0|1,0,0]=3 2406 B11R1.13 Cc1cccc(c1F)CO[13CH3] 7a_200011219517_200025704644 [1,1,0,0,0,0|1,0,0]=3 2407 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_100011216058_200025704644 [1,1,0,0,0,0|1,1,0]=4 2408 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_200025704644_100011216058 [1,1,0,0,0,0|1,1,0]=4 2409 B11R1.13 Cc1cccc(c1F)NCF 34a_100000697159_100015361967 [1,1,0,0,0,0|2,0,0]=4 2410 B11R1.13 Cc1cccc(c1F)NCF 7a_100000697159_100015361967 [1,1,0,0,0,0|2,0,0]=4 2411 B11R1.13 Cc1cccc(c1F)OCF 34a_100000751311_100015361967 [1,1,0,0,0,0|1,0,0]=3 2412 B11R1.13 Cc1cccc(c1F)OCF 7a_100000751311_100015361967 [1,1,0,0,0,0|1,0,0]=3 2413 B11R1.13 Cc1cccc(c1F)SCF 62a_100000717567_100015361967 [1,1,0,0,0,0|1,1,0]=4 2414 B11R1.13 Cc1cccc(c1F)SCF 62a_100015361967_100000717567 [1,1,0,0,0,0|1,1,0]=4 2415 B11R1.13 Cc1cccc(c1I)CO[13CH3] 34a_100012349780_200025704644 [1,1,0,0,0,0|1,0,0]=3 2416 B11R1.13 Cc1cccc(c1I)CO[13CH3] 7a_100012349780_200025704644 [1,1,0,0,0,0|1,0,0]=3 2417 B11R1.13 Cc1cccc(c1I)NCF 34a_100000761888_100015361967 [1,1,0,0,0,0|2,0,0]=4 2418 B11R1.13 Cc1cccc(c1I)OCF 34a_100010083724_100015361967 [1,1,0,0,0,0|1,0,0]=3 2419 B11R1.13 Cc1cccc(c1I)OCF 7a_100010083724_100015361967 [1,1,0,0,0,0|1,0,0]=3 2420 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [1,1,0,0,0,0|1,0,0]=3 2421 B11R1.13 Cc1cccc(c1N)OCF 34a_100000743429_100015361967 [1,1,0,0,0,0|1,0,0]=3 2422 B11R1.13 Cc1cccc(c1N)OCF 7a_100000743429_100015361967 [1,1,0,0,0,0|1,0,0]=3 2423 B11R1.13 Cc1cccc(c1N)SCF 62a_100011834072_100015361967 [1,1,0,0,0,0|1,1,0]=4 2424 B11R1.13 Cc1cccc(c1N)SCF 62a_100015361967_100011834072 [1,1,0,0,0,0|1,1,0]=4 2425 B11R1.13 Cc1cccc(c1O)CC#N 271570a_203496583355_100010147024 [1,1,0,0,0,0|1,0,1]=4 2426 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [1,1,0,0,0,0|1,0,0]=3 2427 B11R1.13 Cc1cccc(c1O)NCF 34a_100000756359_100015361967 [1,1,0,0,0,0|1,0,0]=3 2428 B11R1.13 Cc1cccc(c1O)SCF 62a_100009817157_100015361967 [1,1,0,0,0,0|0,1,0]=3 2429 B11R1.13 Cc1cccc(c1O)SCF 62a_100015361967_100009817157 [1,1,0,0,0,0|0,1,0]=3 2430 B11R1.13 Cc1ccnc(c1Br)OCF 34a_100012000493_100015361967 [1,1,0,0,0,0|2,0,0]=4 2431 B11R1.13 Cc1ccnc(c1O)SCF 62a_100015361967_100000696282 [1,1,0,0,0,0|1,1,0]=4 2432 B11R1.13 Cn1cccc(c1=O)OCF 34a_100000117616_100015361967 [1,1,0,0,0,0|1,0,1]=4 2433 B11R1.13 Cn1cccc(c1=O)OCF 7a_100000117616_100015361967 [1,1,0,0,0,0|1,0,1]=4 2434 B11R1.13 FCOc1cccc(c1Br)Br 34a_100010187966_100015361967 [1,1,0,0,0,0|2,0,0]=4 2435 B11R1.13 FCOc1cccc(c1Br)Br 7a_100010187966_100015361967 [1,1,0,0,0,0|2,0,0]=4 2436 B11R1.13 FCOc1cccc(c1Br)Cl 34a_100012348804_100015361967 [1,1,0,0,0,0|2,0,0]=4 2437 B11R1.13 FCOc1cccc(c1Br)Cl 7a_100012348804_100015361967 [1,1,0,0,0,0|2,0,0]=4 2438 B11R1.13 FCOc1cccc(c1Br)F 34a_100009820682_100015361967 [1,1,0,0,0,0|2,0,0]=4 2439 B11R1.13 FCOc1cccc(c1Br)F 7a_100009820682_100015361967 [1,1,0,0,0,0|2,0,0]=4 2440 B11R1.13 FCOc1cccc(c1Br)I 34a_100010187914_100015361967 [1,1,0,0,0,0|2,0,0]=4 2441 B11R1.13 FCOc1cccc(c1Br)I 7a_100010187914_100015361967 [1,1,0,0,0,0|2,0,0]=4 2442 B11R1.13 FCOc1cccc(c1Cl)Br 34a_100010187913_100015361967 [1,1,0,0,0,0|2,0,0]=4 2443 B11R1.13 FCOc1cccc(c1Cl)Br 7a_100010187913_100015361967 [1,1,0,0,0,0|2,0,0]=4 2444 B11R1.13 FCOc1cccc(c1Cl)Cl 34a_100000211076_100015361967 [1,1,0,0,0,0|2,0,0]=4 2445 B11R1.13 FCOc1cccc(c1Cl)Cl 7a_100000211076_100015361967 [1,1,0,0,0,0|2,0,0]=4 2446 B11R1.13 FCOc1cccc(c1Cl)F 34a_100000087408_100015361967 [1,1,0,0,0,0|2,0,0]=4 2447 B11R1.13 FCOc1cccc(c1Cl)F 7a_100000087408_100015361967 [1,1,0,0,0,0|2,0,0]=4 2448 B11R1.13 FCOc1cccc(c1Cl)I 34a_100000049636_100015361967 [1,1,0,0,0,0|2,0,0]=4 2449 B11R1.13 FCOc1cccc(c1Cl)I 7a_100000049636_100015361967 [1,1,0,0,0,0|2,0,0]=4 2450 B11R1.13 FCOc1cccc(c1F)Br 34a_100009817021_100015361967 [1,1,0,0,0,0|2,0,0]=4 2451 B11R1.13 FCOc1cccc(c1F)Br 7a_100009817021_100015361967 [1,1,0,0,0,0|2,0,0]=4 2452 B11R1.13 FCOc1cccc(c1F)Cl 34a_100000687438_100015361967 [1,1,0,0,0,0|2,0,0]=4 2453 B11R1.13 FCOc1cccc(c1F)Cl 7a_100000687438_100015361967 [1,1,0,0,0,0|2,0,0]=4 2454 B11R1.13 FCOc1cccc(c1F)F 34a_100000751161_100015361967 [1,1,0,0,0,0|2,0,0]=4 2455 B11R1.13 FCOc1cccc(c1F)F 7a_100000751161_100015361967 [1,1,0,0,0,0|2,0,0]=4 2456 B11R1.13 FCOc1cccc(c1I)Br 34a_100010187912_100015361967 [1,1,0,0,0,0|2,0,0]=4 2457 B11R1.13 FCOc1cccc(c1I)Br 7a_100010187912_100015361967 [1,1,0,0,0,0|2,0,0]=4 2458 B11R1.13 FCOc1cccc(c1I)Cl 34a_100000050174_100015361967 [1,1,0,0,0,0|2,0,0]=4 2459 B11R1.13 FCOc1cccc(c1I)Cl 7a_100000050174_100015361967 [1,1,0,0,0,0|2,0,0]=4 2460 B11R1.13 FCOc1cccc(c1I)F 34a_100000690913_100015361967 [1,1,0,0,0,0|2,0,0]=4 2461 B11R1.13 FCOc1cccc(c1I)F 7a_100000690913_100015361967 [1,1,0,0,0,0|2,0,0]=4 2462 B11R1.13 Nc1c(cccc1OCF)Br 34a_100011934926_100015361967 [1,1,0,0,0,0|2,0,0]=4 2463 B11R1.13 Nc1c(cccc1OCF)Br 7a_100011934926_100015361967 [1,1,0,0,0,0|2,0,0]=4 2464 B11R1.13 Nc1c(cccc1OCF)Cl 34a_100012022510_100015361967 [1,1,0,0,0,0|2,0,0]=4 2465 B11R1.13 Nc1c(cccc1OCF)Cl 7a_100012022510_100015361967 [1,1,0,0,0,0|2,0,0]=4 2466 B11R1.13 Nc1c(cccc1OCF)F 34a_100020591140_100015361967 [1,1,0,0,0,0|2,0,0]=4 2467 B11R1.13 Nc1c(cccc1OCF)F 7a_100020591140_100015361967 [1,1,0,0,0,0|2,0,0]=4 2468 B11R1.13 Nc1c(cccc1OCF)I 34a_200000049512_100015361967 [1,1,0,0,0,0|2,0,0]=4 2469 B11R1.13 Nc1c(cccc1OCF)I 7a_200000049512_100015361967 [1,1,0,0,0,0|2,0,0]=4 2470 B11R1.13 Nc1c(cccc1SCF)O 62a_100015361967_100011934926 [1,1,0,0,0,0|1,1,0]=4 2471 B11R1.13 Nc1cccc(c1Br)OCF 34a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 2472 B11R1.13 Nc1cccc(c1Br)OCF 7a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 2473 B11R1.13 Nc1cccc(c1Cl)OCF 34a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 2474 B11R1.13 Nc1cccc(c1Cl)OCF 7a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 2475 B11R1.13 Nc1cccc(c1N)OCF 34a_100000033209_100015361967 [1,1,0,0,0,0|2,0,0]=4 2476 B11R1.13 Nc1cccc(c1O)SCF 62a_100011934915_100015361967 [1,1,0,0,0,0|1,1,0]=4 2477 B11R1.13 Nc1cccc(c1O)SCF 62a_100015361967_100010084371 [1,1,0,0,0,0|1,1,0]=4 2478 B11R1.13 Oc1c(cccc1NCF)Br 34a_100011934915_100015361967 [1,1,0,0,0,0|2,0,0]=4 2479 B11R1.13 Oc1c(cccc1NCF)Cl 34a_100000754742_100015361967 [1,1,0,0,0,0|2,0,0]=4 2480 B11R1.13 Oc1c(cccc1NCF)F 34a_100011934987_100015361967 [1,1,0,0,0,0|2,0,0]=4 2481 B11R1.13 Oc1c(cccc1SCF)Br 62a_100010084509_100015361967 [1,1,0,0,0,0|1,1,0]=4 2482 B11R1.13 Oc1c(cccc1SCF)Br 62a_100015361967_100010084509 [1,1,0,0,0,0|1,1,0]=4 2483 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100010202889_100015361967 [1,1,0,0,0,0|1,1,0]=4 2484 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100015361967_100010202889 [1,1,0,0,0,0|1,1,0]=4 2485 B11R1.13 Oc1c(cccc1SCF)F 62a_100009813666_100015361967 [1,1,0,0,0,0|1,1,0]=4 2486 B11R1.13 Oc1c(cccc1SCF)F 62a_100015361967_100009813666 [1,1,0,0,0,0|1,1,0]=4 2487 B11R1.13 Oc1cccc(c1Br)NCF 34a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 2488 B11R1.13 Oc1cccc(c1Br)NCF 7a_100012183704_100015361967 [1,1,0,0,0,0|2,0,0]=4 2489 B11R1.13 Oc1cccc(c1Br)SCF 62a_100010187914_100015361967 [1,1,0,0,0,0|1,1,0]=4 2490 B11R1.13 Oc1cccc(c1Br)SCF 62a_100015361967_100010187914 [1,1,0,0,0,0|1,1,0]=4 2491 B11R1.13 Oc1cccc(c1Cl)NCF 34a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 2492 B11R1.13 Oc1cccc(c1Cl)NCF 7a_100012002038_100015361967 [1,1,0,0,0,0|2,0,0]=4 2493 B11R1.13 Oc1cccc(c1Cl)SCF 62a_100015361967_100000049636 [1,1,0,0,0,0|1,1,0]=4 2494 B11R1.13 Oc1cccc(c1F)SCF 62a_100009817021_100015361967 [1,1,0,0,0,0|1,1,0]=4 2495 B11R1.13 Oc1cccc(c1F)SCF 62a_100015361967_100009817021 [1,1,0,0,0,0|1,1,0]=4 2496 B11R1.13 Oc1cccc(c1O)SCF 62a_100015361967_100009815950 [1,1,0,0,0,0|0,1,0]=3 2497 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2498 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 34a_100010168166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2499 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 7a_100010168166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2500 B11R1.13 [13CH3]OCc1cccc(c1Br)F 34a_100012351117_200025704644 [1,1,0,0,0,0|2,0,0]=4 2501 B11R1.13 [13CH3]OCc1cccc(c1Br)F 7a_100012351117_200025704644 [1,1,0,0,0,0|2,0,0]=4 2502 B11R1.13 [13CH3]OCc1cccc(c1Br)I 34a_100010240205_200025704644 [1,1,0,0,0,0|2,0,0]=4 2503 B11R1.13 [13CH3]OCc1cccc(c1Br)I 7a_100010240205_200025704644 [1,1,0,0,0,0|2,0,0]=4 2504 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 34a_100012351182_200025704644 [1,1,0,0,0,0|2,0,0]=4 2505 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 7a_100012351182_200025704644 [1,1,0,0,0,0|2,0,0]=4 2506 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 34a_100000720469_200025704644 [1,1,0,0,0,0|2,0,0]=4 2507 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 7a_100000720469_200025704644 [1,1,0,0,0,0|2,0,0]=4 2508 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 34a_100000696319_200025704644 [1,1,0,0,0,0|2,0,0]=4 2509 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 7a_100000696319_200025704644 [1,1,0,0,0,0|2,0,0]=4 2510 B11R1.13 [13CH3]OCc1cccc(c1F)Br 34a_100011935076_200025704644 [1,1,0,0,0,0|2,0,0]=4 2511 B11R1.13 [13CH3]OCc1cccc(c1F)Br 7a_100011935076_200025704644 [1,1,0,0,0,0|2,0,0]=4 2512 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 34a_100011216988_200025704644 [1,1,0,0,0,0|2,0,0]=4 2513 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 7a_100011216988_200025704644 [1,1,0,0,0,0|2,0,0]=4 2514 B11R1.13 [13CH3]OCc1cccc(c1F)F 34a_100011218644_200025704644 [1,1,0,0,0,0|2,0,0]=4 2515 B11R1.13 [13CH3]OCc1cccc(c1F)F 7a_100011218644_200025704644 [1,1,0,0,0,0|2,0,0]=4 2516 B11R1.13 [13CH3]OCc1cccc(c1F)I 34a_200010235739_200025704644 [1,1,0,0,0,0|2,0,0]=4 2517 B11R1.13 [13CH3]OCc1cccc(c1F)I 7a_200010235739_200025704644 [1,1,0,0,0,0|2,0,0]=4 2518 B11R1.13 [13CH3]OCc1cccc(c1F)N 34a_100012023829_200025704644 [1,1,0,0,0,0|2,0,0]=4 2519 B11R1.13 [13CH3]OCc1cccc(c1I)Br 34a_100010146604_200025704644 [1,1,0,0,0,0|2,0,0]=4 2520 B11R1.13 [13CH3]OCc1cccc(c1I)Br 7a_100010146604_200025704644 [1,1,0,0,0,0|2,0,0]=4 2521 B11R1.13 [13CH3]OCc1cccc(c1I)F 34a_100000692438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2522 B11R1.13 [13CH3]OCc1cccc(c1I)F 7a_100000692438_200025704644 [1,1,0,0,0,0|2,0,0]=4 2523 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [1,1,0,0,0,0|2,0,0]=4 2524 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [1,1,0,0,0,0|2,0,0]=4 2525 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [1,1,0,0,0,0|2,0,0]=4 2526 B11R1.72 CNc1c(ccc(c1C)C)C 2230a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 2527 B11R1.72 CNc1c(ccc(c1C)C)C 34a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 2528 B11R1.72 CNc1c(ccc(c1C)C)C 7a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 2529 B11R1.72 CNc1c(ccc(c1Cl)C)Cl 34a_100000210993_200000210301 [1,1,0,0,0,0|2,0,0]=4 2530 B11R1.72 CNc1c(ccc(c1Cl)C)F 34a_106744479701_200000210301 [1,1,0,0,0,0|2,0,0]=4 2531 B11R1.72 CNc1c(ccc(c1Cl)O)Cl 34a_100016988457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2532 B11R1.72 CNc1c(ccc(c1Cl)O)Cl 7a_100016988457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2533 B11R1.72 CNc1c(ccc(c1F)C)Cl 34a_100000062009_200000210301 [1,1,0,0,0,0|2,0,0]=4 2534 B11R1.72 CNc1c(ccc(c1F)C)F 2230a_102495364760_200000210301 [1,1,0,0,0,0|2,0,0]=4 2535 B11R1.72 CNc1c(ccc(c1F)C)F 34a_102495364760_200000210301 [1,1,0,0,0,0|2,0,0]=4 2536 B11R1.72 COc1c(ccc(c1Br)C)F 34a_200010223207_200000210301 [1,1,0,0,0,0|1,0,0]=3 2537 B11R1.72 COc1c(ccc(c1Br)C)F 7a_200010223207_200000210301 [1,1,0,0,0,0|1,0,0]=3 2538 B11R1.72 COc1c(ccc(c1Br)F)F 34a_100010170822_200000210301 [1,1,0,0,0,0|2,0,0]=4 2539 B11R1.72 COc1c(ccc(c1Br)F)F 7a_100010170822_200000210301 [1,1,0,0,0,0|2,0,0]=4 2540 B11R1.72 COc1c(ccc(c1Br)F)N 34a_100010128263_200000210301 [1,1,0,0,0,0|2,0,0]=4 2541 B11R1.72 COc1c(ccc(c1Br)F)N 7a_100010128263_200000210301 [1,1,0,0,0,0|2,0,0]=4 2542 B11R1.72 COc1c(ccc(c1C)C)C 34a_100000211305_200000210301 [1,1,0,0,0,0|1,0,0]=3 2543 B11R1.72 COc1c(ccc(c1C)C)C 7a_100000211305_200000210301 [1,1,0,0,0,0|1,0,0]=3 2544 B11R1.72 COc1c(ccc(c1C)Cl)Br 34a_200010391122_200000210301 [1,1,0,0,0,0|2,0,0]=4 2545 B11R1.72 COc1c(ccc(c1C)Cl)Br 7a_200010391122_200000210301 [1,1,0,0,0,0|2,0,0]=4 2546 B11R1.72 COc1c(ccc(c1C)F)Br 34a_200010391124_200000210301 [1,1,0,0,0,0|2,0,0]=4 2547 B11R1.72 COc1c(ccc(c1C)F)Br 7a_200010391124_200000210301 [1,1,0,0,0,0|2,0,0]=4 2548 B11R1.72 COc1c(ccc(c1Cl)Br)Cl 34a_100010089855_200000210301 [1,1,0,0,0,0|2,0,0]=4 2549 B11R1.72 COc1c(ccc(c1Cl)Br)Cl 7a_100010089855_200000210301 [1,1,0,0,0,0|2,0,0]=4 2550 B11R1.72 COc1c(ccc(c1Cl)C)Cl 34a_200000087117_200000210301 [1,1,0,0,0,0|1,0,0]=3 2551 B11R1.72 COc1c(ccc(c1Cl)C)Cl 7a_200000087117_200000210301 [1,1,0,0,0,0|1,0,0]=3 2552 B11R1.72 COc1c(ccc(c1Cl)C)F 34a_100000035349_200000210301 [1,1,0,0,0,0|1,0,0]=3 2553 B11R1.72 COc1c(ccc(c1Cl)C)F 7a_100000035349_200000210301 [1,1,0,0,0,0|1,0,0]=3 2554 B11R1.72 COc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_200000210301 [1,1,0,0,0,0|2,0,0]=4 2555 B11R1.72 COc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_200000210301 [1,1,0,0,0,0|2,0,0]=4 2556 B11R1.72 COc1c(ccc(c1Cl)Cl)F 34a_100000062035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2557 B11R1.72 COc1c(ccc(c1Cl)Cl)F 7a_100000062035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2558 B11R1.72 COc1c(ccc(c1Cl)F)Br 34a_100014979575_200000210301 [1,1,0,0,0,0|2,0,0]=4 2559 B11R1.72 COc1c(ccc(c1Cl)F)Br 7a_100014979575_200000210301 [1,1,0,0,0,0|2,0,0]=4 2560 B11R1.72 COc1c(ccc(c1Cl)F)F 34a_100000038336_200000210301 [1,1,0,0,0,0|2,0,0]=4 2561 B11R1.72 COc1c(ccc(c1Cl)F)F 7a_100000038336_200000210301 [1,1,0,0,0,0|2,0,0]=4 2562 B11R1.72 COc1c(ccc(c1Cl)N)C 34a_100000036876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2563 B11R1.72 COc1c(ccc(c1Cl)N)C 7a_100000036876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2564 B11R1.72 COc1c(ccc(c1F)Br)Cl 34a_100010240321_200000210301 [1,1,0,0,0,0|2,0,0]=4 2565 B11R1.72 COc1c(ccc(c1F)Br)Cl 7a_100010240321_200000210301 [1,1,0,0,0,0|2,0,0]=4 2566 B11R1.72 COc1c(ccc(c1F)Br)F 34a_100010167067_200000210301 [1,1,0,0,0,0|2,0,0]=4 2567 B11R1.72 COc1c(ccc(c1F)Br)F 7a_100010167067_200000210301 [1,1,0,0,0,0|2,0,0]=4 2568 B11R1.72 COc1c(ccc(c1F)C)Br 34a_100000722096_200000210301 [1,1,0,0,0,0|1,0,0]=3 2569 B11R1.72 COc1c(ccc(c1F)C)Br 7a_100000722096_200000210301 [1,1,0,0,0,0|1,0,0]=3 2570 B11R1.72 COc1c(ccc(c1F)C)Cl 34a_200000034537_200000210301 [1,1,0,0,0,0|1,0,0]=3 2571 B11R1.72 COc1c(ccc(c1F)C)Cl 7a_200000034537_200000210301 [1,1,0,0,0,0|1,0,0]=3 2572 B11R1.72 COc1c(ccc(c1F)C)F 34a_100011216644_200000210301 [1,1,0,0,0,0|1,0,0]=3 2573 B11R1.72 COc1c(ccc(c1F)C)F 7a_100011216644_200000210301 [1,1,0,0,0,0|1,0,0]=3 2574 B11R1.72 COc1c(ccc(c1F)C)O 271570a_203496583355_100010081143 [1,1,0,0,0,0|1,0,0]=3 2575 B11R1.72 COc1c(ccc(c1F)Cl)Br 34a_100010081130_200000210301 [1,1,0,0,0,0|2,0,0]=4 2576 B11R1.72 COc1c(ccc(c1F)Cl)Br 7a_100010081130_200000210301 [1,1,0,0,0,0|2,0,0]=4 2577 B11R1.72 COc1c(ccc(c1F)Cl)F 34a_100000034634_200000210301 [1,1,0,0,0,0|2,0,0]=4 2578 B11R1.72 COc1c(ccc(c1F)Cl)F 7a_100000034634_200000210301 [1,1,0,0,0,0|2,0,0]=4 2579 B11R1.72 COc1c(ccc(c1F)F)Br 34a_100010243909_200000210301 [1,1,0,0,0,0|2,0,0]=4 2580 B11R1.72 COc1c(ccc(c1F)F)Br 7a_100010243909_200000210301 [1,1,0,0,0,0|2,0,0]=4 2581 B11R1.72 COc1c(ccc(c1F)F)F 34a_100000031686_200000210301 [1,1,0,0,0,0|2,0,0]=4 2582 B11R1.72 COc1c(ccc(c1F)F)F 7a_100000031686_200000210301 [1,1,0,0,0,0|2,0,0]=4 2583 B11R1.72 COc1c(ccc(c1F)F)N 34a_100015205010_200000210301 [1,1,0,0,0,0|2,0,0]=4 2584 B11R1.72 COc1c(ccc(c1F)F)N 7a_100015205010_200000210301 [1,1,0,0,0,0|2,0,0]=4 2585 B11R1.72 COc1c(ccc(c1F)F)O 271570a_203496583355_100010223324 [1,1,0,0,0,0|2,0,0]=4 2586 B11R1.72 COc1c(ccc(c1F)I)Br 34a_200010782288_200000210301 [1,1,0,0,0,0|2,0,0]=4 2587 B11R1.72 COc1c(ccc(c1F)I)Br 7a_200010782288_200000210301 [1,1,0,0,0,0|2,0,0]=4 2588 B11R1.72 COc1c(ccc(c1F)O)Cl 271570a_203496583355_200135222481 [1,1,0,0,0,0|1,0,0]=3 2589 B11R1.72 COc1c(ccc(c1F)O)N 271570a_203496583355_100010734149 [1,1,0,0,0,0|1,0,0]=3 2590 B11R1.72 COc1c(ccc(c1O)F)Br 271570a_203496583355_200034458476 [1,1,0,0,0,0|1,0,0]=3 2591 B11R1.72 COc1c(ccc(c1O)F)F 271570a_203496583355_100010254772 [1,1,0,0,0,0|1,0,0]=3 2592 B11R1.72 COc1c(ccc(c1O)F)N 271570a_203496583355_102516457224 [1,1,0,0,0,0|1,0,0]=3 2593 B11R1.72 COc1c(ccc(c1O)F)O 271570a_203496583355_200010167157 [1,1,0,0,0,0|1,0,0]=3 2594 B11R1.72 COc1c(n(ccc1=O)C)C 34a_100000032683_200000210301 [1,1,0,0,0,0|2,0,0]=4 2595 B11R1.72 COc1c(n(ccc1=O)C)C 7a_100000032683_200000210301 [1,1,0,0,0,0|2,0,0]=4 2596 B11R1.72 CSc1c(ccc(c1C)O)C 62a_100010659238_200000210301 [1,1,0,0,0,0|1,1,0]=4 2597 B11R1.72 CSc1c(ccc(c1C)O)C 62a_200000210301_100010659238 [1,1,0,0,0,0|1,1,0]=4 2598 B11R1.72 CSc1c(ccc(c1F)C)O 271570a_203496583355_200134762213 [1,1,0,0,0,0|1,1,0]=4 2599 B11R1.72 CSc1c(ccc(c1F)O)F 271570a_203496583355_202125771753 [1,1,0,0,0,0|1,1,0]=4 2600 B11R1.72 CSc1c(ccc(c1O)F)C 62a_200000210301_200010223207 [1,1,0,0,0,0|1,1,0]=4 2601 B11R1.72 CSc1c(ccc(c1O)F)C 62a_200010223207_200000210301 [1,1,0,0,0,0|1,1,0]=4 2602 B11R1.72 CSc1c(ccc(c1O)F)F 62a_100010170822_200000210301 [1,1,0,0,0,0|1,1,0]=4 2603 B11R1.72 CSc1c(ccc(c1O)F)F 62a_200000210301_100010170822 [1,1,0,0,0,0|1,1,0]=4 2604 B11R1.72 CSc1c(ccc(c1O)N)F 62a_100010128263_200000210301 [1,1,0,0,0,0|1,1,0]=4 2605 B11R1.72 CSc1c(ccc(c1O)N)F 62a_200000210301_100010128263 [1,1,0,0,0,0|1,1,0]=4 2606 B11R1.72 Cc1c(c(=O)ccn1C)O[13CH3] 34a_100000032683_200025704644 [1,1,0,0,0,0|2,0,0]=4 2607 B11R1.72 Cc1c(c(=O)ccn1C)O[13CH3] 7a_100000032683_200025704644 [1,1,0,0,0,0|2,0,0]=4 2608 B11R1.72 Cc1c(ccc(c1O[13CH3])Br)Cl 34a_200010391122_200025704644 [1,1,0,0,0,0|2,0,0]=4 2609 B11R1.72 Cc1c(ccc(c1O[13CH3])Br)Cl 7a_200010391122_200025704644 [1,1,0,0,0,0|2,0,0]=4 2610 B11R1.72 Cc1c(ccc(c1O[13CH3])Br)F 34a_200010391124_200025704644 [1,1,0,0,0,0|2,0,0]=4 2611 B11R1.72 Cc1c(ccc(c1O[13CH3])Br)F 7a_200010391124_200025704644 [1,1,0,0,0,0|2,0,0]=4 2612 B11R1.72 Cc1ccc(c(c1Br)O[13CH3])F 34a_200010223207_200025704644 [1,1,0,0,0,0|1,0,0]=3 2613 B11R1.72 Cc1ccc(c(c1Br)O[13CH3])F 7a_200010223207_200025704644 [1,1,0,0,0,0|1,0,0]=3 2614 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 2230a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 2615 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 34a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 2616 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 7a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 2617 B11R1.72 Cc1ccc(c(c1C)O[13CH3])C 34a_100000211305_200025704644 [1,1,0,0,0,0|1,0,0]=3 2618 B11R1.72 Cc1ccc(c(c1C)O[13CH3])C 7a_100000211305_200025704644 [1,1,0,0,0,0|1,0,0]=3 2619 B11R1.72 Cc1ccc(c(c1Cl)N[13CH3])Cl 34a_100000210993_200025704644 [1,1,0,0,0,0|2,0,0]=4 2620 B11R1.72 Cc1ccc(c(c1Cl)N[13CH3])F 34a_106744479701_200025704644 [1,1,0,0,0,0|2,0,0]=4 2621 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])Cl 34a_200000087117_200025704644 [1,1,0,0,0,0|1,0,0]=3 2622 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])Cl 7a_200000087117_200025704644 [1,1,0,0,0,0|1,0,0]=3 2623 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])F 34a_100000035349_200025704644 [1,1,0,0,0,0|1,0,0]=3 2624 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])F 7a_100000035349_200025704644 [1,1,0,0,0,0|1,0,0]=3 2625 B11R1.72 Cc1ccc(c(c1F)N[13CH3])Cl 34a_100000062009_200025704644 [1,1,0,0,0,0|2,0,0]=4 2626 B11R1.72 Cc1ccc(c(c1F)N[13CH3])F 2230a_102495364760_200025704644 [1,1,0,0,0,0|2,0,0]=4 2627 B11R1.72 Cc1ccc(c(c1F)N[13CH3])F 34a_102495364760_200025704644 [1,1,0,0,0,0|2,0,0]=4 2628 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Br 34a_100000722096_200025704644 [1,1,0,0,0,0|1,0,0]=3 2629 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Br 7a_100000722096_200025704644 [1,1,0,0,0,0|1,0,0]=3 2630 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Cl 34a_200000034537_200025704644 [1,1,0,0,0,0|1,0,0]=3 2631 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Cl 7a_200000034537_200025704644 [1,1,0,0,0,0|1,0,0]=3 2632 B11R1.72 Cc1ccc(c(c1F)O[13CH3])F 34a_100011216644_200025704644 [1,1,0,0,0,0|1,0,0]=3 2633 B11R1.72 Cc1ccc(c(c1F)O[13CH3])F 7a_100011216644_200025704644 [1,1,0,0,0,0|1,0,0]=3 2634 B11R1.72 Cc1ccc(c(c1O)C#N)F 271570a_203496583355_100000062000 [1,1,0,0,0,0|2,0,0]=4 2635 B11R1.72 Cc1ccc(c(c1O)C=O)F 271570a_203496583355_100000033498 [1,1,0,0,0,0|2,0,0]=4 2636 B11R1.72 Cc1ccc(c(c1O)CO)F 271570a_203496583355_100010365568 [1,1,0,0,0,0|2,0,0]=4 2637 B11R1.72 Cc1ccc(c(c1O[13CH3])Cl)N 34a_100000036876_200025704644 [1,1,0,0,0,0|2,0,0]=4 2638 B11R1.72 Cc1ccc(c(c1O[13CH3])Cl)N 7a_100000036876_200025704644 [1,1,0,0,0,0|2,0,0]=4 2639 B11R1.72 Cc1ccc(c(c1S[13CH3])C)O 62a_100010659238_200025704644 [1,1,0,0,0,0|1,1,0]=4 2640 B11R1.72 Cc1ccc(c(c1S[13CH3])C)O 62a_200025704644_100010659238 [1,1,0,0,0,0|1,1,0]=4 2641 B11R1.72 Cc1ccc(c(c1S[13CH3])O)F 62a_200010223207_200025704644 [1,1,0,0,0,0|1,1,0]=4 2642 B11R1.72 Cc1ccc(c(c1S[13CH3])O)F 62a_200025704644_200010223207 [1,1,0,0,0,0|1,1,0]=4 2643 B11R1.72 O=Cc1c(ccc(c1O)O)O 271570a_203496583355_100010184888 [1,1,0,0,0,0|2,0,0]=4 2644 B11R1.72 [13CH3]Nc1c(ccc(c1Cl)O)Cl 34a_100016988457_200025704644 [1,1,0,0,0,0|2,0,0]=4 2645 B11R1.72 [13CH3]Nc1c(ccc(c1Cl)O)Cl 7a_100016988457_200025704644 [1,1,0,0,0,0|2,0,0]=4 2646 B11R1.72 [13CH3]Oc1c(ccc(c1Br)F)F 34a_100010170822_200025704644 [1,1,0,0,0,0|2,0,0]=4 2647 B11R1.72 [13CH3]Oc1c(ccc(c1Br)F)F 7a_100010170822_200025704644 [1,1,0,0,0,0|2,0,0]=4 2648 B11R1.72 [13CH3]Oc1c(ccc(c1Br)F)N 34a_100010128263_200025704644 [1,1,0,0,0,0|2,0,0]=4 2649 B11R1.72 [13CH3]Oc1c(ccc(c1Br)F)N 7a_100010128263_200025704644 [1,1,0,0,0,0|2,0,0]=4 2650 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Br)Cl 34a_100010089855_200025704644 [1,1,0,0,0,0|2,0,0]=4 2651 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Br)Cl 7a_100010089855_200025704644 [1,1,0,0,0,0|2,0,0]=4 2652 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_200025704644 [1,1,0,0,0,0|2,0,0]=4 2653 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_200025704644 [1,1,0,0,0,0|2,0,0]=4 2654 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Cl)F 34a_100000062035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2655 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)Cl)F 7a_100000062035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2656 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)F)Br 34a_100014979575_200025704644 [1,1,0,0,0,0|2,0,0]=4 2657 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)F)Br 7a_100014979575_200025704644 [1,1,0,0,0,0|2,0,0]=4 2658 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)F)F 34a_100000038336_200025704644 [1,1,0,0,0,0|2,0,0]=4 2659 B11R1.72 [13CH3]Oc1c(ccc(c1Cl)F)F 7a_100000038336_200025704644 [1,1,0,0,0,0|2,0,0]=4 2660 B11R1.72 [13CH3]Oc1c(ccc(c1F)Br)Cl 34a_100010240321_200025704644 [1,1,0,0,0,0|2,0,0]=4 2661 B11R1.72 [13CH3]Oc1c(ccc(c1F)Br)Cl 7a_100010240321_200025704644 [1,1,0,0,0,0|2,0,0]=4 2662 B11R1.72 [13CH3]Oc1c(ccc(c1F)Br)F 34a_100010167067_200025704644 [1,1,0,0,0,0|2,0,0]=4 2663 B11R1.72 [13CH3]Oc1c(ccc(c1F)Br)F 7a_100010167067_200025704644 [1,1,0,0,0,0|2,0,0]=4 2664 B11R1.72 [13CH3]Oc1c(ccc(c1F)Cl)Br 34a_100010081130_200025704644 [1,1,0,0,0,0|2,0,0]=4 2665 B11R1.72 [13CH3]Oc1c(ccc(c1F)Cl)Br 7a_100010081130_200025704644 [1,1,0,0,0,0|2,0,0]=4 2666 B11R1.72 [13CH3]Oc1c(ccc(c1F)Cl)F 34a_100000034634_200025704644 [1,1,0,0,0,0|2,0,0]=4 2667 B11R1.72 [13CH3]Oc1c(ccc(c1F)Cl)F 7a_100000034634_200025704644 [1,1,0,0,0,0|2,0,0]=4 2668 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)Br 34a_100010243909_200025704644 [1,1,0,0,0,0|2,0,0]=4 2669 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)Br 7a_100010243909_200025704644 [1,1,0,0,0,0|2,0,0]=4 2670 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)F 34a_100000031686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2671 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)F 7a_100000031686_200025704644 [1,1,0,0,0,0|2,0,0]=4 2672 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)N 34a_100015205010_200025704644 [1,1,0,0,0,0|2,0,0]=4 2673 B11R1.72 [13CH3]Oc1c(ccc(c1F)F)N 7a_100015205010_200025704644 [1,1,0,0,0,0|2,0,0]=4 2674 B11R1.72 [13CH3]Oc1c(ccc(c1F)I)Br 34a_200010782288_200025704644 [1,1,0,0,0,0|2,0,0]=4 2675 B11R1.72 [13CH3]Oc1c(ccc(c1F)I)Br 7a_200010782288_200025704644 [1,1,0,0,0,0|2,0,0]=4 2676 B11R1.72 [13CH3]Sc1c(ccc(c1O)F)F 62a_100010170822_200025704644 [1,1,0,0,0,0|1,1,0]=4 2677 B11R1.72 [13CH3]Sc1c(ccc(c1O)F)F 62a_200025704644_100010170822 [1,1,0,0,0,0|1,1,0]=4 2678 B11R1.72 [13CH3]Sc1c(ccc(c1O)N)F 62a_100010128263_200025704644 [1,1,0,0,0,0|1,1,0]=4 2679 B11R1.72 [13CH3]Sc1c(ccc(c1O)N)F 62a_200025704644_100010128263 [1,1,0,0,0,0|1,1,0]=4 2680 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,1,0,0,0,0|2,0,0]=4 2681 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [1,1,0,0,0,0|2,0,0]=4 2682 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,1,0,0,0,0|2,0,0]=4 2683 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [1,1,0,0,0,0|2,0,0]=4 2684 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,1,0,0,0,0|2,0,0]=4 2685 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [1,1,0,0,0,0|2,0,0]=4 2686 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,1,0,0,0,0|2,0,0]=4 2687 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [1,1,0,0,0,0|2,0,0]=4 2688 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,1,0,0,0,0|2,0,0]=4 2689 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [1,1,0,0,0,0|2,0,0]=4 2690 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [1,1,0,0,0,0|1,0,0]=3 2691 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [1,1,0,0,0,0|2,0,0]=4 2692 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [1,1,0,0,0,0|2,0,0]=4 2693 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [1,1,0,0,0,0|2,0,0]=4 2694 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,1,0,0,0,0|1,0,0]=3 2695 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [1,1,0,0,0,0|2,0,0]=4 2696 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,1,0,0,0,0|2,0,0]=4 2697 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,1,0,0,0,0|2,0,0]=4 2698 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,1,0,0,0,0|2,0,0]=4 2699 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,1,0,0,0,0|2,0,0]=4 2700 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,1,0,0,0,0|2,0,0]=4 2701 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,1,0,0,0,0|2,0,0]=4 2702 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,1,0,0,0,0|2,0,0]=4 2703 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,1,0,0,0,0|2,0,0]=4 2704 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,1,0,0,0,0|2,0,0]=4 2705 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,1,0,0,0,0|2,0,0]=4 2706 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,1,0,0,0,0|2,0,0]=4 2707 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,1,0,0,0,0|2,0,0]=4 2708 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,1,0,0,0,0|2,0,0]=4 2709 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,1,0,0,0,0|1,0,0]=3 2710 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,1,0,0,0,0|2,0,0]=4 2711 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,1,0,0,0,0|2,0,0]=4 2712 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,1,0,0,0,0|2,0,0]=4 2713 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,1,0,0,0,0|1,0,0]=3 2714 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,1,0,0,0,0|1,0,0]=3 2715 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [1,1,0,0,0,0|2,0,0]=4 2716 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [1,1,0,0,0,0|2,0,0]=4 2717 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,1,0,0,0,0|2,0,0]=4 2718 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,1,0,0,0,0|2,0,0]=4 2719 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,1,0,0,0,0|2,0,0]=4 2720 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,1,0,0,0,0|2,0,0]=4 2721 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,1,0,0,0,0|2,0,0]=4 2722 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,1,0,0,0,0|2,0,0]=4 2723 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,1,0,0,0,0|2,0,0]=4 2724 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,1,0,0,0,0|1,0,0]=3 2725 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,1,0,0,0,0|2,0,0]=4 2726 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,1,0,0,0,0|2,0,0]=4 2727 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,1,0,0,0,0|2,0,0]=4 2728 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,1,0,0,0,0|2,0,0]=4 2729 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,1,0,0,0,0|2,0,0]=4 2730 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,1,0,0,0,0|2,0,0]=4 2731 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,1,0,0,0,0|1,0,0]=3 2733 B11R1.265 C=Cc1c(cccc1CC)C 271570a_100011290941_100000036235 [1,1,0,0,0,0|2,0,0]=4 2734 B11R1.265 C=Cc1c(cccc1OC)Br 271570a_100011290941_100010131421 [1,1,0,0,0,0|2,0,0]=4 2735 B11R1.265 C=Cc1c(cccc1OC)F 271570a_100011290941_100000041735 [1,1,0,0,0,0|2,0,0]=4 2736 B11R1.265 C=Cc1c(cccc1OC)N 271570a_100011290941_100000703447 [1,1,0,0,0,0|2,0,0]=4 2737 B11R1.265 C=Cc1c(cccc1OC)O 271570a_100011290941_100010202623 [1,1,0,0,0,0|1,0,0]=3 2738 B11R1.265 C=Cc1c(ccnc1OC)C 271570a_100011290941_100012353928 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.265 C=Cc1cccc(c1OC)C 271570a_100011290941_100010141385 [1,1,0,0,0,0|1,0,1]=4 2740 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [1,1,0,0,0,0|1,0,1]=4 2741 B11R1.265 CCc1cccc(c1NC)C 2230a_100000210048_200000210301 [1,1,0,0,0,0|2,0,0]=4 2742 B11R1.265 CCc1cccc(c1NC)C 34a_100000210048_200000210301 [1,1,0,0,0,0|2,0,0]=4 2743 B11R1.265 CCc1cccc(c1NC)C 7a_100000210048_200000210301 [1,1,0,0,0,0|2,0,0]=4 2744 B11R1.265 CCc1cccc(c1N[13CH3])C 2230a_100000210048_200025704644 [1,1,0,0,0,0|2,0,0]=4 2745 B11R1.265 CCc1cccc(c1N[13CH3])C 34a_100000210048_200025704644 [1,1,0,0,0,0|2,0,0]=4 2746 B11R1.265 CCc1cccc(c1N[13CH3])C 7a_100000210048_200025704644 [1,1,0,0,0,0|2,0,0]=4 2747 B11R1.265 CCc1cccc(c1OC)Br 34a_200010001580_200000210301 [1,1,0,0,0,0|2,0,0]=4 2748 B11R1.265 CCc1cccc(c1OC)Br 7a_200010001580_200000210301 [1,1,0,0,0,0|2,0,0]=4 2749 B11R1.265 CCc1cccc(c1OC)C 34a_100000034007_200000210301 [1,1,0,0,0,0|1,0,0]=3 2750 B11R1.265 CCc1cccc(c1OC)C 7a_100000034007_200000210301 [1,1,0,0,0,0|1,0,0]=3 2751 B11R1.265 CCc1cccc(c1O[13CH3])Br 34a_200010001580_200025704644 [1,1,0,0,0,0|2,0,0]=4 2752 B11R1.265 CCc1cccc(c1O[13CH3])Br 7a_200010001580_200025704644 [1,1,0,0,0,0|2,0,0]=4 2753 B11R1.265 CCc1cccc(c1O[13CH3])C 34a_100000034007_200025704644 [1,1,0,0,0,0|1,0,0]=3 2754 B11R1.265 CCc1cccc(c1O[13CH3])C 7a_100000034007_200025704644 [1,1,0,0,0,0|1,0,0]=3 2755 B11R1.265 CCc1cccc(c1SC)C 62a_100000036235_200000210301 [1,1,0,0,0,0|1,1,0]=4 2756 B11R1.265 CCc1cccc(c1SC)C 62a_200000210301_100000036235 [1,1,0,0,0,0|1,1,0]=4 2757 B11R1.265 CCc1cccc(c1S[13CH3])C 62a_100000036235_200025704644 [1,1,0,0,0,0|1,1,0]=4 2758 B11R1.265 CCc1cccc(c1S[13CH3])C 62a_200025704644_100000036235 [1,1,0,0,0,0|1,1,0]=4 2759 B11R1.265 CNc1c(cccc1OC)Br 34a_100000708083_200000210301 [1,1,0,0,0,0|2,0,0]=4 2760 B11R1.265 CNc1c(cccc1OC)C 2230a_100000758225_200000210301 [1,1,0,0,0,0|1,0,0]=3 2761 B11R1.265 CNc1c(cccc1OC)C 34a_100000758225_200000210301 [1,1,0,0,0,0|1,0,0]=3 2762 B11R1.265 CNc1c(cccc1OC)Cl 34a_100011309317_200000210301 [1,1,0,0,0,0|2,0,0]=4 2763 B11R1.265 CNc1c(cccc1OC)F 34a_100000686744_200000210301 [1,1,0,0,0,0|2,0,0]=4 2764 B11R1.265 CNc1c(cccc1OC)O 34a_100012022766_200000210301 [1,1,0,0,0,0|1,0,0]=3 2765 B11R1.265 CNc1cccc(c1C#N)C 2230a_100000763283_200000210301 [1,1,0,0,0,0|2,0,0]=4 2766 B11R1.265 CNc1cccc(c1C#N)C 34a_100000763283_200000210301 [1,1,0,0,0,0|2,0,0]=4 2767 B11R1.265 CNc1cccc(c1C#N)C 7a_100000763283_200000210301 [1,1,0,0,0,0|2,0,0]=4 2768 B11R1.265 CNc1cccc(c1C#N)O 271570a_203496583355_200012769483 [1,1,0,0,0,0|2,0,0]=4 2769 B11R1.265 CNc1cccc(c1CO)Br 34a_100000747656_200000210301 [1,1,0,0,0,0|2,0,0]=4 2770 B11R1.265 CNc1cccc(c1CO)Cl 34a_100011916388_200000210301 [1,1,0,0,0,0|2,0,0]=4 2771 B11R1.265 CNc1cccc(c1CO)F 34a_100011846719_200000210301 [1,1,0,0,0,0|2,0,0]=4 2772 B11R1.265 CNc1cccc(c1OC)Br 34a_100011935253_200000210301 [1,1,0,0,0,0|2,0,0]=4 2773 B11R1.265 CNc1cccc(c1OC)C 34a_100012017360_200000210301 [1,1,0,0,0,0|1,0,0]=3 2774 B11R1.265 CNc1cccc(c1OC)Cl 2230a_100000743799_200000210301 [1,1,0,0,0,0|2,0,0]=4 2775 B11R1.265 CNc1cccc(c1OC)Cl 34a_100000743799_200000210301 [1,1,0,0,0,0|2,0,0]=4 2776 B11R1.265 CNc1cccc(c1OC)F 34a_100011215007_200000210301 [1,1,0,0,0,0|2,0,0]=4 2777 B11R1.265 COc1c(cccc1C#N)C 34a_100011659161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2778 B11R1.265 COc1c(cccc1C#N)C 7a_100011659161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2779 B11R1.265 COc1c(cccc1C#N)O 271570a_203496583355_100009817008 [1,1,0,0,0,0|2,0,0]=4 2780 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [1,1,0,0,0,0|2,0,0]=4 2781 B11R1.265 COc1c(cccc1CN)C 34a_100020639391_200000210301 [1,1,0,0,0,0|2,0,0]=4 2782 B11R1.265 COc1c(cccc1CO)O 271570a_203496583355_100000704359 [1,1,0,0,0,0|2,0,0]=4 2783 B11R1.265 COc1c(cccc1N[13CH3])Br 34a_100011935253_200025704644 [1,1,0,0,0,0|2,0,0]=4 2784 B11R1.265 COc1c(cccc1N[13CH3])C 34a_100012017360_200025704644 [1,1,0,0,0,0|1,0,0]=3 2785 B11R1.265 COc1c(cccc1N[13CH3])Cl 2230a_100000743799_200025704644 [1,1,0,0,0,0|2,0,0]=4 2786 B11R1.265 COc1c(cccc1N[13CH3])Cl 34a_100000743799_200025704644 [1,1,0,0,0,0|2,0,0]=4 2787 B11R1.265 COc1c(cccc1N[13CH3])F 34a_100011215007_200025704644 [1,1,0,0,0,0|2,0,0]=4 2788 B11R1.265 COc1c(cccc1O[13CH3])Br 34a_100010234590_200025704644 [1,1,0,0,0,0|1,0,0]=3 2789 B11R1.265 COc1c(cccc1O[13CH3])Cl 34a_200009886253_200025704644 [1,1,0,0,0,0|1,0,0]=3 2790 B11R1.265 COc1c(cccc1O[13CH3])Cl 7a_200009886253_200025704644 [1,1,0,0,0,0|1,0,0]=3 2791 B11R1.265 COc1c(cccc1SC)Br 62a_100010146560_200000210301 [1,1,0,0,0,0|1,1,0]=4 2792 B11R1.265 COc1c(cccc1SC)Br 62a_200000210301_100010146560 [1,1,0,0,0,0|1,1,0]=4 2793 B11R1.265 COc1c(cccc1SC)C 62a_100010141385_200000210301 [1,1,0,0,0,0|0,1,0]=3 2794 B11R1.265 COc1c(cccc1SC)C 62a_200000210301_100010141385 [1,1,0,0,0,0|0,1,0]=3 2795 B11R1.265 COc1c(cccc1SC)Cl 62a_100010147678_200000210301 [1,1,0,0,0,0|1,1,0]=4 2796 B11R1.265 COc1c(cccc1SC)Cl 62a_200000210301_100010147678 [1,1,0,0,0,0|1,1,0]=4 2797 B11R1.265 COc1c(cccc1SC)F 62a_100009816759_200000210301 [1,1,0,0,0,0|1,1,0]=4 2798 B11R1.265 COc1c(cccc1SC)F 62a_200000210301_100009816759 [1,1,0,0,0,0|1,1,0]=4 2799 B11R1.265 COc1c(cccc1SC)N 62a_100011935253_200000210301 [1,1,0,0,0,0|1,1,0]=4 2800 B11R1.265 COc1c(cccc1SC)O 62a_200000210301_100010234590 [1,1,0,0,0,0|0,1,0]=3 2801 B11R1.265 COc1c(cccc1S[13CH3])Br 62a_100010146560_200025704644 [1,1,0,0,0,0|1,1,0]=4 2802 B11R1.265 COc1c(cccc1S[13CH3])Br 62a_200025704644_100010146560 [1,1,0,0,0,0|1,1,0]=4 2803 B11R1.265 COc1c(cccc1S[13CH3])C 62a_100010141385_200025704644 [1,1,0,0,0,0|0,1,0]=3 2804 B11R1.265 COc1c(cccc1S[13CH3])C 62a_200025704644_100010141385 [1,1,0,0,0,0|0,1,0]=3 2805 B11R1.265 COc1c(cccc1S[13CH3])Cl 62a_100010147678_200025704644 [1,1,0,0,0,0|1,1,0]=4 2806 B11R1.265 COc1c(cccc1S[13CH3])Cl 62a_200025704644_100010147678 [1,1,0,0,0,0|1,1,0]=4 2807 B11R1.265 COc1c(cccc1S[13CH3])F 62a_100009816759_200025704644 [1,1,0,0,0,0|1,1,0]=4 2808 B11R1.265 COc1c(cccc1S[13CH3])F 62a_200025704644_100009816759 [1,1,0,0,0,0|1,1,0]=4 2809 B11R1.265 COc1c(cccc1S[13CH3])N 62a_100011935253_200025704644 [1,1,0,0,0,0|1,1,0]=4 2810 B11R1.265 COc1c(cccc1S[13CH3])O 62a_200025704644_100010234590 [1,1,0,0,0,0|0,1,0]=3 2811 B11R1.265 COc1c(ccnc1C)SC 62a_100000685116_200000210301 [1,1,0,0,0,0|1,1,0]=4 2812 B11R1.265 COc1c(ccnc1C)SC 62a_200000210301_100000685116 [1,1,0,0,0,0|1,1,0]=4 2813 B11R1.265 COc1c(ccnc1C)S[13CH3] 62a_100000685116_200025704644 [1,1,0,0,0,0|1,1,0]=4 2814 B11R1.265 COc1c(ccnc1C)S[13CH3] 62a_200025704644_100000685116 [1,1,0,0,0,0|1,1,0]=4 2815 B11R1.265 COc1c(ccnc1Cl)O[13CH3] 34a_100000104430_200025704644 [1,1,0,0,0,0|2,0,0]=4 2816 B11R1.265 COc1c(ccnc1SC)O 62a_200000210301_100000104430 [1,1,0,0,0,0|1,1,0]=4 2817 B11R1.265 COc1c(ccnc1S[13CH3])O 62a_200025704644_100000104430 [1,1,0,0,0,0|1,1,0]=4 2818 B11R1.265 COc1cccc(c1C#N)Br 34a_100012180507_200000210301 [1,1,0,0,0,0|2,0,0]=4 2819 B11R1.265 COc1cccc(c1C#N)Br 7a_100012180507_200000210301 [1,1,0,0,0,0|2,0,0]=4 2820 B11R1.265 COc1cccc(c1C#N)C 34a_100000079363_200000210301 [1,1,0,0,0,0|1,0,0]=3 2821 B11R1.265 COc1cccc(c1C#N)C 7a_100000079363_200000210301 [1,1,0,0,0,0|1,0,0]=3 2822 B11R1.265 COc1cccc(c1C#N)Cl 34a_100000764475_200000210301 [1,1,0,0,0,0|2,0,0]=4 2823 B11R1.265 COc1cccc(c1C#N)Cl 7a_100000764475_200000210301 [1,1,0,0,0,0|2,0,0]=4 2824 B11R1.265 COc1cccc(c1C#N)F 34a_100000741147_200000210301 [1,1,0,0,0,0|2,0,0]=4 2825 B11R1.265 COc1cccc(c1C#N)F 7a_100000741147_200000210301 [1,1,0,0,0,0|2,0,0]=4 2826 B11R1.265 COc1cccc(c1C#N)O 271570a_203496583355_100012356440 [1,1,0,0,0,0|1,0,0]=3 2827 B11R1.265 COc1cccc(c1C=O)O 271570a_203496583355_100009814803 [1,1,0,0,0,0|0,0,1]=3 2828 B11R1.265 COc1cccc(c1CO)C 34a_200009874777_200000210301 [1,1,0,0,0,0|0,0,0]=2 2829 B11R1.265 COc1cccc(c1CO)C 7a_200009874777_200000210301 [1,1,0,0,0,0|0,0,0]=2 2830 B11R1.265 COc1cccc(c1N[13CH3])Br 34a_100000708083_200025704644 [1,1,0,0,0,0|2,0,0]=4 2831 B11R1.265 COc1cccc(c1N[13CH3])C 2230a_100000758225_200025704644 [1,1,0,0,0,0|1,0,0]=3 2832 B11R1.265 COc1cccc(c1N[13CH3])C 34a_100000758225_200025704644 [1,1,0,0,0,0|1,0,0]=3 2833 B11R1.265 COc1cccc(c1N[13CH3])Cl 34a_100011309317_200025704644 [1,1,0,0,0,0|2,0,0]=4 2834 B11R1.265 COc1cccc(c1N[13CH3])F 34a_100000686744_200025704644 [1,1,0,0,0,0|2,0,0]=4 2835 B11R1.265 COc1cccc(c1N[13CH3])O 34a_100012022766_200025704644 [1,1,0,0,0,0|1,0,0]=3 2836 B11R1.265 COc1cccc(c1OC)Br 34a_100000686866_200000210301 [1,1,0,0,0,0|1,0,0]=3 2837 B11R1.265 COc1cccc(c1OC)Br 34a_100010234590_200000210301 [1,1,0,0,0,0|1,0,0]=3 2838 B11R1.265 COc1cccc(c1OC)C 34a_100011219253_200000210301 [1,1,0,0,0,0|0,0,0]=2 2839 B11R1.265 COc1cccc(c1OC)C 7a_100011219253_200000210301 [1,1,0,0,0,0|0,0,0]=2 2840 B11R1.265 COc1cccc(c1OC)Cl 34a_100009851661_200000210301 [1,1,0,0,0,0|1,0,0]=3 2841 B11R1.265 COc1cccc(c1OC)Cl 34a_200009886253_200000210301 [1,1,0,0,0,0|1,0,0]=3 2842 B11R1.265 COc1cccc(c1OC)Cl 7a_100009851661_200000210301 [1,1,0,0,0,0|1,0,0]=3 2843 B11R1.265 COc1cccc(c1OC)Cl 7a_200009886253_200000210301 [1,1,0,0,0,0|1,0,0]=3 2844 B11R1.265 COc1cccc(c1OC)F 34a_100000036725_200000210301 [1,1,0,0,0,0|1,0,0]=3 2845 B11R1.265 COc1cccc(c1OC)F 7a_100000036725_200000210301 [1,1,0,0,0,0|1,0,0]=3 2846 B11R1.265 COc1cccc(c1OC)N 34a_100000123586_200000210301 [1,1,0,0,0,0|1,0,0]=3 2847 B11R1.265 COc1cccc(c1OC)O 271570a_203496583355_100009815961 [1,1,0,0,0,0|0,0,0]=2 2848 B11R1.265 COc1cccc(c1O[13CH3])Br 34a_100000686866_200025704644 [1,1,0,0,0,0|1,0,0]=3 2849 B11R1.265 COc1cccc(c1O[13CH3])C 34a_100011219253_200025704644 [1,1,0,0,0,0|0,0,0]=2 2850 B11R1.265 COc1cccc(c1O[13CH3])C 7a_100011219253_200025704644 [1,1,0,0,0,0|0,0,0]=2 2851 B11R1.265 COc1cccc(c1O[13CH3])Cl 34a_100009851661_200025704644 [1,1,0,0,0,0|1,0,0]=3 2852 B11R1.265 COc1cccc(c1O[13CH3])Cl 7a_100009851661_200025704644 [1,1,0,0,0,0|1,0,0]=3 2853 B11R1.265 COc1cccc(c1O[13CH3])F 34a_100000036725_200025704644 [1,1,0,0,0,0|1,0,0]=3 2854 B11R1.265 COc1cccc(c1O[13CH3])F 7a_100000036725_200025704644 [1,1,0,0,0,0|1,0,0]=3 2855 B11R1.265 COc1cccc(c1O[13CH3])N 34a_100000123586_200025704644 [1,1,0,0,0,0|1,0,0]=3 2856 B11R1.265 COc1cccc(c1SC)Br 62a_100010131421_200000210301 [1,1,0,0,0,0|1,1,0]=4 2857 B11R1.265 COc1cccc(c1SC)Br 62a_200000210301_100010131421 [1,1,0,0,0,0|1,1,0]=4 2858 B11R1.265 COc1cccc(c1SC)C 34a_200000099257_200000210301 [1,1,0,0,0,0|0,1,0]=3 2859 B11R1.265 COc1cccc(c1SC)C 62a_100010191535_200000210301 [1,1,0,0,0,0|0,1,0]=3 2860 B11R1.265 COc1cccc(c1SC)C 62a_200000210301_100010191535 [1,1,0,0,0,0|0,1,0]=3 2861 B11R1.265 COc1cccc(c1SC)C 7a_200000099257_200000210301 [1,1,0,0,0,0|0,1,0]=3 2862 B11R1.265 COc1cccc(c1SC)F 62a_100000703912_200000210301 [1,1,0,0,0,0|1,1,0]=4 2863 B11R1.265 COc1cccc(c1SC)F 62a_200000210301_100000703912 [1,1,0,0,0,0|1,1,0]=4 2864 B11R1.265 COc1cccc(c1SC)N 62a_100000703447_200000210301 [1,1,0,0,0,0|1,1,0]=4 2865 B11R1.265 COc1cccc(c1SC)N 62a_200000210301_100000703447 [1,1,0,0,0,0|1,1,0]=4 2866 B11R1.265 COc1cccc(c1SC)O 62a_200000210301_100010202623 [1,1,0,0,0,0|0,1,0]=3 2867 B11R1.265 COc1cccc(c1S[13CH3])Br 62a_100010131421_200025704644 [1,1,0,0,0,0|1,1,0]=4 2868 B11R1.265 COc1cccc(c1S[13CH3])Br 62a_200025704644_100010131421 [1,1,0,0,0,0|1,1,0]=4 2869 B11R1.265 COc1cccc(c1S[13CH3])C 62a_100010191535_200025704644 [1,1,0,0,0,0|0,1,0]=3 2870 B11R1.265 COc1cccc(c1S[13CH3])C 62a_200025704644_100010191535 [1,1,0,0,0,0|0,1,0]=3 2871 B11R1.265 COc1cccc(c1S[13CH3])F 62a_100000703912_200025704644 [1,1,0,0,0,0|1,1,0]=4 2872 B11R1.265 COc1cccc(c1S[13CH3])F 62a_200025704644_100000703912 [1,1,0,0,0,0|1,1,0]=4 2873 B11R1.265 COc1cccc(c1S[13CH3])N 62a_100000703447_200025704644 [1,1,0,0,0,0|1,1,0]=4 2874 B11R1.265 COc1cccc(c1S[13CH3])N 62a_200025704644_100000703447 [1,1,0,0,0,0|1,1,0]=4 2875 B11R1.265 COc1cccc(c1S[13CH3])O 62a_200025704644_100010202623 [1,1,0,0,0,0|0,1,0]=3 2876 B11R1.265 COc1ccnc(c1C#N)O 271570a_203496583355_100000047147 [1,1,0,0,0,0|2,0,0]=4 2877 B11R1.265 COc1ccnc(c1C=O)O 271570a_203496583355_100009860067 [1,1,0,0,0,0|1,0,1]=4 2878 B11R1.265 COc1ccnc(c1OC)Cl 34a_100000104430_200000210301 [1,1,0,0,0,0|2,0,0]=4 2879 B11R1.265 COc1nccc(c1C#N)O 271570a_203496583355_200009870389 [1,1,0,0,0,0|2,0,0]=4 2880 B11R1.265 COc1nccc(c1C=O)O 271570a_203496583355_100010160771 [1,1,0,0,0,0|1,0,1]=4 2881 B11R1.265 COc1nccc(c1SC)C 62a_100012353928_200000210301 [1,1,0,0,0,0|1,1,0]=4 2882 B11R1.265 COc1nccc(c1SC)C 62a_200000210301_100012353928 [1,1,0,0,0,0|1,1,0]=4 2883 B11R1.265 COc1nccc(c1S[13CH3])C 62a_100012353928_200025704644 [1,1,0,0,0,0|1,1,0]=4 2884 B11R1.265 COc1nccc(c1S[13CH3])C 62a_200025704644_100012353928 [1,1,0,0,0,0|1,1,0]=4 2885 B11R1.265 COc1ncnc(c1OC)O 271570a_203496583355_100012964862 [1,1,0,0,0,0|2,0,0]=4 2886 B11R1.265 CSc1c(cccc1O[13CH3])C 34a_200000099257_200025704644 [1,1,0,0,0,0|0,1,0]=3 2887 B11R1.265 CSc1c(cccc1O[13CH3])C 7a_200000099257_200025704644 [1,1,0,0,0,0|0,1,0]=3 2888 B11R1.265 CSc1cccc(c1C#N)C 62a_200000210301_100009819585 [1,1,0,0,0,0|1,1,0]=4 2889 B11R1.265 CSc1cccc(c1C#N)O 62a_200000210301_100012180507 [1,1,0,0,0,0|1,1,0]=4 2890 B11R1.265 CSc1cccc(c1C=O)C 62a_100000041122_200000210301 [1,1,0,0,0,0|0,1,1]=4 2891 B11R1.265 CSc1cccc(c1C=O)C 62a_200000210301_100000041122 [1,1,0,0,0,0|0,1,1]=4 2892 B11R1.265 CSc1cccc(c1C=O)O 62a_200000210301_100010193437 [1,1,0,0,0,0|0,1,1]=4 2893 B11R1.265 CSc1cccc(c1CO)F 62a_100012355691_200000210301 [1,1,0,0,0,0|1,1,0]=4 2894 B11R1.265 CSc1cccc(c1CO)F 62a_200000210301_100012355691 [1,1,0,0,0,0|1,1,0]=4 2895 B11R1.265 CSc1cccc(c1CO)N 62a_100000747656_200000210301 [1,1,0,0,0,0|1,1,0]=4 2896 B11R1.265 CSc1cccc(c1CO)N 62a_200000210301_100000747656 [1,1,0,0,0,0|1,1,0]=4 2897 B11R1.265 Cc1cccc(c1C#N)N[13CH3] 2230a_100000763283_200025704644 [1,1,0,0,0,0|2,0,0]=4 2898 B11R1.265 Cc1cccc(c1C#N)N[13CH3] 34a_100000763283_200025704644 [1,1,0,0,0,0|2,0,0]=4 2899 B11R1.265 Cc1cccc(c1C#N)N[13CH3] 7a_100000763283_200025704644 [1,1,0,0,0,0|2,0,0]=4 2900 B11R1.265 Cc1cccc(c1C#N)O[13CH3] 34a_100000079363_200025704644 [1,1,0,0,0,0|1,0,0]=3 2901 B11R1.265 Cc1cccc(c1C#N)O[13CH3] 7a_100000079363_200025704644 [1,1,0,0,0,0|1,0,0]=3 2902 B11R1.265 Cc1cccc(c1C#N)S[13CH3] 62a_200025704644_100009819585 [1,1,0,0,0,0|1,1,0]=4 2903 B11R1.265 Cc1cccc(c1C=O)S[13CH3] 62a_100000041122_200025704644 [1,1,0,0,0,0|0,1,1]=4 2904 B11R1.265 Cc1cccc(c1C=O)S[13CH3] 62a_200025704644_100000041122 [1,1,0,0,0,0|0,1,1]=4 2905 B11R1.265 Cc1cccc(c1CO)O[13CH3] 34a_200009874777_200025704644 [1,1,0,0,0,0|0,0,0]=2 2906 B11R1.265 Cc1cccc(c1CO)O[13CH3] 7a_200009874777_200025704644 [1,1,0,0,0,0|0,0,0]=2 2907 B11R1.265 Cc1cccc(c1O[13CH3])C#N 34a_100011659161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2908 B11R1.265 Cc1cccc(c1O[13CH3])C#N 7a_100011659161_200025704644 [1,1,0,0,0,0|2,0,0]=4 2909 B11R1.265 Cc1cccc(c1O[13CH3])CN 34a_100020639391_200025704644 [1,1,0,0,0,0|2,0,0]=4 2910 B11R1.265 [13CH3]Nc1cccc(c1CO)Br 34a_100000747656_200025704644 [1,1,0,0,0,0|2,0,0]=4 2911 B11R1.265 [13CH3]Nc1cccc(c1CO)Cl 34a_100011916388_200025704644 [1,1,0,0,0,0|2,0,0]=4 2912 B11R1.265 [13CH3]Nc1cccc(c1CO)F 34a_100011846719_200025704644 [1,1,0,0,0,0|2,0,0]=4 2913 B11R1.265 [13CH3]Oc1cccc(c1C#N)Br 34a_100012180507_200025704644 [1,1,0,0,0,0|2,0,0]=4 2914 B11R1.265 [13CH3]Oc1cccc(c1C#N)Br 7a_100012180507_200025704644 [1,1,0,0,0,0|2,0,0]=4 2915 B11R1.265 [13CH3]Oc1cccc(c1C#N)Cl 34a_100000764475_200025704644 [1,1,0,0,0,0|2,0,0]=4 2916 B11R1.265 [13CH3]Oc1cccc(c1C#N)Cl 7a_100000764475_200025704644 [1,1,0,0,0,0|2,0,0]=4 2917 B11R1.265 [13CH3]Oc1cccc(c1C#N)F 34a_100000741147_200025704644 [1,1,0,0,0,0|2,0,0]=4 2918 B11R1.265 [13CH3]Oc1cccc(c1C#N)F 7a_100000741147_200025704644 [1,1,0,0,0,0|2,0,0]=4 2919 B11R1.265 [13CH3]Sc1cccc(c1C#N)O 62a_200025704644_100012180507 [1,1,0,0,0,0|1,1,0]=4 2920 B11R1.265 [13CH3]Sc1cccc(c1C=O)O 62a_200025704644_100010193437 [1,1,0,0,0,0|0,1,1]=4 2921 B11R1.265 [13CH3]Sc1cccc(c1CO)F 62a_100012355691_200025704644 [1,1,0,0,0,0|1,1,0]=4 2922 B11R1.265 [13CH3]Sc1cccc(c1CO)F 62a_200025704644_100012355691 [1,1,0,0,0,0|1,1,0]=4 2923 B11R1.265 [13CH3]Sc1cccc(c1CO)N 62a_100000747656_200025704644 [1,1,0,0,0,0|1,1,0]=4 2924 B11R1.265 [13CH3]Sc1cccc(c1CO)N 62a_200025704644_100000747656 [1,1,0,0,0,0|1,1,0]=4 2925 B11R1.278 C=Cc1ccc(c(c1O)C)F 271570a_100011290941_200010391124 [1,1,0,0,0,0|1,0,1]=4 2926 B11R1.278 CNc1ccc(c(c1C)C)Br 2230a_100009816967_200000210301 [1,1,0,0,0,0|2,0,0]=4 2927 B11R1.278 CNc1ccc(c(c1C)C)Br 34a_100009816967_200000210301 [1,1,0,0,0,0|2,0,0]=4 2928 B11R1.278 CNc1ccc(c(c1C)C)Br 7a_100009816967_200000210301 [1,1,0,0,0,0|2,0,0]=4 2929 B11R1.278 CNc1ccc(c(c1C)C)C 2230a_100000116900_200000210301 [1,1,0,0,0,0|2,0,0]=4 2930 B11R1.278 CNc1ccc(c(c1C)C)C 34a_100000116900_200000210301 [1,1,0,0,0,0|2,0,0]=4 2931 B11R1.278 CNc1ccc(c(c1C)C)C 7a_100000116900_200000210301 [1,1,0,0,0,0|2,0,0]=4 2932 B11R1.278 CNc1ccc(c(c1C)C)F 2230a_100000062172_200000210301 [1,1,0,0,0,0|2,0,0]=4 2933 B11R1.278 CNc1ccc(c(c1C)C)F 34a_100000062172_200000210301 [1,1,0,0,0,0|2,0,0]=4 2934 B11R1.278 CNc1ccc(c(c1C)C)F 7a_100000062172_200000210301 [1,1,0,0,0,0|2,0,0]=4 2935 B11R1.278 CNc1ccc(c(c1C)C)O 34a_200011216674_200000210301 [1,1,0,0,0,0|2,0,0]=4 2936 B11R1.278 CNc1ccc(c(c1C)C)O 7a_200011216674_200000210301 [1,1,0,0,0,0|2,0,0]=4 2937 B11R1.278 CNc1ccc(c(c1Cl)C)Cl 34a_100011935240_200000210301 [1,1,0,0,0,0|2,0,0]=4 2938 B11R1.278 CNc1ccc(c(c1Cl)C)Cl 7a_100011935240_200000210301 [1,1,0,0,0,0|2,0,0]=4 2939 B11R1.278 CNc1ccc(c(c1Cl)C)F 2230a_100009863382_200000210301 [1,1,0,0,0,0|2,0,0]=4 2940 B11R1.278 CNc1ccc(c(c1Cl)C)F 34a_100009863382_200000210301 [1,1,0,0,0,0|2,0,0]=4 2941 B11R1.278 CNc1ccc(c(c1Cl)C)F 7a_100009863382_200000210301 [1,1,0,0,0,0|2,0,0]=4 2942 B11R1.278 CNc1ccc(c(c1Cl)O)C 34a_100000036876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2943 B11R1.278 CNc1ccc(c(c1Cl)O)C 7a_100000036876_200000210301 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.278 CNc1ccc(c(c1F)C)Br 2230a_100000722916_200000210301 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.278 CNc1ccc(c(c1F)C)Br 34a_100000722916_200000210301 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.278 CNc1ccc(c(c1F)C)Br 7a_100000722916_200000210301 [1,1,0,0,0,0|2,0,0]=4 2947 B11R1.278 CNc1ccc(c(c1F)C)F 2230a_102495366501_200000210301 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.278 CNc1ccc(c(c1F)C)F 34a_102495366501_200000210301 [1,1,0,0,0,0|2,0,0]=4 2949 B11R1.278 CNc1ccc(c(c1F)C)F 7a_102495366501_200000210301 [1,1,0,0,0,0|2,0,0]=4 2950 B11R1.278 CNc1ccc(c(c1F)C)O 34a_200000126710_200000210301 [1,1,0,0,0,0|2,0,0]=4 2951 B11R1.278 CNc1ccc(c(c1F)C)O 7a_200000126710_200000210301 [1,1,0,0,0,0|2,0,0]=4 2952 B11R1.278 CNc1ccc(c(c1O)Br)F 34a_100010128263_200000210301 [1,1,0,0,0,0|2,0,0]=4 2953 B11R1.278 CNc1ccc(c(c1O)F)F 34a_100015205010_200000210301 [1,1,0,0,0,0|2,0,0]=4 2954 B11R1.278 COc1ccc(c(c1C)Br)C 34a_100010659238_200000210301 [1,1,0,0,0,0|2,0,0]=4 2955 B11R1.278 COc1ccc(c(c1C)Br)C 7a_100010659238_200000210301 [1,1,0,0,0,0|2,0,0]=4 2956 B11R1.278 COc1ccc(c(c1C)C)Br 34a_100012353674_200000210301 [1,1,0,0,0,0|1,0,0]=3 2957 B11R1.278 COc1ccc(c(c1C)C)Br 7a_100012353674_200000210301 [1,1,0,0,0,0|1,0,0]=3 2958 B11R1.278 COc1ccc(c(c1C)C)F 34a_100009847123_200000210301 [1,1,0,0,0,0|1,0,0]=3 2959 B11R1.278 COc1ccc(c(c1C)C)F 7a_100009847123_200000210301 [1,1,0,0,0,0|1,0,0]=3 2960 B11R1.278 COc1ccc(c(c1C)C)I 34a_100011356951_200000210301 [1,1,0,0,0,0|1,0,0]=3 2961 B11R1.278 COc1ccc(c(c1C)C)I 7a_100011356951_200000210301 [1,1,0,0,0,0|1,0,0]=3 2962 B11R1.278 COc1ccc(c(c1C)C)N 34a_200011216674_200000210301 [1,1,0,0,0,0|1,0,0]=3 2963 B11R1.278 COc1ccc(c(c1C)C)N 7a_200011216674_200000210301 [1,1,0,0,0,0|1,0,0]=3 2964 B11R1.278 COc1ccc(c(c1C)C)O 271570a_203496583355_100000049725 [1,1,0,0,0,0|1,0,0]=3 2965 B11R1.278 COc1ccc(c(c1C)F)Br 34a_100010390934_200000210301 [1,1,0,0,0,0|2,0,0]=4 2966 B11R1.278 COc1ccc(c(c1C)F)Br 7a_100010390934_200000210301 [1,1,0,0,0,0|2,0,0]=4 2967 B11R1.278 COc1ccc(c(c1C)F)N 34a_200000126710_200000210301 [1,1,0,0,0,0|2,0,0]=4 2968 B11R1.278 COc1ccc(c(c1C)F)N 7a_200000126710_200000210301 [1,1,0,0,0,0|2,0,0]=4 2969 B11R1.278 COc1ccc(c(c1C)O)C 271570a_203496583355_100016151084 [1,1,0,0,0,0|1,0,0]=3 2970 B11R1.278 COc1ccc(c(c1Cl)C)Br 34a_100021574527_200000210301 [1,1,0,0,0,0|1,0,0]=3 2971 B11R1.278 COc1ccc(c(c1Cl)C)Br 7a_100021574527_200000210301 [1,1,0,0,0,0|1,0,0]=3 2972 B11R1.278 COc1ccc(c(c1Cl)Cl)Br 34a_100011988769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2973 B11R1.278 COc1ccc(c(c1Cl)Cl)Br 7a_100011988769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2974 B11R1.278 COc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_200000210301 [1,1,0,0,0,0|2,0,0]=4 2975 B11R1.278 COc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_200000210301 [1,1,0,0,0,0|2,0,0]=4 2976 B11R1.278 COc1ccc(c(c1Cl)Cl)N 34a_100012017499_200000210301 [1,1,0,0,0,0|2,0,0]=4 2977 B11R1.278 COc1ccc(c(c1Cl)Cl)N 7a_100012017499_200000210301 [1,1,0,0,0,0|2,0,0]=4 2978 B11R1.278 COc1ccc(c(c1Cl)F)Br 34a_100010245746_200000210301 [1,1,0,0,0,0|2,0,0]=4 2979 B11R1.278 COc1ccc(c(c1Cl)F)Br 7a_100010245746_200000210301 [1,1,0,0,0,0|2,0,0]=4 2980 B11R1.278 COc1ccc(c(c1Cl)F)N 34a_200000098347_200000210301 [1,1,0,0,0,0|2,0,0]=4 2981 B11R1.278 COc1ccc(c(c1Cl)F)N 7a_200000098347_200000210301 [1,1,0,0,0,0|2,0,0]=4 2982 B11R1.278 COc1ccc(c(c1Cl)N)Cl 34a_100016988457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2983 B11R1.278 COc1ccc(c(c1Cl)N)Cl 7a_100016988457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2984 B11R1.278 COc1ccc(c(c1F)F)Br 34a_100011830415_200000210301 [1,1,0,0,0,0|2,0,0]=4 2985 B11R1.278 COc1ccc(c(c1F)F)Br 7a_100011830415_200000210301 [1,1,0,0,0,0|2,0,0]=4 2986 B11R1.278 COc1ccc(c(c1F)F)C 34a_100000036877_200000210301 [1,1,0,0,0,0|2,0,0]=4 2987 B11R1.278 COc1ccc(c(c1F)F)C 7a_100000036877_200000210301 [1,1,0,0,0,0|2,0,0]=4 2988 B11R1.278 COc1ccc(c(c1F)F)F 34a_100000230025_200000210301 [1,1,0,0,0,0|2,0,0]=4 2989 B11R1.278 COc1ccc(c(c1F)F)F 7a_100000230025_200000210301 [1,1,0,0,0,0|2,0,0]=4 2990 B11R1.278 COc1ccc(c(c1F)F)I 34a_200011356956_200000210301 [1,1,0,0,0,0|2,0,0]=4 2991 B11R1.278 COc1ccc(c(c1F)F)I 7a_200011356956_200000210301 [1,1,0,0,0,0|2,0,0]=4 2992 B11R1.278 COc1ccc(c(c1F)F)N 34a_100015204651_200000210301 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.278 COc1ccc(c(c1F)F)N 7a_100015204651_200000210301 [1,1,0,0,0,0|2,0,0]=4 2994 B11R1.278 COc1ccc(c(c1F)F)O 271570a_203496583355_100009816879 [1,1,0,0,0,0|2,0,0]=4 2995 B11R1.278 COc1ccc(c(c1F)O)F 271570a_203496583355_100010946477 [1,1,0,0,0,0|1,0,0]=3 2996 B11R1.278 COc1ccc(c(c1N)C)Br 34a_100013039247_200000210301 [1,1,0,0,0,0|1,0,0]=3 2997 B11R1.278 COc1ccc(c(c1N)C)Br 7a_100013039247_200000210301 [1,1,0,0,0,0|1,0,0]=3 2998 B11R1.278 COc1ccc(c(c1O)F)F 271570a_203496583355_100010204329 [1,1,0,0,0,0|1,0,0]=3 2999 B11R1.278 COc1ncc(c(c1Br)C)Cl 34a_200010175591_200000210301 [1,1,0,0,0,0|2,0,0]=4 3000 B11R1.278 COc1ncc(c(c1C)C)Br 34a_200011099879_200000210301 [1,1,0,0,0,0|2,0,0]=4 3001 B11R1.278 COc1ncc(c(c1N)C)O 271570a_203496583355_100010380692 [1,1,0,0,0,0|2,0,0]=4 3002 B11R1.278 CSc1ccc(c(c1C)C)Br 62a_200000210301_200010185626 [1,1,0,0,0,0|1,1,0]=4 3003 B11R1.278 CSc1ccc(c(c1C)C)Br 62a_200010185626_200000210301 [1,1,0,0,0,0|1,1,0]=4 3004 B11R1.278 CSc1ccc(c(c1C)C)F 62a_100009816033_200000210301 [1,1,0,0,0,0|1,1,0]=4 3005 B11R1.278 CSc1ccc(c(c1C)C)F 62a_200000210301_100009816033 [1,1,0,0,0,0|1,1,0]=4 3006 B11R1.278 CSc1ccc(c(c1C)C)N 62a_100009816967_200000210301 [1,1,0,0,0,0|1,1,0]=4 3007 B11R1.278 CSc1ccc(c(c1C)C)N 62a_200000210301_100009816967 [1,1,0,0,0,0|1,1,0]=4 3008 B11R1.278 CSc1ccc(c(c1C)C)O 62a_100012353674_200000210301 [1,1,0,0,0,0|1,1,0]=4 3009 B11R1.278 CSc1ccc(c(c1C)C)O 62a_200000210301_100012353674 [1,1,0,0,0,0|1,1,0]=4 3010 B11R1.278 CSc1ccc(c(c1Cl)C)Br 62a_100055076181_200000210301 [1,1,0,0,0,0|1,1,0]=4 3011 B11R1.278 CSc1ccc(c(c1Cl)C)Br 62a_200000210301_100055076181 [1,1,0,0,0,0|1,1,0]=4 3012 B11R1.278 CSc1ccc(c(c1Cl)C)Cl 62a_100010730154_200000210301 [1,1,0,0,0,0|1,1,0]=4 3013 B11R1.278 CSc1ccc(c(c1Cl)C)Cl 62a_200000210301_100010730154 [1,1,0,0,0,0|1,1,0]=4 3014 B11R1.278 CSc1ccc(c(c1F)C)C 62a_200000210301_200015555822 [1,1,0,0,0,0|1,1,0]=4 3015 B11R1.278 CSc1ccc(c(c1F)C)C 62a_200015555822_200000210301 [1,1,0,0,0,0|1,1,0]=4 3016 B11R1.278 CSc1ccc(c(c1F)C)F 62a_100009815987_200000210301 [1,1,0,0,0,0|1,1,0]=4 3017 B11R1.278 CSc1ccc(c(c1F)C)F 62a_200000210301_100009815987 [1,1,0,0,0,0|1,1,0]=4 3018 B11R1.278 CSc1ccc(c(c1F)C)N 62a_100010208198_200000210301 [1,1,0,0,0,0|1,1,0]=4 3019 B11R1.278 CSc1ccc(c(c1F)C)N 62a_200000210301_100010208198 [1,1,0,0,0,0|1,1,0]=4 3020 B11R1.278 CSc1ccc(c(c1F)C)O 271570a_203496583355_202125771832 [1,1,0,0,0,0|1,1,0]=4 3021 B11R1.278 CSc1ccc(c(c1F)C)O 62a_100010390934_200000210301 [1,1,0,0,0,0|1,1,0]=4 3022 B11R1.278 CSc1ccc(c(c1F)C)O 62a_200000210301_100010390934 [1,1,0,0,0,0|1,1,0]=4 3023 B11R1.278 CSc1ccc(c(c1F)O)Br 62a_200000210301_200010782288 [1,1,0,0,0,0|1,1,0]=4 3024 B11R1.278 CSc1ccc(c(c1F)O)Br 62a_200010782288_200000210301 [1,1,0,0,0,0|1,1,0]=4 3025 B11R1.278 CSc1ccc(c(c1F)O)F 62a_100010167067_200000210301 [1,1,0,0,0,0|1,1,0]=4 3026 B11R1.278 CSc1ccc(c(c1F)O)F 62a_200000210301_100010167067 [1,1,0,0,0,0|1,1,0]=4 3027 B11R1.278 CSc1ccc(c(c1N)C)F 62a_100011009917_200000210301 [1,1,0,0,0,0|1,1,0]=4 3028 B11R1.278 CSc1ccc(c(c1N)C)F 62a_200000210301_100011009917 [1,1,0,0,0,0|1,1,0]=4 3029 B11R1.278 CSc1ccc(c(c1N)O)Br 62a_100020748643_200000210301 [1,1,0,0,0,0|1,1,0]=4 3030 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200000210301_200010391124 [1,1,0,0,0,0|0,1,0]=3 3031 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200010391124_200000210301 [1,1,0,0,0,0|0,1,0]=3 3032 B11R1.278 CSc1ccc(c(c1O)F)C 62a_100000722096_200000210301 [1,1,0,0,0,0|1,1,0]=4 3033 B11R1.278 CSc1ccc(c(c1O)F)C 62a_200000210301_100000722096 [1,1,0,0,0,0|1,1,0]=4 3034 B11R1.278 CSc1ccc(c(c1O)F)F 62a_100010243909_200000210301 [1,1,0,0,0,0|1,1,0]=4 3035 B11R1.278 CSc1ccc(c(c1O)F)F 62a_200000210301_100010243909 [1,1,0,0,0,0|1,1,0]=4 3036 B11R1.278 Cc1c(ccc(c1C)N[13CH3])Br 2230a_100009816967_200025704644 [1,1,0,0,0,0|2,0,0]=4 3037 B11R1.278 Cc1c(ccc(c1C)N[13CH3])Br 34a_100009816967_200025704644 [1,1,0,0,0,0|2,0,0]=4 3038 B11R1.278 Cc1c(ccc(c1C)N[13CH3])Br 7a_100009816967_200025704644 [1,1,0,0,0,0|2,0,0]=4 3039 B11R1.278 Cc1c(ccc(c1C)N[13CH3])F 2230a_100000062172_200025704644 [1,1,0,0,0,0|2,0,0]=4 3040 B11R1.278 Cc1c(ccc(c1C)N[13CH3])F 34a_100000062172_200025704644 [1,1,0,0,0,0|2,0,0]=4 3041 B11R1.278 Cc1c(ccc(c1C)N[13CH3])F 7a_100000062172_200025704644 [1,1,0,0,0,0|2,0,0]=4 3042 B11R1.278 Cc1c(ccc(c1C)N[13CH3])O 34a_200011216674_200025704644 [1,1,0,0,0,0|2,0,0]=4 3043 B11R1.278 Cc1c(ccc(c1C)N[13CH3])O 7a_200011216674_200025704644 [1,1,0,0,0,0|2,0,0]=4 3044 B11R1.278 Cc1c(ccc(c1C)O[13CH3])Br 34a_100012353674_200025704644 [1,1,0,0,0,0|1,0,0]=3 3045 B11R1.278 Cc1c(ccc(c1C)O[13CH3])Br 7a_100012353674_200025704644 [1,1,0,0,0,0|1,0,0]=3 3046 B11R1.278 Cc1c(ccc(c1C)O[13CH3])F 34a_100009847123_200025704644 [1,1,0,0,0,0|1,0,0]=3 3047 B11R1.278 Cc1c(ccc(c1C)O[13CH3])F 7a_100009847123_200025704644 [1,1,0,0,0,0|1,0,0]=3 3048 B11R1.278 Cc1c(ccc(c1C)O[13CH3])I 34a_100011356951_200025704644 [1,1,0,0,0,0|1,0,0]=3 3049 B11R1.278 Cc1c(ccc(c1C)O[13CH3])I 7a_100011356951_200025704644 [1,1,0,0,0,0|1,0,0]=3 3050 B11R1.278 Cc1c(ccc(c1C)O[13CH3])N 34a_200011216674_200025704644 [1,1,0,0,0,0|1,0,0]=3 3051 B11R1.278 Cc1c(ccc(c1C)O[13CH3])N 7a_200011216674_200025704644 [1,1,0,0,0,0|1,0,0]=3 3052 B11R1.278 Cc1c(ccc(c1C)S[13CH3])Br 62a_200010185626_200025704644 [1,1,0,0,0,0|1,1,0]=4 3053 B11R1.278 Cc1c(ccc(c1C)S[13CH3])Br 62a_200025704644_200010185626 [1,1,0,0,0,0|1,1,0]=4 3054 B11R1.278 Cc1c(ccc(c1C)S[13CH3])F 62a_100009816033_200025704644 [1,1,0,0,0,0|1,1,0]=4 3055 B11R1.278 Cc1c(ccc(c1C)S[13CH3])F 62a_200025704644_100009816033 [1,1,0,0,0,0|1,1,0]=4 3056 B11R1.278 Cc1c(ccc(c1C)S[13CH3])N 62a_100009816967_200025704644 [1,1,0,0,0,0|1,1,0]=4 3057 B11R1.278 Cc1c(ccc(c1C)S[13CH3])N 62a_200025704644_100009816967 [1,1,0,0,0,0|1,1,0]=4 3058 B11R1.278 Cc1c(ccc(c1C)S[13CH3])O 62a_100012353674_200025704644 [1,1,0,0,0,0|1,1,0]=4 3059 B11R1.278 Cc1c(ccc(c1C)S[13CH3])O 62a_200025704644_100012353674 [1,1,0,0,0,0|1,1,0]=4 3060 B11R1.278 Cc1c(ccc(c1Cl)N[13CH3])Cl 34a_100011935240_200025704644 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.278 Cc1c(ccc(c1Cl)N[13CH3])Cl 7a_100011935240_200025704644 [1,1,0,0,0,0|2,0,0]=4 3062 B11R1.278 Cc1c(ccc(c1Cl)N[13CH3])F 2230a_100009863382_200025704644 [1,1,0,0,0,0|2,0,0]=4 3063 B11R1.278 Cc1c(ccc(c1Cl)N[13CH3])F 34a_100009863382_200025704644 [1,1,0,0,0,0|2,0,0]=4 3064 B11R1.278 Cc1c(ccc(c1Cl)N[13CH3])F 7a_100009863382_200025704644 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.278 Cc1c(ccc(c1Cl)O[13CH3])Br 34a_100021574527_200025704644 [1,1,0,0,0,0|1,0,0]=3 3066 B11R1.278 Cc1c(ccc(c1Cl)O[13CH3])Br 7a_100021574527_200025704644 [1,1,0,0,0,0|1,0,0]=3 3067 B11R1.278 Cc1c(ccc(c1Cl)S[13CH3])Br 62a_100055076181_200025704644 [1,1,0,0,0,0|1,1,0]=4 3068 B11R1.278 Cc1c(ccc(c1Cl)S[13CH3])Br 62a_200025704644_100055076181 [1,1,0,0,0,0|1,1,0]=4 3069 B11R1.278 Cc1c(ccc(c1Cl)S[13CH3])Cl 62a_100010730154_200025704644 [1,1,0,0,0,0|1,1,0]=4 3070 B11R1.278 Cc1c(ccc(c1Cl)S[13CH3])Cl 62a_200025704644_100010730154 [1,1,0,0,0,0|1,1,0]=4 3071 B11R1.278 Cc1c(ccc(c1F)Br)O[13CH3] 34a_100010390934_200025704644 [1,1,0,0,0,0|2,0,0]=4 3072 B11R1.278 Cc1c(ccc(c1F)Br)O[13CH3] 7a_100010390934_200025704644 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.278 Cc1c(ccc(c1F)N)O[13CH3] 34a_200000126710_200025704644 [1,1,0,0,0,0|2,0,0]=4 3074 B11R1.278 Cc1c(ccc(c1F)N)O[13CH3] 7a_200000126710_200025704644 [1,1,0,0,0,0|2,0,0]=4 3075 B11R1.278 Cc1c(ccc(c1F)N[13CH3])Br 2230a_100000722916_200025704644 [1,1,0,0,0,0|2,0,0]=4 3076 B11R1.278 Cc1c(ccc(c1F)N[13CH3])Br 34a_100000722916_200025704644 [1,1,0,0,0,0|2,0,0]=4 3077 B11R1.278 Cc1c(ccc(c1F)N[13CH3])Br 7a_100000722916_200025704644 [1,1,0,0,0,0|2,0,0]=4 3078 B11R1.278 Cc1c(ccc(c1F)N[13CH3])F 2230a_102495366501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3079 B11R1.278 Cc1c(ccc(c1F)N[13CH3])F 34a_102495366501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3080 B11R1.278 Cc1c(ccc(c1F)N[13CH3])F 7a_102495366501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3081 B11R1.278 Cc1c(ccc(c1F)N[13CH3])O 34a_200000126710_200025704644 [1,1,0,0,0,0|2,0,0]=4 3082 B11R1.278 Cc1c(ccc(c1F)N[13CH3])O 7a_200000126710_200025704644 [1,1,0,0,0,0|2,0,0]=4 3083 B11R1.278 Cc1c(ccc(c1F)S[13CH3])F 62a_100009815987_200025704644 [1,1,0,0,0,0|1,1,0]=4 3084 B11R1.278 Cc1c(ccc(c1F)S[13CH3])F 62a_200025704644_100009815987 [1,1,0,0,0,0|1,1,0]=4 3085 B11R1.278 Cc1c(ccc(c1F)S[13CH3])N 62a_100010208198_200025704644 [1,1,0,0,0,0|1,1,0]=4 3086 B11R1.278 Cc1c(ccc(c1F)S[13CH3])N 62a_200025704644_100010208198 [1,1,0,0,0,0|1,1,0]=4 3087 B11R1.278 Cc1c(ccc(c1F)S[13CH3])O 62a_100010390934_200025704644 [1,1,0,0,0,0|1,1,0]=4 3088 B11R1.278 Cc1c(ccc(c1F)S[13CH3])O 62a_200025704644_100010390934 [1,1,0,0,0,0|1,1,0]=4 3089 B11R1.278 Cc1c(ccc(c1N)O[13CH3])Br 34a_100013039247_200025704644 [1,1,0,0,0,0|1,0,0]=3 3090 B11R1.278 Cc1c(ccc(c1N)O[13CH3])Br 7a_100013039247_200025704644 [1,1,0,0,0,0|1,0,0]=3 3091 B11R1.278 Cc1c(ccc(c1N)S[13CH3])F 62a_100011009917_200025704644 [1,1,0,0,0,0|1,1,0]=4 3092 B11R1.278 Cc1c(ccc(c1N)S[13CH3])F 62a_200025704644_100011009917 [1,1,0,0,0,0|1,1,0]=4 3093 B11R1.278 Cc1c(ccc(c1O)C#N)F 271570a_203496583355_100009859896 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.278 Cc1c(ccc(c1O)C=O)F 271570a_203496583355_100009872231 [1,1,0,0,0,0|2,0,0]=4 3095 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200010391124_200025704644 [1,1,0,0,0,0|0,1,0]=3 3096 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200025704644_200010391124 [1,1,0,0,0,0|0,1,0]=3 3097 B11R1.278 Cc1c(cnc(c1Br)O[13CH3])Cl 34a_200010175591_200025704644 [1,1,0,0,0,0|2,0,0]=4 3098 B11R1.278 Cc1c(cnc(c1C)O[13CH3])Br 34a_200011099879_200025704644 [1,1,0,0,0,0|2,0,0]=4 3099 B11R1.278 Cc1ccc(c(c1Br)C)O[13CH3] 34a_100010659238_200025704644 [1,1,0,0,0,0|2,0,0]=4 3100 B11R1.278 Cc1ccc(c(c1Br)C)O[13CH3] 7a_100010659238_200025704644 [1,1,0,0,0,0|2,0,0]=4 3101 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 2230a_100000116900_200025704644 [1,1,0,0,0,0|2,0,0]=4 3102 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 34a_100000116900_200025704644 [1,1,0,0,0,0|2,0,0]=4 3103 B11R1.278 Cc1ccc(c(c1C)C)N[13CH3] 7a_100000116900_200025704644 [1,1,0,0,0,0|2,0,0]=4 3104 B11R1.278 Cc1ccc(c(c1C)F)S[13CH3] 62a_200015555822_200025704644 [1,1,0,0,0,0|1,1,0]=4 3105 B11R1.278 Cc1ccc(c(c1C)F)S[13CH3] 62a_200025704644_200015555822 [1,1,0,0,0,0|1,1,0]=4 3106 B11R1.278 Cc1ccc(c(c1F)F)O[13CH3] 34a_100000036877_200025704644 [1,1,0,0,0,0|2,0,0]=4 3107 B11R1.278 Cc1ccc(c(c1F)F)O[13CH3] 7a_100000036877_200025704644 [1,1,0,0,0,0|2,0,0]=4 3108 B11R1.278 Cc1ccc(c(c1F)O)S[13CH3] 62a_100000722096_200025704644 [1,1,0,0,0,0|1,1,0]=4 3109 B11R1.278 Cc1ccc(c(c1F)O)S[13CH3] 62a_200025704644_100000722096 [1,1,0,0,0,0|1,1,0]=4 3110 B11R1.278 Cc1ccc(c(c1O)Cl)N[13CH3] 34a_100000036876_200025704644 [1,1,0,0,0,0|2,0,0]=4 3111 B11R1.278 Cc1ccc(c(c1O)Cl)N[13CH3] 7a_100000036876_200025704644 [1,1,0,0,0,0|2,0,0]=4 3112 B11R1.278 N#Cc1ccc(c(c1O)O)F 271570a_203496583355_100010128267 [1,1,0,0,0,0|2,0,0]=4 3113 B11R1.278 [13CH3]Nc1ccc(c(c1O)Br)F 34a_100010128263_200025704644 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.278 [13CH3]Nc1ccc(c(c1O)F)F 34a_100015205010_200025704644 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)Br 34a_100011988769_200025704644 [1,1,0,0,0,0|2,0,0]=4 3116 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)Br 7a_100011988769_200025704644 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_200025704644 [1,1,0,0,0,0|2,0,0]=4 3118 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_200025704644 [1,1,0,0,0,0|2,0,0]=4 3119 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)N 34a_100012017499_200025704644 [1,1,0,0,0,0|2,0,0]=4 3120 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)Cl)N 7a_100012017499_200025704644 [1,1,0,0,0,0|2,0,0]=4 3121 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)F)Br 34a_100010245746_200025704644 [1,1,0,0,0,0|2,0,0]=4 3122 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)F)Br 7a_100010245746_200025704644 [1,1,0,0,0,0|2,0,0]=4 3123 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)F)N 34a_200000098347_200025704644 [1,1,0,0,0,0|2,0,0]=4 3124 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)F)N 7a_200000098347_200025704644 [1,1,0,0,0,0|2,0,0]=4 3125 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)N)Cl 34a_100016988457_200025704644 [1,1,0,0,0,0|2,0,0]=4 3126 B11R1.278 [13CH3]Oc1ccc(c(c1Cl)N)Cl 7a_100016988457_200025704644 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)Br 34a_100011830415_200025704644 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)Br 7a_100011830415_200025704644 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)F 34a_100000230025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)F 7a_100000230025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)I 34a_200011356956_200025704644 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)I 7a_200011356956_200025704644 [1,1,0,0,0,0|2,0,0]=4 3133 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)N 34a_100015204651_200025704644 [1,1,0,0,0,0|2,0,0]=4 3134 B11R1.278 [13CH3]Oc1ccc(c(c1F)F)N 7a_100015204651_200025704644 [1,1,0,0,0,0|2,0,0]=4 3135 B11R1.278 [13CH3]Sc1ccc(c(c1F)O)Br 62a_200010782288_200025704644 [1,1,0,0,0,0|1,1,0]=4 3136 B11R1.278 [13CH3]Sc1ccc(c(c1F)O)Br 62a_200025704644_200010782288 [1,1,0,0,0,0|1,1,0]=4 3137 B11R1.278 [13CH3]Sc1ccc(c(c1F)O)F 62a_100010167067_200025704644 [1,1,0,0,0,0|1,1,0]=4 3138 B11R1.278 [13CH3]Sc1ccc(c(c1F)O)F 62a_200025704644_100010167067 [1,1,0,0,0,0|1,1,0]=4 3139 B11R1.278 [13CH3]Sc1ccc(c(c1N)O)Br 62a_100020748643_200025704644 [1,1,0,0,0,0|1,1,0]=4 3140 B11R1.278 [13CH3]Sc1ccc(c(c1O)F)F 62a_100010243909_200025704644 [1,1,0,0,0,0|1,1,0]=4 3141 B11R1.278 [13CH3]Sc1ccc(c(c1O)F)F 62a_200025704644_100010243909 [1,1,0,0,0,0|1,1,0]=4 3142 B11R1.9 C=Cc1cc(cc(c1)OC)Br 271570a_100011290941_100010141301 [1,1,0,0,0,0|1,0,1]=4 3143 B11R1.9 C=Cc1cc(cc(c1)OC)C 271570a_100011290941_100010187550 [1,1,0,0,0,0|1,0,1]=4 3144 B11R1.9 C=Cc1cc(cc(c1)OC)Cl 271570a_100011290941_100010147680 [1,1,0,0,0,0|1,0,1]=4 3145 B11R1.9 C=Cc1cc(cc(c1)OC)F 271570a_100011290941_100011934182 [1,1,0,0,0,0|1,0,1]=4 3146 B11R1.9 C=Cc1cc(cc(c1)OC)N 271570a_100011290941_100000750983 [1,1,0,0,0,0|1,0,1]=4 3147 B11R1.9 C=Cc1cc(cc(c1)OC)O 271570a_100011290941_100010068927 [1,1,0,0,0,0|1,0,1]=4 3148 B11R1.9 CCc1cc(cc(c1)CC)O 271570a_203496583355_100010187588 [1,1,0,0,0,0|2,0,0]=4 3149 B11R1.9 CCc1cc(cc(c1)NC)Br 2230a_100010074814_200000210301 [1,1,0,0,0,0|2,0,0]=4 3150 B11R1.9 CCc1cc(cc(c1)NC)Br 34a_100010074814_200000210301 [1,1,0,0,0,0|2,0,0]=4 3151 B11R1.9 CCc1cc(cc(c1)NC)Br 7a_100010074814_200000210301 [1,1,0,0,0,0|2,0,0]=4 3152 B11R1.9 CCc1cc(cc(c1)NC)C 2230a_100012022893_200000210301 [1,1,0,0,0,0|2,0,0]=4 3153 B11R1.9 CCc1cc(cc(c1)NC)C 34a_100012022893_200000210301 [1,1,0,0,0,0|2,0,0]=4 3154 B11R1.9 CCc1cc(cc(c1)NC)C 7a_100012022893_200000210301 [1,1,0,0,0,0|2,0,0]=4 3155 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 2230a_100010074814_200025704644 [1,1,0,0,0,0|2,0,0]=4 3156 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 34a_100010074814_200025704644 [1,1,0,0,0,0|2,0,0]=4 3157 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 7a_100010074814_200025704644 [1,1,0,0,0,0|2,0,0]=4 3158 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 2230a_100012022893_200025704644 [1,1,0,0,0,0|2,0,0]=4 3159 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 34a_100012022893_200025704644 [1,1,0,0,0,0|2,0,0]=4 3160 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 7a_100012022893_200025704644 [1,1,0,0,0,0|2,0,0]=4 3161 B11R1.9 CCc1cc(cc(c1)SC)N 62a_100010074814_200000210301 [1,1,0,0,0,0|1,1,0]=4 3162 B11R1.9 CCc1cc(cc(c1)SC)N 62a_200000210301_100010074814 [1,1,0,0,0,0|1,1,0]=4 3163 B11R1.9 CCc1cc(cc(c1)S[13CH3])N 62a_100010074814_200025704644 [1,1,0,0,0,0|1,1,0]=4 3164 B11R1.9 CCc1cc(cc(c1)S[13CH3])N 62a_200025704644_100010074814 [1,1,0,0,0,0|1,1,0]=4 3165 B11R1.9 CNc1cc(cc(c1)OC)Br 34a_100000750983_200000210301 [1,1,0,0,0,0|1,0,0]=3 3166 B11R1.9 CNc1cc(cc(c1)OC)Br 7a_100000750983_200000210301 [1,1,0,0,0,0|1,0,0]=3 3167 B11R1.9 CNc1cc(cc(c1)OC)C 2230a_100012001870_200000210301 [1,1,0,0,0,0|1,0,0]=3 3168 B11R1.9 CNc1cc(cc(c1)OC)C 34a_100012001870_200000210301 [1,1,0,0,0,0|1,0,0]=3 3169 B11R1.9 CNc1cc(cc(c1)OC)C 7a_100012001870_200000210301 [1,1,0,0,0,0|1,0,0]=3 3170 B11R1.9 CNc1cc(cc(c1)OC)Cl 2230a_100000051436_200000210301 [1,1,0,0,0,0|1,0,0]=3 3171 B11R1.9 CNc1cc(cc(c1)OC)Cl 34a_100000051436_200000210301 [1,1,0,0,0,0|1,0,0]=3 3172 B11R1.9 CNc1cc(cc(c1)OC)Cl 7a_100000051436_200000210301 [1,1,0,0,0,0|1,0,0]=3 3173 B11R1.9 CNc1cc(cc(c1)OC)F 2230a_100000687699_200000210301 [1,1,0,0,0,0|1,0,0]=3 3174 B11R1.9 CNc1cc(cc(c1)OC)F 34a_100000687699_200000210301 [1,1,0,0,0,0|1,0,0]=3 3175 B11R1.9 CNc1cc(cc(c1)OC)F 7a_100000687699_200000210301 [1,1,0,0,0,0|1,0,0]=3 3176 B11R1.9 CNc1cc(cc(c1)OC)O 34a_200000692186_200000210301 [1,1,0,0,0,0|1,0,0]=3 3177 B11R1.9 CNc1cc(cc(c1)SC)F 62a_106741647397_200000210301 [1,1,0,0,0,0|1,1,0]=4 3178 B11R1.9 CNc1cc(cc(c1)SC)F 62a_200000210301_106741647397 [1,1,0,0,0,0|1,1,0]=4 3179 B11R1.9 CNc1cc(cc(c1)S[13CH3])F 62a_106741647397_200025704644 [1,1,0,0,0,0|1,1,0]=4 3180 B11R1.9 CNc1cc(cc(c1)S[13CH3])F 62a_200025704644_106741647397 [1,1,0,0,0,0|1,1,0]=4 3181 B11R1.9 COc1cc(cc(c1)C#N)Br 34a_100012180112_200000210301 [1,1,0,0,0,0|2,0,0]=4 3182 B11R1.9 COc1cc(cc(c1)C#N)Br 7a_100012180112_200000210301 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.9 COc1cc(cc(c1)C#N)C 34a_100009849966_200000210301 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.9 COc1cc(cc(c1)C#N)C 7a_100009849966_200000210301 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.9 COc1cc(cc(c1)C#N)Cl 34a_100000724442_200000210301 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.9 COc1cc(cc(c1)C#N)Cl 7a_100000724442_200000210301 [1,1,0,0,0,0|2,0,0]=4 3187 B11R1.9 COc1cc(cc(c1)C#N)F 34a_100000732150_200000210301 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.9 COc1cc(cc(c1)C#N)F 7a_100000732150_200000210301 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.9 COc1cc(cc(c1)C#N)O 271570a_203496583355_100011934654 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.9 COc1cc(cc(c1)C=O)O 271570a_203496583355_100009816777 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.9 COc1cc(cc(c1)CN)Cl 34a_107254831445_200000210301 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.9 COc1cc(cc(c1)CN)F 34a_100160469513_200000210301 [1,1,0,0,0,0|2,0,0]=4 3193 B11R1.9 COc1cc(cc(c1)CO)N 34a_200000124675_200000210301 [1,1,0,0,0,0|2,0,0]=4 3194 B11R1.9 COc1cc(cc(c1)CO)O 271570a_203496583355_100009995317 [1,1,0,0,0,0|2,0,0]=4 3195 B11R1.9 COc1cc(cc(c1)N[13CH3])Br 34a_100000750983_200025704644 [1,1,0,0,0,0|1,0,0]=3 3196 B11R1.9 COc1cc(cc(c1)N[13CH3])Br 7a_100000750983_200025704644 [1,1,0,0,0,0|1,0,0]=3 3197 B11R1.9 COc1cc(cc(c1)N[13CH3])C 2230a_100012001870_200025704644 [1,1,0,0,0,0|1,0,0]=3 3198 B11R1.9 COc1cc(cc(c1)N[13CH3])C 34a_100012001870_200025704644 [1,1,0,0,0,0|1,0,0]=3 3199 B11R1.9 COc1cc(cc(c1)N[13CH3])C 7a_100012001870_200025704644 [1,1,0,0,0,0|1,0,0]=3 3200 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 2230a_100000051436_200025704644 [1,1,0,0,0,0|1,0,0]=3 3201 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 34a_100000051436_200025704644 [1,1,0,0,0,0|1,0,0]=3 3202 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 7a_100000051436_200025704644 [1,1,0,0,0,0|1,0,0]=3 3203 B11R1.9 COc1cc(cc(c1)N[13CH3])F 2230a_100000687699_200025704644 [1,1,0,0,0,0|1,0,0]=3 3204 B11R1.9 COc1cc(cc(c1)N[13CH3])F 34a_100000687699_200025704644 [1,1,0,0,0,0|1,0,0]=3 3205 B11R1.9 COc1cc(cc(c1)N[13CH3])F 7a_100000687699_200025704644 [1,1,0,0,0,0|1,0,0]=3 3206 B11R1.9 COc1cc(cc(c1)N[13CH3])O 34a_200000692186_200025704644 [1,1,0,0,0,0|1,0,0]=3 3207 B11R1.9 COc1cc(cc(c1)OC)Br 34a_100010068927_200000210301 [1,1,0,0,0,0|0,0,0]=2 3208 B11R1.9 COc1cc(cc(c1)OC)Br 7a_100010068927_200000210301 [1,1,0,0,0,0|0,0,0]=2 3209 B11R1.9 COc1cc(cc(c1)OC)C 34a_100011216608_200000210301 [1,1,0,0,0,0|0,0,0]=2 3210 B11R1.9 COc1cc(cc(c1)OC)C 7a_100011216608_200000210301 [1,1,0,0,0,0|0,0,0]=2 3211 B11R1.9 COc1cc(cc(c1)OC)Cl 34a_100000051430_200000210301 [1,1,0,0,0,0|0,0,0]=2 3212 B11R1.9 COc1cc(cc(c1)OC)Cl 7a_100000051430_200000210301 [1,1,0,0,0,0|0,0,0]=2 3213 B11R1.9 COc1cc(cc(c1)OC)F 34a_100011369910_200000210301 [1,1,0,0,0,0|0,0,0]=2 3214 B11R1.9 COc1cc(cc(c1)OC)F 7a_100011369910_200000210301 [1,1,0,0,0,0|0,0,0]=2 3215 B11R1.9 COc1cc(cc(c1)OC)N 34a_200000692186_200000210301 [1,1,0,0,0,0|0,0,0]=2 3216 B11R1.9 COc1cc(cc(c1)OC)N 7a_200000692186_200000210301 [1,1,0,0,0,0|0,0,0]=2 3217 B11R1.9 COc1cc(cc(c1)OC)O 271570a_203496583355_100000685218 [1,1,0,0,0,0|0,0,0]=2 3218 B11R1.9 COc1cc(cc(c1)O[13CH3])Br 34a_100010068927_200025704644 [1,1,0,0,0,0|0,0,0]=2 3219 B11R1.9 COc1cc(cc(c1)O[13CH3])Br 7a_100010068927_200025704644 [1,1,0,0,0,0|0,0,0]=2 3220 B11R1.9 COc1cc(cc(c1)O[13CH3])C 34a_100011216608_200025704644 [1,1,0,0,0,0|0,0,0]=2 3221 B11R1.9 COc1cc(cc(c1)O[13CH3])C 7a_100011216608_200025704644 [1,1,0,0,0,0|0,0,0]=2 3222 B11R1.9 COc1cc(cc(c1)O[13CH3])Cl 34a_100000051430_200025704644 [1,1,0,0,0,0|0,0,0]=2 3223 B11R1.9 COc1cc(cc(c1)O[13CH3])Cl 7a_100000051430_200025704644 [1,1,0,0,0,0|0,0,0]=2 3224 B11R1.9 COc1cc(cc(c1)O[13CH3])F 34a_100011369910_200025704644 [1,1,0,0,0,0|0,0,0]=2 3225 B11R1.9 COc1cc(cc(c1)O[13CH3])F 7a_100011369910_200025704644 [1,1,0,0,0,0|0,0,0]=2 3226 B11R1.9 COc1cc(cc(c1)O[13CH3])N 34a_200000692186_200025704644 [1,1,0,0,0,0|0,0,0]=2 3227 B11R1.9 COc1cc(cc(c1)O[13CH3])N 7a_200000692186_200025704644 [1,1,0,0,0,0|0,0,0]=2 3228 B11R1.9 COc1cc(cc(c1)SC)Br 62a_100010141301_200000210301 [1,1,0,0,0,0|0,1,0]=3 3229 B11R1.9 COc1cc(cc(c1)SC)Br 62a_200000210301_100010141301 [1,1,0,0,0,0|0,1,0]=3 3230 B11R1.9 COc1cc(cc(c1)SC)C 62a_200000210301_100010187550 [1,1,0,0,0,0|0,1,0]=3 3231 B11R1.9 COc1cc(cc(c1)SC)Cl 62a_100010147680_200000210301 [1,1,0,0,0,0|0,1,0]=3 3232 B11R1.9 COc1cc(cc(c1)SC)Cl 62a_200000210301_100010147680 [1,1,0,0,0,0|0,1,0]=3 3233 B11R1.9 COc1cc(cc(c1)SC)F 62a_100011934182_200000210301 [1,1,0,0,0,0|0,1,0]=3 3234 B11R1.9 COc1cc(cc(c1)SC)F 62a_200000210301_100011934182 [1,1,0,0,0,0|0,1,0]=3 3235 B11R1.9 COc1cc(cc(c1)SC)N 62a_100000750983_200000210301 [1,1,0,0,0,0|0,1,0]=3 3236 B11R1.9 COc1cc(cc(c1)SC)N 62a_200000210301_100000750983 [1,1,0,0,0,0|0,1,0]=3 3237 B11R1.9 COc1cc(cc(c1)SC)O 271570a_203496583355_200010709149 [1,1,0,0,0,0|0,1,0]=3 3238 B11R1.9 COc1cc(cc(c1)SC)O 62a_200000210301_100010068927 [1,1,0,0,0,0|0,1,0]=3 3239 B11R1.9 COc1cc(cc(c1)S[13CH3])Br 62a_100010141301_200025704644 [1,1,0,0,0,0|0,1,0]=3 3240 B11R1.9 COc1cc(cc(c1)S[13CH3])Br 62a_200025704644_100010141301 [1,1,0,0,0,0|0,1,0]=3 3241 B11R1.9 COc1cc(cc(c1)S[13CH3])C 62a_200025704644_100010187550 [1,1,0,0,0,0|0,1,0]=3 3242 B11R1.9 COc1cc(cc(c1)S[13CH3])Cl 62a_100010147680_200025704644 [1,1,0,0,0,0|0,1,0]=3 3243 B11R1.9 COc1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100010147680 [1,1,0,0,0,0|0,1,0]=3 3244 B11R1.9 COc1cc(cc(c1)S[13CH3])F 62a_100011934182_200025704644 [1,1,0,0,0,0|0,1,0]=3 3245 B11R1.9 COc1cc(cc(c1)S[13CH3])F 62a_200025704644_100011934182 [1,1,0,0,0,0|0,1,0]=3 3246 B11R1.9 COc1cc(cc(c1)S[13CH3])N 62a_100000750983_200025704644 [1,1,0,0,0,0|0,1,0]=3 3247 B11R1.9 COc1cc(cc(c1)S[13CH3])N 62a_200025704644_100000750983 [1,1,0,0,0,0|0,1,0]=3 3248 B11R1.9 COc1cc(cc(c1)S[13CH3])O 62a_200025704644_100010068927 [1,1,0,0,0,0|0,1,0]=3 3249 B11R1.9 COc1cc(cc(n1)C)SC 62a_100010067692_200000210301 [1,1,0,0,0,0|1,1,0]=4 3250 B11R1.9 COc1cc(cc(n1)C)SC 62a_200000210301_100010067692 [1,1,0,0,0,0|1,1,0]=4 3251 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_100010067692_200025704644 [1,1,0,0,0,0|1,1,0]=4 3252 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100010067692 [1,1,0,0,0,0|1,1,0]=4 3253 B11R1.9 COc1cc(cc(n1)N)SC 62a_100010136845_200000210301 [1,1,0,0,0,0|1,1,0]=4 3254 B11R1.9 COc1cc(cc(n1)N)SC 62a_200000210301_100010136845 [1,1,0,0,0,0|1,1,0]=4 3255 B11R1.9 COc1cc(cc(n1)N)S[13CH3] 62a_100010136845_200025704644 [1,1,0,0,0,0|1,1,0]=4 3256 B11R1.9 COc1cc(cc(n1)N)S[13CH3] 62a_200025704644_100010136845 [1,1,0,0,0,0|1,1,0]=4 3257 B11R1.9 COc1cc(cc(n1)SC)C 62a_100009856763_200000210301 [1,1,0,0,0,0|1,1,0]=4 3258 B11R1.9 COc1cc(cc(n1)SC)C 62a_200000210301_100009856763 [1,1,0,0,0,0|1,1,0]=4 3259 B11R1.9 COc1cc(cc(n1)SC)N 62a_100012187057_200000210301 [1,1,0,0,0,0|1,1,0]=4 3260 B11R1.9 COc1cc(cc(n1)SC)N 62a_200000210301_100012187057 [1,1,0,0,0,0|1,1,0]=4 3261 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_100009856763_200025704644 [1,1,0,0,0,0|1,1,0]=4 3262 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_200025704644_100009856763 [1,1,0,0,0,0|1,1,0]=4 3263 B11R1.9 COc1cc(cc(n1)S[13CH3])N 62a_100012187057_200025704644 [1,1,0,0,0,0|1,1,0]=4 3264 B11R1.9 COc1cc(cc(n1)S[13CH3])N 62a_200025704644_100012187057 [1,1,0,0,0,0|1,1,0]=4 3265 B11R1.9 COc1cc(nc(c1)OC)O 271570a_203496583355_100010008354 [1,1,0,0,0,0|1,0,0]=3 3266 B11R1.9 COc1cc(nc(c1)SC)C 62a_200000210301_200009849800 [1,1,0,0,0,0|1,1,0]=4 3267 B11R1.9 COc1cc(nc(c1)SC)C 62a_200009849800_200000210301 [1,1,0,0,0,0|1,1,0]=4 3268 B11R1.9 COc1cc(nc(c1)SC)N 62a_100010257270_200000210301 [1,1,0,0,0,0|1,1,0]=4 3269 B11R1.9 COc1cc(nc(c1)SC)N 62a_200000210301_100010257270 [1,1,0,0,0,0|1,1,0]=4 3270 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200009849800_200025704644 [1,1,0,0,0,0|1,1,0]=4 3271 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200025704644_200009849800 [1,1,0,0,0,0|1,1,0]=4 3272 B11R1.9 COc1cc(nc(c1)S[13CH3])N 62a_100010257270_200025704644 [1,1,0,0,0,0|1,1,0]=4 3273 B11R1.9 COc1cc(nc(c1)S[13CH3])N 62a_200025704644_100010257270 [1,1,0,0,0,0|1,1,0]=4 3274 B11R1.9 COc1cc(nc(n1)O)OC 271570a_203496583355_100000758842 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.9 COc1cc(nc(n1)OC)O 271570a_203496583355_100000038909 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.9 CSc1cc(cc(c1)SC)C 62a_200000210301_200010709730 [1,1,0,0,0,0|0,2,0]=4 3277 B11R1.9 CSc1cc(cc(c1)SC)C 62a_200010709730_200000210301 [1,1,0,0,0,0|0,2,0]=4 3278 B11R1.9 CSc1cc(cc(c1)SC)F 62a_200000210301_200010245467 [1,1,0,0,0,0|0,2,0]=4 3279 B11R1.9 CSc1cc(cc(c1)SC)F 62a_200010245467_200000210301 [1,1,0,0,0,0|0,2,0]=4 3280 B11R1.9 CSc1cc(cc(c1)S[13CH3])C 62a_200010709730_200025704644 [1,1,0,0,0,0|0,2,0]=4 3281 B11R1.9 CSc1cc(cc(c1)S[13CH3])C 62a_200025704644_200010709730 [1,1,0,0,0,0|0,2,0]=4 3282 B11R1.9 CSc1cc(cc(c1)S[13CH3])F 62a_200010245467_200025704644 [1,1,0,0,0,0|0,2,0]=4 3283 B11R1.9 CSc1cc(cc(c1)S[13CH3])F 62a_200025704644_200010245467 [1,1,0,0,0,0|0,2,0]=4 3284 B11R1.9 Cc1cc(cc(c1)O[13CH3])C#N 34a_100009849966_200025704644 [1,1,0,0,0,0|2,0,0]=4 3285 B11R1.9 Cc1cc(cc(c1)O[13CH3])C#N 7a_100009849966_200025704644 [1,1,0,0,0,0|2,0,0]=4 3286 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Br 34a_100012180112_200025704644 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Br 7a_100012180112_200025704644 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Cl 34a_100000724442_200025704644 [1,1,0,0,0,0|2,0,0]=4 3289 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Cl 7a_100000724442_200025704644 [1,1,0,0,0,0|2,0,0]=4 3290 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)F 34a_100000732150_200025704644 [1,1,0,0,0,0|2,0,0]=4 3291 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)F 7a_100000732150_200025704644 [1,1,0,0,0,0|2,0,0]=4 3292 B11R1.9 [13CH3]Oc1cc(cc(c1)CN)Cl 34a_107254831445_200025704644 [1,1,0,0,0,0|2,0,0]=4 3293 B11R1.9 [13CH3]Oc1cc(cc(c1)CN)F 34a_100160469513_200025704644 [1,1,0,0,0,0|2,0,0]=4 3294 B11R1.9 [13CH3]Oc1cc(cc(c1)CO)N 34a_200000124675_200025704644 [1,1,0,0,0,0|2,0,0]=4 3295 B11R1.189 C#Cc1cccc(c1)COC 34a_100010272118_200000210301 [1,1,0,0,0,0|1,0,1]=4 3296 B11R1.189 C#Cc1cccc(c1)COC 7a_100010272118_200000210301 [1,1,0,0,0,0|1,0,1]=4 3297 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 34a_100010272118_200025704644 [1,1,0,0,0,0|1,0,1]=4 3298 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 7a_100010272118_200025704644 [1,1,0,0,0,0|1,0,1]=4 3299 B11R1.189 C#Cc1cccc(c1)OCC 34a_100011216014_100000210202 [1,1,0,0,0,0|1,0,1]=4 3300 B11R1.189 C#Cc1cccc(c1)OCC 7a_100011216014_100000210202 [1,1,0,0,0,0|1,0,1]=4 3301 B11R1.189 C#Cc1cccc(c1)OCF 34a_100011216014_100015361967 [1,1,0,0,0,0|1,0,1]=4 3302 B11R1.189 C#Cc1cccc(c1)OCF 7a_100011216014_100015361967 [1,1,0,0,0,0|1,0,1]=4 3303 B11R1.189 C=C=Cc1cccc(c1)OC 271570a_100015277604_100000170001 [1,1,0,0,0,0|1,0,1]=4 3304 B11R1.189 C=Cc1cccc(c1)COC 271570a_100011290941_100011493687 [1,1,0,0,0,0|1,0,1]=4 3305 B11R1.189 C=Cc1cccc(c1)OCC 271570a_100011290941_100000170002 [1,1,0,0,0,0|1,0,1]=4 3306 B11R1.189 C=Cc1cccc(c1)OCC 34a_100011309434_100000210202 [1,1,0,0,0,0|1,0,1]=4 3307 B11R1.189 C=Cc1cccc(c1)OCC 7a_100011309434_100000210202 [1,1,0,0,0,0|1,0,1]=4 3308 B11R1.189 C=Cc1cccc(c1)OCF 34a_100011309434_100015361967 [1,1,0,0,0,0|1,0,1]=4 3309 B11R1.189 C=Cc1cccc(c1)OCF 7a_100011309434_100015361967 [1,1,0,0,0,0|1,0,1]=4 3310 B11R1.189 CC#Cc1cccc(c1)SC 62a_200000210301_200009843338 [1,1,0,0,0,0|1,1,0]=4 3311 B11R1.189 CC#Cc1cccc(c1)S[13CH3] 62a_200025704644_200009843338 [1,1,0,0,0,0|1,1,0]=4 3312 B11R1.189 CC=Cc1cc(ccn1)OC 271570a_100016259895_100011216251 [1,1,0,0,0,0|2,0,0]=4 3313 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,1,0,0,0,0|2,0,0]=4 3314 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,1,0,0,0,0|2,0,0]=4 3315 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,1,0,0,0,0|1,0,0]=3 3316 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,1,0,0,0,0|1,1,0]=4 3317 B11R1.189 CC=Cc1cccc(n1)OC 271570a_100016259895_100000760917 [1,1,0,0,0,0|2,0,0]=4 3318 B11R1.189 CC=Cc1ccnc(c1)OC 271570a_100016259895_100000117307 [1,1,0,0,0,0|2,0,0]=4 3319 B11R1.189 CC=Cc1cncc(c1)OC 271570a_100016259895_100000684773 [1,1,0,0,0,0|2,0,0]=4 3320 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,1,0,0,0,0|1,0,0]=3 3321 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,1,0,0,0,0|1,0,0]=3 3322 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,1,0,0,0,0|1,0,0]=3 3323 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,1,0,0,0,0|1,0,0]=3 3324 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [1,1,0,0,0,0|1,1,0]=4 3325 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [1,1,0,0,0,0|1,1,0]=4 3326 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [1,1,0,0,0,0|1,1,0]=4 3327 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [1,1,0,0,0,0|1,1,0]=4 3328 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [1,1,0,0,0,0|2,0,0]=4 3329 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [1,1,0,0,0,0|2,0,0]=4 3330 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [1,1,0,0,0,0|2,0,0]=4 3331 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [1,1,0,0,0,0|1,0,0]=3 3332 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [1,1,0,0,0,0|1,0,0]=3 3333 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [1,1,0,0,0,0|1,0,0]=3 3334 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [1,1,0,0,0,0|1,0,0]=3 3335 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [1,1,0,0,0,0|1,0,0]=3 3336 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [1,1,0,0,0,0|1,1,0]=4 3337 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [1,1,0,0,0,0|1,1,0]=4 3338 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [1,1,0,0,0,0|1,1,0]=4 3339 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [1,1,0,0,0,0|1,1,0]=4 3340 B11R1.189 CCOc1cc(ccn1)SC 62a_100009995528_200000210301 [1,1,0,0,0,0|1,1,0]=4 3341 B11R1.189 CCOc1cc(ccn1)SC 62a_200000210301_100009995528 [1,1,0,0,0,0|1,1,0]=4 3342 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_100009995528_200025704644 [1,1,0,0,0,0|1,1,0]=4 3343 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_200025704644_100009995528 [1,1,0,0,0,0|1,1,0]=4 3344 B11R1.189 CCOc1ccc[n+](c1)CC 34a_100000731997_100000210202 [1,1,0,0,0,0|2,0,0]=4 3345 B11R1.189 CCOc1ccc[n+](c1)CC 7a_100000731997_100000210202 [1,1,0,0,0,0|2,0,0]=4 3346 B11R1.189 CCOc1cccc(c1)C#N 34a_100000184713_100000210202 [1,1,0,0,0,0|2,0,0]=4 3347 B11R1.189 CCOc1cccc(c1)C#N 7a_100000184713_100000210202 [1,1,0,0,0,0|2,0,0]=4 3348 B11R1.189 CCOc1cccc(c1)CBr 34a_100011660834_100000210202 [1,1,0,0,0,0|2,0,0]=4 3349 B11R1.189 CCOc1cccc(c1)CBr 7a_100011660834_100000210202 [1,1,0,0,0,0|2,0,0]=4 3350 B11R1.189 CCOc1cccc(c1)CC 34a_100000211550_100000210202 [1,1,0,0,0,0|1,0,0]=3 3351 B11R1.189 CCOc1cccc(c1)CC 7a_100000211550_100000210202 [1,1,0,0,0,0|1,0,0]=3 3352 B11R1.189 CCOc1cccc(c1)CCl 34a_100000084143_100000210202 [1,1,0,0,0,0|2,0,0]=4 3353 B11R1.189 CCOc1cccc(c1)CCl 7a_100000084143_100000210202 [1,1,0,0,0,0|2,0,0]=4 3354 B11R1.189 CCOc1cccc(c1)CN 34a_100000743036_100000210202 [1,1,0,0,0,0|2,0,0]=4 3355 B11R1.189 CCOc1cccc(c1)CO 34a_100011214949_100000210202 [1,1,0,0,0,0|2,0,0]=4 3356 B11R1.189 CCOc1cccc(c1)CO 7a_100011214949_100000210202 [1,1,0,0,0,0|2,0,0]=4 3357 B11R1.189 CCOc1cccc(c1)NC 2230a_100000742568_200000210301 [1,1,0,0,0,0|1,0,0]=3 3358 B11R1.189 CCOc1cccc(c1)NC 34a_100000742568_200000210301 [1,1,0,0,0,0|1,0,0]=3 3359 B11R1.189 CCOc1cccc(c1)NC 34a_100000756613_100000210202 [1,1,0,0,0,0|1,0,0]=3 3360 B11R1.189 CCOc1cccc(c1)NC 7a_100000756613_100000210202 [1,1,0,0,0,0|1,0,0]=3 3361 B11R1.189 CCOc1cccc(c1)N[13CH3] 2230a_100000742568_200025704644 [1,1,0,0,0,0|1,0,0]=3 3362 B11R1.189 CCOc1cccc(c1)N[13CH3] 34a_100000742568_200025704644 [1,1,0,0,0,0|1,0,0]=3 3363 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [1,1,0,0,0,0|0,0,0]=2 3364 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [1,1,0,0,0,0|0,0,0]=2 3365 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [1,1,0,0,0,0|0,0,0]=2 3366 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [1,1,0,0,0,0|0,0,0]=2 3367 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [1,1,0,0,0,0|0,0,0]=2 3368 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [1,1,0,0,0,0|0,0,0]=2 3369 B11R1.189 CCOc1cccc(c1)SC 34a_100011265683_100000210202 [1,1,0,0,0,0|0,1,0]=3 3370 B11R1.189 CCOc1cccc(c1)SC 62a_200000210301_100000170002 [1,1,0,0,0,0|0,1,0]=3 3371 B11R1.189 CCOc1cccc(c1)SC 7a_100011265683_100000210202 [1,1,0,0,0,0|0,1,0]=3 3372 B11R1.189 CCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170002 [1,1,0,0,0,0|0,1,0]=3 3373 B11R1.189 CCOc1cccc(n1)SC 62a_100000752924_200000210301 [1,1,0,0,0,0|1,1,0]=4 3374 B11R1.189 CCOc1cccc(n1)SC 62a_200000210301_100000752924 [1,1,0,0,0,0|1,1,0]=4 3375 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_100000752924_200025704644 [1,1,0,0,0,0|1,1,0]=4 3376 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_200025704644_100000752924 [1,1,0,0,0,0|1,1,0]=4 3377 B11R1.189 CCOc1ccnc(c1)NC 27a_100102657272_100009995529 [1,1,0,0,0,0|2,0,0]=4 3378 B11R1.189 CCOc1ccnc(c1)OC 34a_100012181050_100000210202 [1,1,0,0,0,0|1,0,0]=3 3379 B11R1.189 CCOc1ccnc(c1)SC 62a_100009995529_200000210301 [1,1,0,0,0,0|1,1,0]=4 3380 B11R1.189 CCOc1ccnc(c1)SC 62a_200000210301_100011922638 [1,1,0,0,0,0|1,1,0]=4 3381 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_100009995529_200025704644 [1,1,0,0,0,0|1,1,0]=4 3382 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_200025704644_100011922638 [1,1,0,0,0,0|1,1,0]=4 3383 B11R1.189 CCOc1cncc(c1)CC 34a_200009861530_100000210202 [1,1,0,0,0,0|2,0,0]=4 3384 B11R1.189 CCOc1cncc(c1)CC 7a_200009861530_100000210202 [1,1,0,0,0,0|2,0,0]=4 3385 B11R1.189 CCOc1cncc(c1)OC 34a_100000084572_100000210202 [1,1,0,0,0,0|1,0,0]=3 3386 B11R1.189 CCOc1cncc(c1)OC 7a_100000084572_100000210202 [1,1,0,0,0,0|1,0,0]=3 3387 B11R1.189 CCOc1cncc(c1)SC 62a_100012029586_200000210301 [1,1,0,0,0,0|1,1,0]=4 3388 B11R1.189 CCOc1cncc(c1)SC 62a_200000210301_100012029586 [1,1,0,0,0,0|1,1,0]=4 3389 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_100012029586_200025704644 [1,1,0,0,0,0|1,1,0]=4 3390 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_200025704644_100012029586 [1,1,0,0,0,0|1,1,0]=4 3391 B11R1.189 CCSc1cc(ccn1)OC 62a_100000210202_100011216251 [1,1,0,0,0,0|1,1,0]=4 3392 B11R1.189 CCSc1cc(ccn1)OC 62a_100009817693_100000210202 [1,1,0,0,0,0|1,1,0]=4 3393 B11R1.189 CCSc1cccc(c1)CC 62a_100000210202_100011263222 [1,1,0,0,0,0|1,1,0]=4 3394 B11R1.189 CCSc1cccc(c1)CC 62a_100011263222_100000210202 [1,1,0,0,0,0|1,1,0]=4 3395 B11R1.189 CCSc1cccc(c1)NC 62a_100000210202_100000219648 [1,1,0,0,0,0|1,1,0]=4 3396 B11R1.189 CCSc1cccc(c1)NC 62a_100000219648_100000210202 [1,1,0,0,0,0|1,1,0]=4 3397 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [1,1,0,0,0,0|0,1,0]=3 3398 B11R1.189 CCSc1cccc(c1)SC 62a_100000210202_100011215954 [1,1,0,0,0,0|0,2,0]=4 3399 B11R1.189 CCSc1cccc(c1)SC 62a_100000703699_200000210301 [1,1,0,0,0,0|0,2,0]=4 3400 B11R1.189 CCSc1cccc(c1)SC 62a_100011215954_100000210202 [1,1,0,0,0,0|0,2,0]=4 3401 B11R1.189 CCSc1cccc(c1)SC 62a_200000210301_100000703699 [1,1,0,0,0,0|0,2,0]=4 3402 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_100000703699_200025704644 [1,1,0,0,0,0|0,2,0]=4 3403 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_200025704644_100000703699 [1,1,0,0,0,0|0,2,0]=4 3404 B11R1.189 CCSc1cccc(n1)OC 62a_100000210202_100000760917 [1,1,0,0,0,0|1,1,0]=4 3405 B11R1.189 CCSc1cccc(n1)OC 62a_100000760917_100000210202 [1,1,0,0,0,0|1,1,0]=4 3406 B11R1.189 CCSc1ccnc(c1)OC 62a_100000117307_100000210202 [1,1,0,0,0,0|1,1,0]=4 3407 B11R1.189 CCSc1ccnc(c1)OC 62a_100000210202_100000117307 [1,1,0,0,0,0|1,1,0]=4 3408 B11R1.189 CCSc1cncc(c1)OC 62a_100000050176_100000210202 [1,1,0,0,0,0|1,1,0]=4 3409 B11R1.189 CCSc1cncc(c1)OC 62a_100000210202_100000050176 [1,1,0,0,0,0|1,1,0]=4 3410 B11R1.189 CC[n+]1cccc(c1)OCF 34a_100000731997_100015361967 [1,1,0,0,0,0|2,0,0]=4 3411 B11R1.189 CC[n+]1cccc(c1)OCF 7a_100000731997_100015361967 [1,1,0,0,0,0|2,0,0]=4 3412 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,1,0,0,0,0|2,0,0]=4 3413 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,1,0,0,0,0|2,0,0]=4 3414 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,1,0,0,0,0|2,0,0]=4 3415 B11R1.189 CCc1cccc(c1)NCF 34a_100000211250_100015361967 [1,1,0,0,0,0|2,0,0]=4 3416 B11R1.189 CCc1cccc(c1)NCF 7a_100000211250_100015361967 [1,1,0,0,0,0|2,0,0]=4 3417 B11R1.189 CCc1cccc(c1)OCF 34a_100000211550_100015361967 [1,1,0,0,0,0|1,0,0]=3 3418 B11R1.189 CCc1cccc(c1)OCF 7a_100000211550_100015361967 [1,1,0,0,0,0|1,0,0]=3 3419 B11R1.189 CCc1cccc(c1)SCF 62a_100011263222_100015361967 [1,1,0,0,0,0|1,1,0]=4 3420 B11R1.189 CCc1cccc(c1)SCF 62a_100015361967_100011263222 [1,1,0,0,0,0|1,1,0]=4 3421 B11R1.189 CCc1cncc(c1)OCF 34a_200009861530_100015361967 [1,1,0,0,0,0|2,0,0]=4 3422 B11R1.189 CCc1cncc(c1)OCF 7a_200009861530_100015361967 [1,1,0,0,0,0|2,0,0]=4 3423 B11R1.189 CNCc1cc(ccn1)OC 207a_100102657272_100000087537 [1,1,0,0,0,0|2,0,0]=4 3424 B11R1.189 CNCc1cc(ccn1)OC 2230a_106832991635_100000752681 [1,1,0,0,0,0|2,0,0]=4 3425 B11R1.189 CNCc1cc(ccn1)OC 270004a_106832991635_100000087537 [1,1,0,0,0,0|2,0,0]=4 3426 B11R1.189 CNCc1cc(ccn1)OC 34a_100102657272_100000752681 [1,1,0,0,0,0|2,0,0]=4 3427 B11R1.189 CNCc1cc(ccn1)OC 7a_106832991635_100000752681 [1,1,0,0,0,0|2,0,0]=4 3428 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,1,0,0,0,0|1,0,0]=3 3429 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,1,0,0,0,0|1,0,0]=3 3430 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,1,0,0,0,0|1,0,0]=3 3431 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,1,0,0,0,0|1,0,0]=3 3432 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,1,0,0,0,0|1,0,0]=3 3433 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,1,0,0,0,0|1,0,0]=3 3434 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,1,0,0,0,0|1,0,0]=3 3435 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,1,0,0,0,0|1,0,0]=3 3436 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,1,0,0,0,0|1,0,0]=3 3437 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,1,0,0,0,0|1,0,0]=3 3438 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [1,1,0,0,0,0|1,1,0]=4 3439 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [1,1,0,0,0,0|1,1,0]=4 3440 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [1,1,0,0,0,0|1,1,0]=4 3441 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [1,1,0,0,0,0|1,1,0]=4 3442 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [1,1,0,0,0,0|1,1,0]=4 3443 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [1,1,0,0,0,0|1,1,0]=4 3444 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [1,1,0,0,0,0|1,1,0]=4 3445 B11R1.189 CNCc1cccc(n1)OC 207a_100102657272_100000694346 [1,1,0,0,0,0|2,0,0]=4 3446 B11R1.189 CNCc1cccc(n1)OC 2230a_100000746380_200000210301 [1,1,0,0,0,0|2,0,0]=4 3447 B11R1.189 CNCc1cccc(n1)OC 2230a_106832991635_100000755263 [1,1,0,0,0,0|2,0,0]=4 3448 B11R1.189 CNCc1cccc(n1)OC 270004a_106832991635_100000694346 [1,1,0,0,0,0|2,0,0]=4 3449 B11R1.189 CNCc1cccc(n1)OC 34a_100102657272_100000755263 [1,1,0,0,0,0|2,0,0]=4 3450 B11R1.189 CNCc1cccc(n1)OC 7a_106832991635_100000755263 [1,1,0,0,0,0|2,0,0]=4 3451 B11R1.189 CNCc1ccnc(c1)OC 207a_100102657272_100000050969 [1,1,0,0,0,0|2,0,0]=4 3452 B11R1.189 CNCc1ccnc(c1)OC 2230a_106832991635_100103152439 [1,1,0,0,0,0|2,0,0]=4 3453 B11R1.189 CNCc1ccnc(c1)OC 270004a_106832991635_100000050969 [1,1,0,0,0,0|2,0,0]=4 3454 B11R1.189 CNCc1ccnc(c1)OC 34a_100102657272_100103152439 [1,1,0,0,0,0|2,0,0]=4 3455 B11R1.189 CNCc1ccnc(c1)OC 7a_106832991635_100103152439 [1,1,0,0,0,0|2,0,0]=4 3456 B11R1.189 CNCc1cncc(c1)OC 207a_100102657272_100011361638 [1,1,0,0,0,0|2,0,0]=4 3457 B11R1.189 CNCc1cncc(c1)OC 2230a_100020589029_200000210301 [1,1,0,0,0,0|2,0,0]=4 3458 B11R1.189 CNCc1cncc(c1)OC 270004a_106832991635_100011361638 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.189 CNCc1cncc(c1)OC 34a_100020589029_200000210301 [1,1,0,0,0,0|2,0,0]=4 3460 B11R1.189 CNc1cccc(c1)CCO 2230a_100011996697_200000210301 [1,1,0,0,0,0|2,0,0]=4 3461 B11R1.189 CNc1cccc(c1)CCO 34a_100011996697_200000210301 [1,1,0,0,0,0|2,0,0]=4 3462 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [1,1,0,0,0,0|1,0,0]=3 3463 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [1,1,0,0,0,0|1,0,0]=3 3464 B11R1.189 CNc1cccc(c1)OCF 34a_100000756613_100015361967 [1,1,0,0,0,0|1,0,0]=3 3465 B11R1.189 CNc1cccc(c1)OCF 7a_100000756613_100015361967 [1,1,0,0,0,0|1,0,0]=3 3466 B11R1.189 CNc1cccc(c1)SCF 62a_100000219648_100015361967 [1,1,0,0,0,0|1,1,0]=4 3467 B11R1.189 CNc1cccc(c1)SCF 62a_100015361967_100000219648 [1,1,0,0,0,0|1,1,0]=4 3468 B11R1.189 COCc1cc(ccn1)OC 34a_100000749536_200000210301 [1,1,0,0,0,0|1,0,0]=3 3469 B11R1.189 COCc1cc(ccn1)OC 34a_100138415774_100000752681 [1,1,0,0,0,0|1,0,0]=3 3470 B11R1.189 COCc1cccc(c1)C#N 34a_100000753308_200000210301 [1,1,0,0,0,0|2,0,0]=4 3471 B11R1.189 COCc1cccc(c1)C#N 34a_100138415774_100000233786 [1,1,0,0,0,0|2,0,0]=4 3472 B11R1.189 COCc1cccc(c1)C#N 7a_100000753308_200000210301 [1,1,0,0,0,0|2,0,0]=4 3473 B11R1.189 COCc1cccc(c1)C=O 34a_100138415774_100009816774 [1,1,0,0,0,0|2,0,0]=4 3474 B11R1.189 COCc1cccc(c1)CBr 34a_100010188025_200000210301 [1,1,0,0,0,0|2,0,0]=4 3475 B11R1.189 COCc1cccc(c1)CBr 7a_100010188025_200000210301 [1,1,0,0,0,0|2,0,0]=4 3476 B11R1.189 COCc1cccc(c1)CCl 34a_200000090956_200000210301 [1,1,0,0,0,0|2,0,0]=4 3477 B11R1.189 COCc1cccc(c1)CCl 7a_200000090956_200000210301 [1,1,0,0,0,0|2,0,0]=4 3478 B11R1.189 COCc1cccc(c1)CN 34a_100011269909_200000210301 [1,1,0,0,0,0|2,0,0]=4 3479 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,1,0,0,0,0|2,0,0]=4 3480 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [1,1,0,0,0,0|1,0,0]=3 3481 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [1,1,0,0,0,0|1,0,0]=3 3482 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,1,0,0,0,0|0,0,0]=2 3483 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,1,0,0,0,0|0,0,0]=2 3484 B11R1.189 COCc1cccc(c1)SC 62a_100011493687_200000210301 [1,1,0,0,0,0|0,1,0]=3 3485 B11R1.189 COCc1cccc(c1)SC 62a_200000210301_100011493687 [1,1,0,0,0,0|0,1,0]=3 3486 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_100011493687_200025704644 [1,1,0,0,0,0|0,1,0]=3 3487 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_200025704644_100011493687 [1,1,0,0,0,0|0,1,0]=3 3488 B11R1.189 COCc1cccc(n1)OC 34a_100138415774_100000755263 [1,1,0,0,0,0|1,0,0]=3 3489 B11R1.189 COCc1ccnc(c1)OC 34a_100138415774_100103152439 [1,1,0,0,0,0|1,0,0]=3 3490 B11R1.189 COCc1cncc(c1)OC 34a_100000732071_200000210301 [1,1,0,0,0,0|1,0,0]=3 3491 B11R1.189 COc1cc(ccn1)CSC 62a_100103152439_200000210301 [1,1,0,0,0,0|1,1,0]=4 3492 B11R1.189 COc1cc(ccn1)CSC 62a_200000210301_100103152439 [1,1,0,0,0,0|1,1,0]=4 3493 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_100103152439_200025704644 [1,1,0,0,0,0|1,1,0]=4 3494 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_200025704644_100103152439 [1,1,0,0,0,0|1,1,0]=4 3495 B11R1.189 COc1cc(ccn1)OCF 34a_100012181050_100015361967 [1,1,0,0,0,0|1,0,0]=3 3496 B11R1.189 COc1cc(ccn1)SCF 62a_100000117307_100015361967 [1,1,0,0,0,0|1,1,0]=4 3497 B11R1.189 COc1cc(ccn1)SCF 62a_100015361967_100000117307 [1,1,0,0,0,0|1,1,0]=4 3498 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [1,1,0,0,0,0|1,0,1]=4 3499 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [1,1,0,0,0,0|1,0,0]=3 3500 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [1,1,0,0,0,0|1,0,0]=3 3501 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [1,1,0,0,0,0|1,0,0]=3 3502 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [1,1,0,0,0,0|2,0,0]=4 3503 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,1,0,0,0,0|1,0,0]=3 3504 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,1,0,0,0,0|1,0,0]=3 3505 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,1,0,0,0,0|0,0,0]=2 3506 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,1,0,0,0,0|0,1,0]=3 3507 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,1,0,0,0,0|0,1,0]=3 3508 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,1,0,0,0,0|0,1,0]=3 3509 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,1,0,0,0,0|0,1,0]=3 3510 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [1,1,0,0,0,0|1,0,0]=3 3511 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [1,1,0,0,0,0|0,0,0]=2 3512 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [1,1,0,0,0,0|0,0,0]=2 3513 B11R1.189 COc1cccc(c1)SCF 62a_100015361967_100000170001 [1,1,0,0,0,0|0,1,0]=3 3514 B11R1.189 COc1cccc(n1)CN[13CH3] 2230a_100000746380_200025704644 [1,1,0,0,0,0|2,0,0]=4 3515 B11R1.189 COc1cccc(n1)CSC 62a_100000755263_200000210301 [1,1,0,0,0,0|1,1,0]=4 3516 B11R1.189 COc1cccc(n1)CSC 62a_200000210301_100000755263 [1,1,0,0,0,0|1,1,0]=4 3517 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_100000755263_200025704644 [1,1,0,0,0,0|1,1,0]=4 3518 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_200025704644_100000755263 [1,1,0,0,0,0|1,1,0]=4 3519 B11R1.189 COc1cccc(n1)SCF 62a_100000760917_100015361967 [1,1,0,0,0,0|1,1,0]=4 3520 B11R1.189 COc1cccc(n1)SCF 62a_100015361967_100000760917 [1,1,0,0,0,0|1,1,0]=4 3521 B11R1.189 COc1ccnc(c1)CO[13CH3] 34a_100000749536_200025704644 [1,1,0,0,0,0|1,0,0]=3 3522 B11R1.189 COc1ccnc(c1)CSC 62a_100000752681_200000210301 [1,1,0,0,0,0|1,1,0]=4 3523 B11R1.189 COc1ccnc(c1)CSC 62a_200000210301_100000752681 [1,1,0,0,0,0|1,1,0]=4 3524 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_100000752681_200025704644 [1,1,0,0,0,0|1,1,0]=4 3525 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_200025704644_100000752681 [1,1,0,0,0,0|1,1,0]=4 3526 B11R1.189 COc1ccnc(c1)SCF 62a_100009817693_100015361967 [1,1,0,0,0,0|1,1,0]=4 3527 B11R1.189 COc1ccnc(c1)SCF 62a_100015361967_100011216251 [1,1,0,0,0,0|1,1,0]=4 3528 B11R1.189 COc1cncc(c1)CN[13CH3] 2230a_100020589029_200025704644 [1,1,0,0,0,0|2,0,0]=4 3529 B11R1.189 COc1cncc(c1)CN[13CH3] 34a_100020589029_200025704644 [1,1,0,0,0,0|2,0,0]=4 3530 B11R1.189 COc1cncc(c1)CO[13CH3] 34a_100000732071_200025704644 [1,1,0,0,0,0|1,0,0]=3 3531 B11R1.189 COc1cncc(c1)OCF 34a_100000084572_100015361967 [1,1,0,0,0,0|1,0,0]=3 3532 B11R1.189 COc1cncc(c1)OCF 7a_100000084572_100015361967 [1,1,0,0,0,0|1,0,0]=3 3533 B11R1.189 COc1cncc(c1)SCF 62a_100000050176_100015361967 [1,1,0,0,0,0|1,1,0]=4 3534 B11R1.189 COc1cncc(c1)SCF 62a_100015361967_100000050176 [1,1,0,0,0,0|1,1,0]=4 3535 B11R1.189 CSc1cccc(c1)CCN 62a_100011207229_200000210301 [1,1,0,0,0,0|1,1,0]=4 3536 B11R1.189 CSc1cccc(c1)CCN 62a_200000210301_100011207229 [1,1,0,0,0,0|1,1,0]=4 3537 B11R1.189 CSc1cccc(c1)CCO 62a_100011217444_200000210301 [1,1,0,0,0,0|1,1,0]=4 3538 B11R1.189 CSc1cccc(c1)CCO 62a_200000210301_100011217444 [1,1,0,0,0,0|1,1,0]=4 3539 B11R1.189 CSc1cccc(c1)NCF 34a_100000210049_100015361967 [1,1,0,0,0,0|1,1,0]=4 3540 B11R1.189 CSc1cccc(c1)OCF 34a_100011265683_100015361967 [1,1,0,0,0,0|0,1,0]=3 3541 B11R1.189 CSc1cccc(c1)OCF 7a_100011265683_100015361967 [1,1,0,0,0,0|0,1,0]=3 3542 B11R1.189 CSc1cccc(c1)SCF 62a_100011215954_100015361967 [1,1,0,0,0,0|0,2,0]=4 3543 B11R1.189 CSc1cccc(c1)SCF 62a_100015361967_100011215954 [1,1,0,0,0,0|0,2,0]=4 3544 B11R1.189 FCOc1cccc(c1)CBr 34a_100011660834_100015361967 [1,1,0,0,0,0|2,0,0]=4 3545 B11R1.189 FCOc1cccc(c1)CBr 7a_100011660834_100015361967 [1,1,0,0,0,0|2,0,0]=4 3546 B11R1.189 FCOc1cccc(c1)CCl 34a_100000084143_100015361967 [1,1,0,0,0,0|2,0,0]=4 3547 B11R1.189 FCOc1cccc(c1)CCl 7a_100000084143_100015361967 [1,1,0,0,0,0|2,0,0]=4 3548 B11R1.189 N#Cc1cccc(c1)OCF 34a_100000184713_100015361967 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.189 N#Cc1cccc(c1)OCF 7a_100000184713_100015361967 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.189 NCc1cccc(c1)OCF 34a_100000743036_100015361967 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.189 OCc1cccc(c1)OCF 34a_100011214949_100015361967 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.189 OCc1cccc(c1)OCF 7a_100011214949_100015361967 [1,1,0,0,0,0|2,0,0]=4 3553 B11R1.189 [13CH3]Nc1cccc(c1)CCO 2230a_100011996697_200025704644 [1,1,0,0,0,0|2,0,0]=4 3554 B11R1.189 [13CH3]Nc1cccc(c1)CCO 34a_100011996697_200025704644 [1,1,0,0,0,0|2,0,0]=4 3555 B11R1.189 [13CH3]OCc1cccc(c1)C#N 34a_100000753308_200025704644 [1,1,0,0,0,0|2,0,0]=4 3556 B11R1.189 [13CH3]OCc1cccc(c1)C#N 7a_100000753308_200025704644 [1,1,0,0,0,0|2,0,0]=4 3557 B11R1.189 [13CH3]OCc1cccc(c1)CBr 34a_100010188025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3558 B11R1.189 [13CH3]OCc1cccc(c1)CBr 7a_100010188025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3559 B11R1.189 [13CH3]OCc1cccc(c1)CCl 34a_200000090956_200025704644 [1,1,0,0,0,0|2,0,0]=4 3560 B11R1.189 [13CH3]OCc1cccc(c1)CCl 7a_200000090956_200025704644 [1,1,0,0,0,0|2,0,0]=4 3561 B11R1.189 [13CH3]OCc1cccc(c1)CN 34a_100011269909_200025704644 [1,1,0,0,0,0|2,0,0]=4 3562 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [1,1,0,0,0,0|1,0,1]=4 3563 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [1,1,0,0,0,0|1,0,0]=3 3564 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [1,1,0,0,0,0|1,0,0]=3 3565 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [1,1,0,0,0,0|1,0,0]=3 3566 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [1,1,0,0,0,0|2,0,0]=4 3567 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_100011207229_200025704644 [1,1,0,0,0,0|1,1,0]=4 3568 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_200025704644_100011207229 [1,1,0,0,0,0|1,1,0]=4 3569 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_100011217444_200025704644 [1,1,0,0,0,0|1,1,0]=4 3570 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_200025704644_100011217444 [1,1,0,0,0,0|1,1,0]=4 3571 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [1,1,0,0,0,0|2,0,0]=4 3572 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [1,1,0,0,0,0|2,0,0]=4 3573 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [1,1,0,0,0,0|2,0,0]=4 3574 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,1,0,0,0,0|1,0,0]=3 3575 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [1,1,0,0,0,0|1,1,0]=4 3576 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [1,1,0,0,0,0|1,1,0]=4 3577 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [1,1,0,0,0,0|1,1,0]=4 3578 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [1,1,0,0,0,0|1,1,0]=4 3579 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [1,1,0,0,0,0|1,1,0]=4 3580 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [1,1,0,0,0,0|2,0,0]=4 3581 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [1,1,0,0,0,0|2,0,0]=4 3582 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [1,1,0,0,0,0|2,0,0]=4 3583 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,1,0,0,0,0|1,0,0]=3 3584 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,1,0,0,0,0|1,0,0]=3 3585 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [1,1,0,0,0,0|1,1,0]=4 3586 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [1,1,0,0,0,0|1,1,0]=4 3587 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 2230a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 34a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 3589 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 7a_100000211879_200025704644 [1,1,0,0,0,0|2,0,0]=4 3590 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [1,1,0,0,0,0|1,0,0]=3 3591 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [1,1,0,0,0,0|1,0,0]=3 3592 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_100011214899_200025704644 [1,1,0,0,0,0|1,1,0]=4 3593 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011214899 [1,1,0,0,0,0|1,1,0]=4 3594 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [1,1,0,0,0,0|1,0,0]=3 3595 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [1,1,0,0,0,0|1,0,0]=3 3596 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [1,1,0,0,0,0|1,1,0]=4 3597 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [1,1,0,0,0,0|1,1,0]=4 3598 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 2230a_100011217120_200025704644 [1,1,0,0,0,0|2,0,0]=4 3599 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 34a_100011217120_200025704644 [1,1,0,0,0,0|2,0,0]=4 3600 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [1,1,0,0,0,0|1,0,0]=3 3601 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [1,1,0,0,0,0|1,0,0]=3 3602 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_100000246457_200025704644 [1,1,0,0,0,0|1,1,0]=4 3603 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_200025704644_100000246457 [1,1,0,0,0,0|1,1,0]=4 3604 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [1,1,0,0,0,0|2,0,0]=4 3605 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [1,1,0,0,0,0|2,0,0]=4 3606 B11R1.266 CN(C)c1cccc(c1)N[13CH3] 34a_100000209982_200025704644 [1,1,0,0,0,0|2,0,0]=4 3607 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [1,1,0,0,0,0|1,0,0]=3 3608 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_100011215952_200025704644 [1,1,0,0,0,0|1,1,0]=4 3609 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011215952 [1,1,0,0,0,0|1,1,0]=4 3610 B11R1.266 CNc1cccc(c1)C(C)C 2230a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 3611 B11R1.266 CNc1cccc(c1)C(C)C 34a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 3612 B11R1.266 CNc1cccc(c1)C(C)C 7a_100000211879_200000210301 [1,1,0,0,0,0|2,0,0]=4 3613 B11R1.266 CNc1cccc(c1)C(C)O 2230a_100011217120_200000210301 [1,1,0,0,0,0|2,0,0]=4 3614 B11R1.266 CNc1cccc(c1)C(C)O 34a_100011217120_200000210301 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.266 CNc1cccc(c1)N(C)C 34a_100000209982_200000210301 [1,1,0,0,0,0|2,0,0]=4 3616 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,1,0,0,0,0|1,0,0]=3 3617 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,1,0,0,0,0|1,0,0]=3 3618 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,1,0,0,0,0|1,0,0]=3 3619 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,1,0,0,0,0|2,0,0]=4 3620 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,1,0,0,0,0|2,0,0]=4 3621 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,1,0,0,0,0|1,0,0]=3 3622 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,1,0,0,0,0|2,0,0]=4 3623 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [1,1,0,0,0,0|1,0,0]=3 3624 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [1,1,0,0,0,0|1,0,0]=3 3625 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [1,1,0,0,0,0|1,0,0]=3 3626 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [1,1,0,0,0,0|1,0,0]=3 3627 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [1,1,0,0,0,0|1,0,0]=3 3628 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [1,1,0,0,0,0|1,0,0]=3 3629 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [1,1,0,0,0,0|1,0,0]=3 3630 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [1,1,0,0,0,0|1,0,0]=3 3631 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [1,1,0,0,0,0|1,0,0]=3 3632 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [1,1,0,0,0,0|1,0,0]=3 3633 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [1,1,0,0,0,0|1,0,0]=3 3634 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [1,1,0,0,0,0|1,0,0]=3 3635 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [1,1,0,0,0,0|1,0,0]=3 3636 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [1,1,0,0,0,0|2,0,0]=4 3637 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [1,1,0,0,0,0|2,0,0]=4 3638 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [1,1,0,0,0,0|0,2,0]=4 3639 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [1,1,0,0,0,0|0,2,0]=4 3640 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [1,1,0,0,0,0|1,1,0]=4 3641 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [1,1,0,0,0,0|1,1,0]=4 3642 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [1,1,0,0,0,0|1,1,0]=4 3643 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [1,1,0,0,0,0|1,1,0]=4 3644 B11R1.266 CSc1cccc(c1)C(C)C 62a_100011214899_200000210301 [1,1,0,0,0,0|1,1,0]=4 3645 B11R1.266 CSc1cccc(c1)C(C)C 62a_200000210301_100011214899 [1,1,0,0,0,0|1,1,0]=4 3646 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [1,1,0,0,0,0|1,1,0]=4 3647 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [1,1,0,0,0,0|1,1,0]=4 3648 B11R1.266 CSc1cccc(c1)C(C)O 62a_100000246457_200000210301 [1,1,0,0,0,0|1,1,0]=4 3649 B11R1.266 CSc1cccc(c1)C(C)O 62a_200000210301_100000246457 [1,1,0,0,0,0|1,1,0]=4 3650 B11R1.266 CSc1cccc(c1)N(C)C 2230a_100020672454_200000210301 [1,1,0,0,0,0|1,1,0]=4 3651 B11R1.266 CSc1cccc(c1)N(C)C 269982a_100020672454_200000210301 [1,1,0,0,0,0|1,1,0]=4 3652 B11R1.266 CSc1cccc(c1)N(C)C 34a_100020672454_200000210301 [1,1,0,0,0,0|1,1,0]=4 3653 B11R1.266 CSc1cccc(c1)N(C)C 62a_100011215952_200000210301 [1,1,0,0,0,0|1,1,0]=4 3654 B11R1.266 CSc1cccc(c1)N(C)C 62a_200000210301_100011215952 [1,1,0,0,0,0|1,1,0]=4 3655 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 2230a_100020672454_200025704644 [1,1,0,0,0,0|1,1,0]=4 3656 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 269982a_100020672454_200025704644 [1,1,0,0,0,0|1,1,0]=4 3657 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 34a_100020672454_200025704644 [1,1,0,0,0,0|1,1,0]=4 3658 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [1,1,0,0,0,0|0,2,0]=4 3659 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [1,1,0,0,0,0|0,2,0]=4 3660 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,1,0,0,0,0|2,0,0]=4 3661 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,1,0,0,0,0|2,0,0]=4 3662 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,1,0,0,0,0|2,0,0]=4 3663 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [1,1,0,0,0,0|2,0,0]=4 3664 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [1,1,0,0,0,0|2,0,0]=4 3665 B11R1.280 C=Cc1cc(ccc1Br)OC 271570a_100011290941_100009992028 [1,1,0,0,0,0|1,0,1]=4 3666 B11R1.280 C=Cc1cc(ccc1C)OC 271570a_100011290941_100012349166 [1,1,0,0,0,0|1,0,1]=4 3667 B11R1.280 C=Cc1cc(ccc1Cl)OC 271570a_100011290941_100011356938 [1,1,0,0,0,0|1,0,1]=4 3668 B11R1.280 C=Cc1cc(ccc1F)OC 271570a_100011290941_100000699733 [1,1,0,0,0,0|1,0,1]=4 3669 B11R1.280 C=Cc1cc(ccc1N)OC 271570a_100011290941_100015195136 [1,1,0,0,0,0|1,0,1]=4 3670 B11R1.280 C=Cc1cc(ccc1O)OC 271570a_100011290941_100000685887 [1,1,0,0,0,0|1,0,1]=4 3671 B11R1.280 C=Cc1ccc(c(c1)OC)Br 271570a_100011290941_100012353699 [1,1,0,0,0,0|1,0,1]=4 3672 B11R1.280 C=Cc1ccc(c(c1)OC)C 271570a_100011290941_100011830276 [1,1,0,0,0,0|1,0,1]=4 3673 B11R1.280 C=Cc1ccc(c(c1)OC)Cl 271570a_100011290941_100011356853 [1,1,0,0,0,0|1,0,1]=4 3674 B11R1.280 C=Cc1ccc(c(c1)OC)F 271570a_100011290941_100011934186 [1,1,0,0,0,0|1,0,1]=4 3675 B11R1.280 C=Cc1ccc(c(c1)OC)N 271570a_100011290941_100011279103 [1,1,0,0,0,0|1,0,1]=4 3676 B11R1.280 C=Cc1ccc(c(c1)OC)O 271570a_100011290941_100000694246 [1,1,0,0,0,0|1,0,1]=4 3677 B11R1.280 CCc1cc(ccc1Br)NC 2230a_100010109747_200000210301 [1,1,0,0,0,0|2,0,0]=4 3678 B11R1.280 CCc1cc(ccc1Br)NC 34a_100010109747_200000210301 [1,1,0,0,0,0|2,0,0]=4 3679 B11R1.280 CCc1cc(ccc1Br)NC 7a_100010109747_200000210301 [1,1,0,0,0,0|2,0,0]=4 3680 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 2230a_100010109747_200025704644 [1,1,0,0,0,0|2,0,0]=4 3681 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 34a_100010109747_200025704644 [1,1,0,0,0,0|2,0,0]=4 3682 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 7a_100010109747_200025704644 [1,1,0,0,0,0|2,0,0]=4 3683 B11R1.280 CCc1cc(ccc1Br)SC 62a_100010244631_200000210301 [1,1,0,0,0,0|1,1,0]=4 3684 B11R1.280 CCc1cc(ccc1Br)SC 62a_200000210301_100010244631 [1,1,0,0,0,0|1,1,0]=4 3685 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_100010244631_200025704644 [1,1,0,0,0,0|1,1,0]=4 3686 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_200025704644_100010244631 [1,1,0,0,0,0|1,1,0]=4 3687 B11R1.280 CCc1cc(ccc1Cl)OC 34a_100000212063_200000210301 [1,1,0,0,0,0|1,0,0]=3 3688 B11R1.280 CCc1cc(ccc1Cl)OC 7a_100000212063_200000210301 [1,1,0,0,0,0|1,0,0]=3 3689 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 34a_100000212063_200025704644 [1,1,0,0,0,0|1,0,0]=3 3690 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 7a_100000212063_200025704644 [1,1,0,0,0,0|1,0,0]=3 3691 B11R1.280 CCc1cc(ccc1F)SC 62a_100010244625_200000210301 [1,1,0,0,0,0|1,1,0]=4 3692 B11R1.280 CCc1cc(ccc1F)SC 62a_200000210301_100010244625 [1,1,0,0,0,0|1,1,0]=4 3693 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_100010244625_200025704644 [1,1,0,0,0,0|1,1,0]=4 3694 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_200025704644_100010244625 [1,1,0,0,0,0|1,1,0]=4 3695 B11R1.280 CCc1cc(ccc1N)SC 62a_100000686106_200000210301 [1,1,0,0,0,0|1,1,0]=4 3696 B11R1.280 CCc1cc(ccc1N)SC 62a_200000210301_100000686106 [1,1,0,0,0,0|1,1,0]=4 3697 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_100000686106_200025704644 [1,1,0,0,0,0|1,1,0]=4 3698 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_200025704644_100000686106 [1,1,0,0,0,0|1,1,0]=4 3699 B11R1.280 CCc1cc(ccc1O)OC 271570a_203496583355_100000720562 [1,1,0,0,0,0|1,0,0]=3 3700 B11R1.280 CCc1cc(ccc1O)SC 62a_200000210301_100012338938 [1,1,0,0,0,0|1,1,0]=4 3701 B11R1.280 CCc1cc(ccc1O)S[13CH3] 62a_200025704644_100012338938 [1,1,0,0,0,0|1,1,0]=4 3702 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3703 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3704 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3705 B11R1.280 CCc1ccc(c(c1)NC)O 34a_100000765835_200000210301 [1,1,0,0,0,0|2,0,0]=4 3706 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3707 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3708 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3709 B11R1.280 CCc1ccc(c(c1)N[13CH3])O 34a_100000765835_200025704644 [1,1,0,0,0,0|2,0,0]=4 3710 B11R1.280 CCc1ccc(c(c1)OC)N 34a_100000124328_200000210301 [1,1,0,0,0,0|1,0,0]=3 3711 B11R1.280 CCc1ccc(c(c1)OC)N 7a_100000124328_200000210301 [1,1,0,0,0,0|1,0,0]=3 3712 B11R1.280 CCc1ccc(c(c1)OC)O 271570a_203496583355_200010710389 [1,1,0,0,0,0|1,0,0]=3 3713 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 34a_100000124328_200025704644 [1,1,0,0,0,0|1,0,0]=3 3714 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 7a_100000124328_200025704644 [1,1,0,0,0,0|1,0,0]=3 3715 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200000210301_200010244628 [1,1,0,0,0,0|1,1,0]=4 3716 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200010244628_200000210301 [1,1,0,0,0,0|1,1,0]=4 3717 B11R1.280 CCc1ccc(c(c1)SC)N 62a_100012339725_200000210301 [1,1,0,0,0,0|1,1,0]=4 3718 B11R1.280 CCc1ccc(c(c1)SC)N 62a_200000210301_100012339725 [1,1,0,0,0,0|1,1,0]=4 3719 B11R1.280 CCc1ccc(c(c1)SC)O 62a_100012339963_200000210301 [1,1,0,0,0,0|1,1,0]=4 3720 B11R1.280 CCc1ccc(c(c1)SC)O 62a_200000210301_100012339963 [1,1,0,0,0,0|1,1,0]=4 3721 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200010244628_200025704644 [1,1,0,0,0,0|1,1,0]=4 3722 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010244628 [1,1,0,0,0,0|1,1,0]=4 3723 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_100012339725_200025704644 [1,1,0,0,0,0|1,1,0]=4 3724 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_200025704644_100012339725 [1,1,0,0,0,0|1,1,0]=4 3725 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_100012339963_200025704644 [1,1,0,0,0,0|1,1,0]=4 3726 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_200025704644_100012339963 [1,1,0,0,0,0|1,1,0]=4 3727 B11R1.280 CNc1cc(ccc1Br)OC 34a_100000748603_200000210301 [1,1,0,0,0,0|1,0,0]=3 3728 B11R1.280 CNc1cc(ccc1C)OC 2230a_100000760359_200000210301 [1,1,0,0,0,0|1,0,0]=3 3729 B11R1.280 CNc1cc(ccc1C)OC 34a_100000760359_200000210301 [1,1,0,0,0,0|1,0,0]=3 3730 B11R1.280 CNc1cc(ccc1C)SC 62a_100020629602_200000210301 [1,1,0,0,0,0|1,1,0]=4 3731 B11R1.280 CNc1cc(ccc1C)SC 62a_200000210301_100020629602 [1,1,0,0,0,0|1,1,0]=4 3732 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_100020629602_200025704644 [1,1,0,0,0,0|1,1,0]=4 3733 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_200025704644_100020629602 [1,1,0,0,0,0|1,1,0]=4 3734 B11R1.280 CNc1cc(ccc1Cl)OC 34a_100000745576_200000210301 [1,1,0,0,0,0|1,0,0]=3 3735 B11R1.280 CNc1cc(ccc1F)OC 34a_100000764331_200000210301 [1,1,0,0,0,0|1,0,0]=3 3736 B11R1.280 CNc1cc(ccc1F)SC 62a_100011314990_200000210301 [1,1,0,0,0,0|1,1,0]=4 3737 B11R1.280 CNc1cc(ccc1F)SC 62a_200000210301_100011314990 [1,1,0,0,0,0|1,1,0]=4 3738 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_100011314990_200025704644 [1,1,0,0,0,0|1,1,0]=4 3739 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_200025704644_100011314990 [1,1,0,0,0,0|1,1,0]=4 3740 B11R1.280 CNc1cc(ccc1I)OC 34a_100000748021_200000210301 [1,1,0,0,0,0|1,0,0]=3 3741 B11R1.280 CNc1cc(ccc1N)SC 62a_100000694363_200000210301 [1,1,0,0,0,0|1,1,0]=4 3742 B11R1.280 CNc1cc(ccc1N)S[13CH3] 62a_100000694363_200025704644 [1,1,0,0,0,0|1,1,0]=4 3743 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [1,1,0,0,0,0|1,0,0]=3 3744 B11R1.280 CNc1ccc(c(c1)OC)Br 2230a_100000765947_200000210301 [1,1,0,0,0,0|1,0,0]=3 3745 B11R1.280 CNc1ccc(c(c1)OC)Br 34a_100000765947_200000210301 [1,1,0,0,0,0|1,0,0]=3 3746 B11R1.280 CNc1ccc(c(c1)OC)C 2230a_100011279678_200000210301 [1,1,0,0,0,0|1,0,0]=3 3747 B11R1.280 CNc1ccc(c(c1)OC)C 34a_100011279678_200000210301 [1,1,0,0,0,0|1,0,0]=3 3748 B11R1.280 CNc1ccc(c(c1)OC)Cl 2230a_100000742311_200000210301 [1,1,0,0,0,0|1,0,0]=3 3749 B11R1.280 CNc1ccc(c(c1)OC)Cl 34a_100000742311_200000210301 [1,1,0,0,0,0|1,0,0]=3 3750 B11R1.280 CNc1ccc(c(c1)OC)F 2230a_100000701188_200000210301 [1,1,0,0,0,0|1,0,0]=3 3751 B11R1.280 CNc1ccc(c(c1)OC)F 34a_100000701188_200000210301 [1,1,0,0,0,0|1,0,0]=3 3752 B11R1.280 CNc1ccc(c(c1)OC)I 34a_100000746945_200000210301 [1,1,0,0,0,0|1,0,0]=3 3753 B11R1.280 CNc1ccc(c(c1)OC)O 34a_100000726020_200000210301 [1,1,0,0,0,0|1,0,0]=3 3754 B11R1.280 CNc1ccc(c(c1)SC)C 62a_100000707694_200000210301 [1,1,0,0,0,0|1,1,0]=4 3755 B11R1.280 CNc1ccc(c(c1)SC)C 62a_200000210301_100000707694 [1,1,0,0,0,0|1,1,0]=4 3756 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_100000707694_200025704644 [1,1,0,0,0,0|1,1,0]=4 3757 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000707694 [1,1,0,0,0,0|1,1,0]=4 3758 B11R1.280 COc1cc(c(cn1)Br)OC 34a_100010738159_200000210301 [1,1,0,0,0,0|1,0,0]=3 3759 B11R1.280 COc1cc(c(cn1)Br)O[13CH3] 34a_100010738159_200025704644 [1,1,0,0,0,0|1,0,0]=3 3760 B11R1.280 COc1cc(c(cn1)C)SC 62a_100010068546_200000210301 [1,1,0,0,0,0|1,1,0]=4 3761 B11R1.280 COc1cc(c(cn1)C)SC 62a_200000210301_100010068546 [1,1,0,0,0,0|1,1,0]=4 3762 B11R1.280 COc1cc(c(cn1)C)S[13CH3] 62a_100010068546_200025704644 [1,1,0,0,0,0|1,1,0]=4 3763 B11R1.280 COc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100010068546 [1,1,0,0,0,0|1,1,0]=4 3764 B11R1.280 COc1cc(c(cn1)Cl)SC 62a_100010068019_200000210301 [1,1,0,0,0,0|1,1,0]=4 3765 B11R1.280 COc1cc(c(cn1)Cl)SC 62a_200000210301_100010068019 [1,1,0,0,0,0|1,1,0]=4 3766 B11R1.280 COc1cc(c(cn1)Cl)S[13CH3] 62a_100010068019_200025704644 [1,1,0,0,0,0|1,1,0]=4 3767 B11R1.280 COc1cc(c(cn1)Cl)S[13CH3] 62a_200025704644_100010068019 [1,1,0,0,0,0|1,1,0]=4 3768 B11R1.280 COc1cc(c(cn1)F)SC 62a_100010160775_200000210301 [1,1,0,0,0,0|1,1,0]=4 3769 B11R1.280 COc1cc(c(cn1)F)SC 62a_200000210301_100010160775 [1,1,0,0,0,0|1,1,0]=4 3770 B11R1.280 COc1cc(c(cn1)F)S[13CH3] 62a_100010160775_200025704644 [1,1,0,0,0,0|1,1,0]=4 3771 B11R1.280 COc1cc(c(cn1)F)S[13CH3] 62a_200025704644_100010160775 [1,1,0,0,0,0|1,1,0]=4 3772 B11R1.280 COc1cc(c(cn1)O)OC 271570a_203496583355_100010191559 [1,1,0,0,0,0|1,0,0]=3 3773 B11R1.280 COc1cc(c[nH]c1=O)SC 62a_200000210301_100010125397 [1,1,0,0,0,0|1,1,0]=4 3774 B11R1.280 COc1cc(c[nH]c1=O)S[13CH3] 62a_200025704644_100010125397 [1,1,0,0,0,0|1,1,0]=4 3775 B11R1.280 COc1cc(ccc1Br)C#N 34a_100009877741_200000210301 [1,1,0,0,0,0|2,0,0]=4 3776 B11R1.280 COc1cc(ccc1Br)C#N 7a_100009877741_200000210301 [1,1,0,0,0,0|2,0,0]=4 3777 B11R1.280 COc1cc(ccc1Br)CO 34a_100010191536_200000210301 [1,1,0,0,0,0|2,0,0]=4 3778 B11R1.280 COc1cc(ccc1Br)CO 7a_100010191536_200000210301 [1,1,0,0,0,0|2,0,0]=4 3779 B11R1.280 COc1cc(ccc1Br)N[13CH3] 2230a_100000765947_200025704644 [1,1,0,0,0,0|1,0,0]=3 3780 B11R1.280 COc1cc(ccc1Br)N[13CH3] 34a_100000765947_200025704644 [1,1,0,0,0,0|1,0,0]=3 3781 B11R1.280 COc1cc(ccc1Br)O[13CH3] 34a_100011827694_200025704644 [1,1,0,0,0,0|0,0,0]=2 3782 B11R1.280 COc1cc(ccc1Br)O[13CH3] 7a_100011827694_200025704644 [1,1,0,0,0,0|0,0,0]=2 3783 B11R1.280 COc1cc(ccc1Br)SC 62a_100012353699_200000210301 [1,1,0,0,0,0|0,1,0]=3 3784 B11R1.280 COc1cc(ccc1Br)SC 62a_200000210301_100012353699 [1,1,0,0,0,0|0,1,0]=3 3785 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_100012353699_200025704644 [1,1,0,0,0,0|0,1,0]=3 3786 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_200025704644_100012353699 [1,1,0,0,0,0|0,1,0]=3 3787 B11R1.280 COc1cc(ccc1C)C#N 34a_100000765541_200000210301 [1,1,0,0,0,0|2,0,0]=4 3788 B11R1.280 COc1cc(ccc1C)C#N 7a_100000765541_200000210301 [1,1,0,0,0,0|2,0,0]=4 3789 B11R1.280 COc1cc(ccc1C)N[13CH3] 2230a_100011279678_200025704644 [1,1,0,0,0,0|1,0,0]=3 3790 B11R1.280 COc1cc(ccc1C)N[13CH3] 34a_100011279678_200025704644 [1,1,0,0,0,0|1,0,0]=3 3791 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [1,1,0,0,0,0|0,0,0]=2 3792 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [1,1,0,0,0,0|0,0,0]=2 3793 B11R1.280 COc1cc(ccc1C)SC 62a_100011830276_200000210301 [1,1,0,0,0,0|0,1,0]=3 3794 B11R1.280 COc1cc(ccc1C)SC 62a_200000210301_100011830276 [1,1,0,0,0,0|0,1,0]=3 3795 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_100011830276_200025704644 [1,1,0,0,0,0|0,1,0]=3 3796 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_200025704644_100011830276 [1,1,0,0,0,0|0,1,0]=3 3797 B11R1.280 COc1cc(ccc1Cl)C#N 34a_100012186312_200000210301 [1,1,0,0,0,0|2,0,0]=4 3798 B11R1.280 COc1cc(ccc1Cl)C#N 7a_100012186312_200000210301 [1,1,0,0,0,0|2,0,0]=4 3799 B11R1.280 COc1cc(ccc1Cl)CN 34a_100020636435_200000210301 [1,1,0,0,0,0|2,0,0]=4 3800 B11R1.280 COc1cc(ccc1Cl)CO 34a_100009876509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3801 B11R1.280 COc1cc(ccc1Cl)CO 7a_100009876509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3802 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 2230a_100000742311_200025704644 [1,1,0,0,0,0|1,0,0]=3 3803 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 34a_100000742311_200025704644 [1,1,0,0,0,0|1,0,0]=3 3804 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 34a_100012186310_200025704644 [1,1,0,0,0,0|0,0,0]=2 3805 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 7a_100012186310_200025704644 [1,1,0,0,0,0|0,0,0]=2 3806 B11R1.280 COc1cc(ccc1Cl)SC 62a_100011356853_200000210301 [1,1,0,0,0,0|0,1,0]=3 3807 B11R1.280 COc1cc(ccc1Cl)SC 62a_200000210301_100011356853 [1,1,0,0,0,0|0,1,0]=3 3808 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_100011356853_200025704644 [1,1,0,0,0,0|0,1,0]=3 3809 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100011356853 [1,1,0,0,0,0|0,1,0]=3 3810 B11R1.280 COc1cc(ccc1F)C#N 34a_100000069402_200000210301 [1,1,0,0,0,0|2,0,0]=4 3811 B11R1.280 COc1cc(ccc1F)C#N 7a_100000069402_200000210301 [1,1,0,0,0,0|2,0,0]=4 3812 B11R1.280 COc1cc(ccc1F)CN 34a_100160469508_200000210301 [1,1,0,0,0,0|2,0,0]=4 3813 B11R1.280 COc1cc(ccc1F)CO 34a_100009842347_200000210301 [1,1,0,0,0,0|2,0,0]=4 3814 B11R1.280 COc1cc(ccc1F)CO 7a_100009842347_200000210301 [1,1,0,0,0,0|2,0,0]=4 3815 B11R1.280 COc1cc(ccc1F)N[13CH3] 2230a_100000701188_200025704644 [1,1,0,0,0,0|1,0,0]=3 3816 B11R1.280 COc1cc(ccc1F)N[13CH3] 34a_100000701188_200025704644 [1,1,0,0,0,0|1,0,0]=3 3817 B11R1.280 COc1cc(ccc1F)O[13CH3] 34a_100012001760_200025704644 [1,1,0,0,0,0|0,0,0]=2 3818 B11R1.280 COc1cc(ccc1F)O[13CH3] 7a_100012001760_200025704644 [1,1,0,0,0,0|0,0,0]=2 3819 B11R1.280 COc1cc(ccc1F)SC 62a_100011934186_200000210301 [1,1,0,0,0,0|0,1,0]=3 3820 B11R1.280 COc1cc(ccc1F)SC 62a_200000210301_100011934186 [1,1,0,0,0,0|0,1,0]=3 3821 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_100011934186_200025704644 [1,1,0,0,0,0|0,1,0]=3 3822 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_200025704644_100011934186 [1,1,0,0,0,0|0,1,0]=3 3823 B11R1.280 COc1cc(ccc1I)C#N 34a_100000724445_200000210301 [1,1,0,0,0,0|2,0,0]=4 3824 B11R1.280 COc1cc(ccc1I)C#N 7a_100000724445_200000210301 [1,1,0,0,0,0|2,0,0]=4 3825 B11R1.280 COc1cc(ccc1I)CO 34a_100000049605_200000210301 [1,1,0,0,0,0|2,0,0]=4 3826 B11R1.280 COc1cc(ccc1I)CO 7a_100000049605_200000210301 [1,1,0,0,0,0|2,0,0]=4 3827 B11R1.280 COc1cc(ccc1I)N[13CH3] 34a_100000746945_200025704644 [1,1,0,0,0,0|1,0,0]=3 3828 B11R1.280 COc1cc(ccc1N)C#N 34a_100011997735_200000210301 [1,1,0,0,0,0|2,0,0]=4 3829 B11R1.280 COc1cc(ccc1N)C#N 7a_100011997735_200000210301 [1,1,0,0,0,0|2,0,0]=4 3830 B11R1.280 COc1cc(ccc1N)O[13CH3] 34a_100015326901_200025704644 [1,1,0,0,0,0|0,0,0]=2 3831 B11R1.280 COc1cc(ccc1N)O[13CH3] 7a_100015326901_200025704644 [1,1,0,0,0,0|0,0,0]=2 3832 B11R1.280 COc1cc(ccc1N)SC 62a_100011279103_200000210301 [1,1,0,0,0,0|0,1,0]=3 3833 B11R1.280 COc1cc(ccc1N)SC 62a_200000210301_100015196925 [1,1,0,0,0,0|0,1,0]=3 3834 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_100011279103_200025704644 [1,1,0,0,0,0|0,1,0]=3 3835 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_200025704644_100015196925 [1,1,0,0,0,0|0,1,0]=3 3836 B11R1.280 COc1cc(ccc1O)C#N 271570a_203496583355_100012356288 [1,1,0,0,0,0|2,0,0]=4 3837 B11R1.280 COc1cc(ccc1O)C=O 271570a_203496583355_100010244714 [1,1,0,0,0,0|2,0,0]=4 3838 B11R1.280 COc1cc(ccc1O)CO 271570a_203496583355_100010234685 [1,1,0,0,0,0|2,0,0]=4 3839 B11R1.280 COc1cc(ccc1O)N[13CH3] 34a_100000726020_200025704644 [1,1,0,0,0,0|1,0,0]=3 3840 B11R1.280 COc1cc(ccc1O)SC 62a_200000210301_100000694246 [1,1,0,0,0,0|0,1,0]=3 3841 B11R1.280 COc1cc(ccc1O)S[13CH3] 62a_200025704644_100000694246 [1,1,0,0,0,0|0,1,0]=3 3842 B11R1.280 COc1cc(cnc1C)SC 62a_100010254219_200000210301 [1,1,0,0,0,0|1,1,0]=4 3843 B11R1.280 COc1cc(cnc1C)SC 62a_200000210301_100010254219 [1,1,0,0,0,0|1,1,0]=4 3844 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_100010254219_200025704644 [1,1,0,0,0,0|1,1,0]=4 3845 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_200025704644_100010254219 [1,1,0,0,0,0|1,1,0]=4 3846 B11R1.280 COc1cc(cnc1F)SC 62a_100010214931_200000210301 [1,1,0,0,0,0|1,1,0]=4 3847 B11R1.280 COc1cc(cnc1F)SC 62a_200000210301_100010214931 [1,1,0,0,0,0|1,1,0]=4 3848 B11R1.280 COc1cc(cnc1F)S[13CH3] 62a_100010214931_200025704644 [1,1,0,0,0,0|1,1,0]=4 3849 B11R1.280 COc1cc(cnc1F)S[13CH3] 62a_200025704644_100010214931 [1,1,0,0,0,0|1,1,0]=4 3850 B11R1.280 COc1cc(cnc1N)SC 62a_106354213024_200000210301 [1,1,0,0,0,0|1,1,0]=4 3851 B11R1.280 COc1cc(cnc1N)SC 62a_200000210301_106354213024 [1,1,0,0,0,0|1,1,0]=4 3852 B11R1.280 COc1cc(cnc1N)S[13CH3] 62a_106354213024_200025704644 [1,1,0,0,0,0|1,1,0]=4 3853 B11R1.280 COc1cc(cnc1N)S[13CH3] 62a_200025704644_106354213024 [1,1,0,0,0,0|1,1,0]=4 3854 B11R1.280 COc1cc(ncc1C)SC 62a_100010067687_200000210301 [1,1,0,0,0,0|1,1,0]=4 3855 B11R1.280 COc1cc(ncc1C)SC 62a_200000210301_100010067687 [1,1,0,0,0,0|1,1,0]=4 3856 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_100010067687_200025704644 [1,1,0,0,0,0|1,1,0]=4 3857 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_200025704644_100010067687 [1,1,0,0,0,0|1,1,0]=4 3858 B11R1.280 COc1cc(ncc1F)SC 62a_200000210301_200010136270 [1,1,0,0,0,0|1,1,0]=4 3859 B11R1.280 COc1cc(ncc1F)SC 62a_200010136270_200000210301 [1,1,0,0,0,0|1,1,0]=4 3860 B11R1.280 COc1cc(ncc1F)S[13CH3] 62a_200010136270_200025704644 [1,1,0,0,0,0|1,1,0]=4 3861 B11R1.280 COc1cc(ncc1F)S[13CH3] 62a_200025704644_200010136270 [1,1,0,0,0,0|1,1,0]=4 3862 B11R1.280 COc1cc(ncc1N)SC 62a_100009887741_200000210301 [1,1,0,0,0,0|1,1,0]=4 3863 B11R1.280 COc1cc(ncc1N)SC 62a_200000210301_100009887741 [1,1,0,0,0,0|1,1,0]=4 3864 B11R1.280 COc1cc(ncc1N)S[13CH3] 62a_100009887741_200025704644 [1,1,0,0,0,0|1,1,0]=4 3865 B11R1.280 COc1cc(ncc1N)S[13CH3] 62a_200025704644_100009887741 [1,1,0,0,0,0|1,1,0]=4 3866 B11R1.280 COc1ccc(c(c1)C#N)Br 34a_100009818209_200000210301 [1,1,0,0,0,0|2,0,0]=4 3867 B11R1.280 COc1ccc(c(c1)C#N)Br 7a_100009818209_200000210301 [1,1,0,0,0,0|2,0,0]=4 3868 B11R1.280 COc1ccc(c(c1)C#N)Cl 34a_100000092820_200000210301 [1,1,0,0,0,0|2,0,0]=4 3869 B11R1.280 COc1ccc(c(c1)C#N)Cl 7a_100000092820_200000210301 [1,1,0,0,0,0|2,0,0]=4 3870 B11R1.280 COc1ccc(c(c1)C#N)F 34a_100000070142_200000210301 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.280 COc1ccc(c(c1)C#N)F 7a_100000070142_200000210301 [1,1,0,0,0,0|2,0,0]=4 3872 B11R1.280 COc1ccc(c(c1)C#N)N 34a_200011997737_200000210301 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.280 COc1ccc(c(c1)C#N)N 7a_200011997737_200000210301 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.280 COc1ccc(c(c1)C#N)O 271570a_203496583355_100000748272 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.280 COc1ccc(c(c1)C=O)O 271570a_203496583355_100000691568 [1,1,0,0,0,0|2,0,0]=4 3876 B11R1.280 COc1ccc(c(c1)CN)C 34a_200009844824_200000210301 [1,1,0,0,0,0|2,0,0]=4 3877 B11R1.280 COc1ccc(c(c1)CN)O 271570a_203496583355_100000741592 [1,1,0,0,0,0|2,0,0]=4 3878 B11R1.280 COc1ccc(c(c1)CO)Br 34a_100012351483_200000210301 [1,1,0,0,0,0|2,0,0]=4 3879 B11R1.280 COc1ccc(c(c1)CO)Br 7a_100012351483_200000210301 [1,1,0,0,0,0|2,0,0]=4 3880 B11R1.280 COc1ccc(c(c1)CO)C 34a_100009878257_200000210301 [1,1,0,0,0,0|2,0,0]=4 3881 B11R1.280 COc1ccc(c(c1)CO)C 7a_100009878257_200000210301 [1,1,0,0,0,0|2,0,0]=4 3882 B11R1.280 COc1ccc(c(c1)CO)Cl 34a_100000091669_200000210301 [1,1,0,0,0,0|2,0,0]=4 3883 B11R1.280 COc1ccc(c(c1)CO)Cl 7a_100000091669_200000210301 [1,1,0,0,0,0|2,0,0]=4 3884 B11R1.280 COc1ccc(c(c1)CO)O 271570a_203496583355_200011273942 [1,1,0,0,0,0|2,0,0]=4 3885 B11R1.280 COc1ccc(c(c1)N[13CH3])Br 34a_100000748603_200025704644 [1,1,0,0,0,0|1,0,0]=3 3886 B11R1.280 COc1ccc(c(c1)N[13CH3])C 2230a_100000760359_200025704644 [1,1,0,0,0,0|1,0,0]=3 3887 B11R1.280 COc1ccc(c(c1)N[13CH3])C 34a_100000760359_200025704644 [1,1,0,0,0,0|1,0,0]=3 3888 B11R1.280 COc1ccc(c(c1)N[13CH3])Cl 34a_100000745576_200025704644 [1,1,0,0,0,0|1,0,0]=3 3889 B11R1.280 COc1ccc(c(c1)N[13CH3])F 34a_100000764331_200025704644 [1,1,0,0,0,0|1,0,0]=3 3890 B11R1.280 COc1ccc(c(c1)N[13CH3])I 34a_100000748021_200025704644 [1,1,0,0,0,0|1,0,0]=3 3891 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [1,1,0,0,0,0|1,0,0]=3 3892 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100000719091_200000210301 [1,1,0,0,0,0|0,0,0]=2 3893 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100011827694_200000210301 [1,1,0,0,0,0|0,0,0]=2 3894 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100000719091_200000210301 [1,1,0,0,0,0|0,0,0]=2 3895 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100011827694_200000210301 [1,1,0,0,0,0|0,0,0]=2 3896 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [1,1,0,0,0,0|0,0,0]=2 3897 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [1,1,0,0,0,0|0,0,0]=2 3898 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [1,1,0,0,0,0|0,0,0]=2 3899 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [1,1,0,0,0,0|0,0,0]=2 3900 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100011516019_200000210301 [1,1,0,0,0,0|0,0,0]=2 3901 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100012186310_200000210301 [1,1,0,0,0,0|0,0,0]=2 3902 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100011516019_200000210301 [1,1,0,0,0,0|0,0,0]=2 3903 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100012186310_200000210301 [1,1,0,0,0,0|0,0,0]=2 3904 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012001760_200000210301 [1,1,0,0,0,0|0,0,0]=2 3905 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012178750_200000210301 [1,1,0,0,0,0|0,0,0]=2 3906 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012001760_200000210301 [1,1,0,0,0,0|0,0,0]=2 3907 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012178750_200000210301 [1,1,0,0,0,0|0,0,0]=2 3908 B11R1.280 COc1ccc(c(c1)OC)I 34a_100010168831_200000210301 [1,1,0,0,0,0|0,0,0]=2 3909 B11R1.280 COc1ccc(c(c1)OC)I 7a_100010168831_200000210301 [1,1,0,0,0,0|0,0,0]=2 3910 B11R1.280 COc1ccc(c(c1)OC)N 34a_100015326901_200000210301 [1,1,0,0,0,0|0,0,0]=2 3911 B11R1.280 COc1ccc(c(c1)OC)N 34a_100016989039_200000210301 [1,1,0,0,0,0|0,0,0]=2 3912 B11R1.280 COc1ccc(c(c1)OC)N 7a_100015326901_200000210301 [1,1,0,0,0,0|0,0,0]=2 3913 B11R1.280 COc1ccc(c(c1)OC)N 7a_100016989039_200000210301 [1,1,0,0,0,0|0,0,0]=2 3914 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [1,1,0,0,0,0|0,0,0]=2 3915 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 34a_100000719091_200025704644 [1,1,0,0,0,0|0,0,0]=2 3916 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 7a_100000719091_200025704644 [1,1,0,0,0,0|0,0,0]=2 3917 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [1,1,0,0,0,0|0,0,0]=2 3918 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [1,1,0,0,0,0|0,0,0]=2 3919 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 34a_100011516019_200025704644 [1,1,0,0,0,0|0,0,0]=2 3920 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 7a_100011516019_200025704644 [1,1,0,0,0,0|0,0,0]=2 3921 B11R1.280 COc1ccc(c(c1)O[13CH3])F 34a_100012178750_200025704644 [1,1,0,0,0,0|0,0,0]=2 3922 B11R1.280 COc1ccc(c(c1)O[13CH3])F 7a_100012178750_200025704644 [1,1,0,0,0,0|0,0,0]=2 3923 B11R1.280 COc1ccc(c(c1)O[13CH3])I 34a_100010168831_200025704644 [1,1,0,0,0,0|0,0,0]=2 3924 B11R1.280 COc1ccc(c(c1)O[13CH3])I 7a_100010168831_200025704644 [1,1,0,0,0,0|0,0,0]=2 3925 B11R1.280 COc1ccc(c(c1)O[13CH3])N 34a_100016989039_200025704644 [1,1,0,0,0,0|0,0,0]=2 3926 B11R1.280 COc1ccc(c(c1)O[13CH3])N 7a_100016989039_200025704644 [1,1,0,0,0,0|0,0,0]=2 3927 B11R1.280 COc1ccc(c(c1)SC)Br 62a_100009992028_200000210301 [1,1,0,0,0,0|0,1,0]=3 3928 B11R1.280 COc1ccc(c(c1)SC)Br 62a_200000210301_100009992028 [1,1,0,0,0,0|0,1,0]=3 3929 B11R1.280 COc1ccc(c(c1)SC)C 62a_100012349166_200000210301 [1,1,0,0,0,0|0,1,0]=3 3930 B11R1.280 COc1ccc(c(c1)SC)C 62a_200000210301_100012349166 [1,1,0,0,0,0|0,1,0]=3 3931 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_100011356938_200000210301 [1,1,0,0,0,0|0,1,0]=3 3932 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_200000210301_100011356938 [1,1,0,0,0,0|0,1,0]=3 3933 B11R1.280 COc1ccc(c(c1)SC)F 62a_100000699733_200000210301 [1,1,0,0,0,0|0,1,0]=3 3934 B11R1.280 COc1ccc(c(c1)SC)F 62a_200000210301_100000699733 [1,1,0,0,0,0|0,1,0]=3 3935 B11R1.280 COc1ccc(c(c1)SC)N 62a_100015195136_200000210301 [1,1,0,0,0,0|0,1,0]=3 3936 B11R1.280 COc1ccc(c(c1)SC)N 62a_200000210301_100015195136 [1,1,0,0,0,0|0,1,0]=3 3937 B11R1.280 COc1ccc(c(c1)SC)O 62a_200000210301_100000685887 [1,1,0,0,0,0|0,1,0]=3 3938 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_100009992028_200025704644 [1,1,0,0,0,0|0,1,0]=3 3939 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100009992028 [1,1,0,0,0,0|0,1,0]=3 3940 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_100012349166_200025704644 [1,1,0,0,0,0|0,1,0]=3 3941 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_200025704644_100012349166 [1,1,0,0,0,0|0,1,0]=3 3942 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_100011356938_200025704644 [1,1,0,0,0,0|0,1,0]=3 3943 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011356938 [1,1,0,0,0,0|0,1,0]=3 3944 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_100000699733_200025704644 [1,1,0,0,0,0|0,1,0]=3 3945 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000699733 [1,1,0,0,0,0|0,1,0]=3 3946 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_100015195136_200025704644 [1,1,0,0,0,0|0,1,0]=3 3947 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_200025704644_100015195136 [1,1,0,0,0,0|0,1,0]=3 3948 B11R1.280 COc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000685887 [1,1,0,0,0,0|0,1,0]=3 3949 B11R1.280 COc1ccc(c(n1)OC)O 271570a_203496583355_100009816055 [1,1,0,0,0,0|1,0,0]=3 3950 B11R1.280 COc1ccc(c(n1)SC)N 62a_100000069805_200000210301 [1,1,0,0,0,0|1,1,0]=4 3951 B11R1.280 COc1ccc(c(n1)SC)N 62a_200000210301_100000069805 [1,1,0,0,0,0|1,1,0]=4 3952 B11R1.280 COc1ccc(c(n1)S[13CH3])N 62a_100000069805_200025704644 [1,1,0,0,0,0|1,1,0]=4 3953 B11R1.280 COc1ccc(c(n1)S[13CH3])N 62a_200025704644_100000069805 [1,1,0,0,0,0|1,1,0]=4 3954 B11R1.280 COc1cnc(c(c1)SC)F 62a_100010068374_200000210301 [1,1,0,0,0,0|1,1,0]=4 3955 B11R1.280 COc1cnc(c(c1)SC)F 62a_200000210301_100010068374 [1,1,0,0,0,0|1,1,0]=4 3956 B11R1.280 COc1cnc(c(c1)S[13CH3])F 62a_100010068374_200025704644 [1,1,0,0,0,0|1,1,0]=4 3957 B11R1.280 COc1cnc(c(c1)S[13CH3])F 62a_200025704644_100010068374 [1,1,0,0,0,0|1,1,0]=4 3958 B11R1.280 COc1nc(ccc1N)SC 62a_100000687816_200000210301 [1,1,0,0,0,0|1,1,0]=4 3959 B11R1.280 COc1nc(ccc1N)SC 62a_200000210301_100000687816 [1,1,0,0,0,0|1,1,0]=4 3960 B11R1.280 COc1nc(ccc1N)S[13CH3] 62a_100000687816_200025704644 [1,1,0,0,0,0|1,1,0]=4 3961 B11R1.280 COc1nc(ccc1N)S[13CH3] 62a_200025704644_100000687816 [1,1,0,0,0,0|1,1,0]=4 3962 B11R1.280 COc1nc(ccc1O)SC 62a_200000210301_100010893133 [1,1,0,0,0,0|1,1,0]=4 3963 B11R1.280 COc1nc(ccc1O)S[13CH3] 62a_200025704644_100010893133 [1,1,0,0,0,0|1,1,0]=4 3964 B11R1.280 COc1ncc(c(n1)OC)O 271570a_203496583355_100011215025 [1,1,0,0,0,0|2,0,0]=4 3965 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_100010341305_200025704644 [1,1,0,0,0,0|0,2,0]=4 3966 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_200025704644_100010341305 [1,1,0,0,0,0|0,2,0]=4 3967 B11R1.280 CSc1ccc(c(c1)SC)F 62a_100010341305_200000210301 [1,1,0,0,0,0|0,2,0]=4 3968 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_100010341305 [1,1,0,0,0,0|0,2,0]=4 3969 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_200010708804 [1,1,0,0,0,0|0,2,0]=4 3970 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200010708804_200000210301 [1,1,0,0,0,0|0,2,0]=4 3971 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200010708804_200025704644 [1,1,0,0,0,0|0,2,0]=4 3972 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010708804 [1,1,0,0,0,0|0,2,0]=4 3973 B11R1.280 Cc1ccc(cc1CN)O[13CH3] 34a_200009844824_200025704644 [1,1,0,0,0,0|2,0,0]=4 3974 B11R1.280 Cc1ccc(cc1CO)O[13CH3] 34a_100009878257_200025704644 [1,1,0,0,0,0|2,0,0]=4 3975 B11R1.280 Cc1ccc(cc1CO)O[13CH3] 7a_100009878257_200025704644 [1,1,0,0,0,0|2,0,0]=4 3976 B11R1.280 Cc1ccc(cc1O[13CH3])C#N 34a_100000765541_200025704644 [1,1,0,0,0,0|2,0,0]=4 3977 B11R1.280 Cc1ccc(cc1O[13CH3])C#N 7a_100000765541_200025704644 [1,1,0,0,0,0|2,0,0]=4 3978 B11R1.280 [13CH3]Oc1cc(ccc1Br)C#N 34a_100009877741_200025704644 [1,1,0,0,0,0|2,0,0]=4 3979 B11R1.280 [13CH3]Oc1cc(ccc1Br)C#N 7a_100009877741_200025704644 [1,1,0,0,0,0|2,0,0]=4 3980 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 34a_100010191536_200025704644 [1,1,0,0,0,0|2,0,0]=4 3981 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 7a_100010191536_200025704644 [1,1,0,0,0,0|2,0,0]=4 3982 B11R1.280 [13CH3]Oc1cc(ccc1Cl)C#N 34a_100012186312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3983 B11R1.280 [13CH3]Oc1cc(ccc1Cl)C#N 7a_100012186312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3984 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CN 34a_100020636435_200025704644 [1,1,0,0,0,0|2,0,0]=4 3985 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 34a_100009876509_200025704644 [1,1,0,0,0,0|2,0,0]=4 3986 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 7a_100009876509_200025704644 [1,1,0,0,0,0|2,0,0]=4 3987 B11R1.280 [13CH3]Oc1cc(ccc1F)C#N 34a_100000069402_200025704644 [1,1,0,0,0,0|2,0,0]=4 3988 B11R1.280 [13CH3]Oc1cc(ccc1F)C#N 7a_100000069402_200025704644 [1,1,0,0,0,0|2,0,0]=4 3989 B11R1.280 [13CH3]Oc1cc(ccc1F)CN 34a_100160469508_200025704644 [1,1,0,0,0,0|2,0,0]=4 3990 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 34a_100009842347_200025704644 [1,1,0,0,0,0|2,0,0]=4 3991 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 7a_100009842347_200025704644 [1,1,0,0,0,0|2,0,0]=4 3992 B11R1.280 [13CH3]Oc1cc(ccc1I)C#N 34a_100000724445_200025704644 [1,1,0,0,0,0|2,0,0]=4 3993 B11R1.280 [13CH3]Oc1cc(ccc1I)C#N 7a_100000724445_200025704644 [1,1,0,0,0,0|2,0,0]=4 3994 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 34a_100000049605_200025704644 [1,1,0,0,0,0|2,0,0]=4 3995 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 7a_100000049605_200025704644 [1,1,0,0,0,0|2,0,0]=4 3996 B11R1.280 [13CH3]Oc1cc(ccc1N)C#N 34a_100011997735_200025704644 [1,1,0,0,0,0|2,0,0]=4 3997 B11R1.280 [13CH3]Oc1cc(ccc1N)C#N 7a_100011997735_200025704644 [1,1,0,0,0,0|2,0,0]=4 3998 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Br 34a_100009818209_200025704644 [1,1,0,0,0,0|2,0,0]=4 3999 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Br 7a_100009818209_200025704644 [1,1,0,0,0,0|2,0,0]=4 4000 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Cl 34a_100000092820_200025704644 [1,1,0,0,0,0|2,0,0]=4 4001 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)Cl 7a_100000092820_200025704644 [1,1,0,0,0,0|2,0,0]=4 4002 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)F 34a_100000070142_200025704644 [1,1,0,0,0,0|2,0,0]=4 4003 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)F 7a_100000070142_200025704644 [1,1,0,0,0,0|2,0,0]=4 4004 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 34a_200011997737_200025704644 [1,1,0,0,0,0|2,0,0]=4 4005 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 7a_200011997737_200025704644 [1,1,0,0,0,0|2,0,0]=4 4006 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Br 34a_100012351483_200025704644 [1,1,0,0,0,0|2,0,0]=4 4007 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Br 7a_100012351483_200025704644 [1,1,0,0,0,0|2,0,0]=4 4008 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Cl 34a_100000091669_200025704644 [1,1,0,0,0,0|2,0,0]=4 4009 B11R1.280 [13CH3]Oc1ccc(c(c1)CO)Cl 7a_100000091669_200025704644 [1,1,0,0,0,0|2,0,0]=4 4010 B13R1.299 C=C(C)c1cc(cc(c1N)OC)F 271570a_100000694244_100011004115 [0,2,0,0,0,0|2,0,0]=4 4011 B13R1.299 C=C(C)c1cc(cc(c1O)OC)F 271570a_100000694244_200010391102 [0,2,0,0,0,0|1,0,0]=3 4012 B13R1.299 CC(=O)c1cc(cc(c1O)S[13CH3])C 62a_200025704644_100011659362 [0,2,0,0,0,0|1,1,0]=4 4013 B13R1.299 COc1cc(cc(c1Cl)C(=O)C)Br 1458a_100015568607_200000210301 [0,2,0,0,0,0|2,0,0]=4 4014 B13R1.299 COc1cc(cc(c1Cl)C(=O)[13CH3])Br 1458a_100015568607_200025704644 [0,2,0,0,0,0|2,0,0]=4 4015 B13R1.299 COc1cc(cc(c1O)C(=O)C)Br 1458a_100012340195_200000210301 [0,2,0,0,0,0|1,0,0]=3 4016 B13R1.299 COc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100012340195_200025704644 [0,2,0,0,0,0|1,0,0]=3 4017 B13R1.299 CSc1cc(cc(c1O)C(=O)C)C 62a_200000210301_100011659362 [0,2,0,0,0,0|1,1,0]=4 4018 B13R1.302 CNc1cc(cc(c1C#N)OC)C 2230a_200021118069_200000210301 [0,2,0,0,0,0|2,0,0]=4 4019 B13R1.302 CNc1cc(cc(c1C#N)OC)C 7a_200021118069_200000210301 [0,2,0,0,0,0|2,0,0]=4 4020 B13R1.302 COc1cc(cc(c1C#N)N[13CH3])C 2230a_200021118069_200025704644 [0,2,0,0,0,0|2,0,0]=4 4021 B13R1.302 COc1cc(cc(c1C#N)N[13CH3])C 7a_200021118069_200025704644 [0,2,0,0,0,0|2,0,0]=4 4022 B13R1.302 COc1cc(cc(c1C=O)OC)O 271570a_203496583355_100010380724 [0,2,0,0,0,0|0,0,1]=3 4023 B13R1.302 COc1cc(cc(c1OC)C#N)O 271570a_203496583355_200010153271 [0,2,0,0,0,0|2,0,0]=4 4024 B13R1.302 COc1cc(cc(c1OC)C=O)O 271570a_203496583355_100009812253 [0,2,0,0,0,0|2,0,0]=4 4025 B13R1.302 COc1cc(cc(c1OC)CO)Br 34a_100000185604_200000210301 [0,2,0,0,0,0|2,0,0]=4 4026 B13R1.302 COc1cc(cc(c1OC)OC)Br 34a_100000691893_200000210301 [0,2,0,0,0,0|0,0,0]=2 4027 B13R1.302 COc1cc(cc(c1OC)OC)C 34a_100000186469_200000210301 [0,2,0,0,0,0|0,0,0]=2 4028 B13R1.302 COc1cc(cc(c1OC)OC)O 271570a_203496583355_100009814342 [0,2,0,0,0,0|0,0,0]=2 4029 B13R1.302 COc1cc(cc(c1O[13CH3])CO)Br 34a_100000185604_200025704644 [0,2,0,0,0,0|2,0,0]=4 4030 B13R1.302 COc1cc(cc(c1O[13CH3])OC)Br 34a_100000691893_200025704644 [0,2,0,0,0,0|0,0,0]=2 4031 B13R1.302 COc1cc(cc(c1O[13CH3])OC)C 34a_100000186469_200025704644 [0,2,0,0,0,0|0,0,0]=2 4032 B13R1.433 C=Cc1cc(c(c(c1)OC)F)OC 271570a_100011290941_100015304952 [0,2,0,0,0,0|1,0,0]=3 4033 B13R1.433 C=Cc1cc(c(c(c1)OC)O)CO 271570a_100011290941_100000185604 [0,2,0,0,0,0|2,0,0]=4 4034 B13R1.433 C=Cc1cc(c(c(c1)OC)O)OC 271570a_100011290941_100000691893 [0,2,0,0,0,0|0,0,0]=2 4035 B13R1.433 C=Cc1cc(cc(c1O)OC)C#N 271570a_100011290941_100000188612 [0,2,0,0,0,0|1,0,1]=4 4036 B13R1.433 C=Cc1cc(cc(c1O)OC)C=O 271570a_100011290941_100000184534 [0,2,0,0,0,0|1,0,1]=4 4037 B13R1.433 C=Cc1cc(cc(c1O)OC)CO 271570a_100011290941_200000022573 [0,2,0,0,0,0|1,0,1]=4 4038 B13R1.433 CNc1cc(c(c(c1)OC)Cl)OC 34a_100009986809_200000210301 [0,2,0,0,0,0|1,0,0]=3 4039 B13R1.433 CNc1cc(cc(c1Cl)OC)OC 34a_100009955059_200000210301 [0,2,0,0,0,0|2,0,0]=4 4040 B13R1.433 COc1cc(c(c(c1)OC)Cl)N[13CH3] 34a_100009955059_200025704644 [0,2,0,0,0,0|2,0,0]=4 4041 B13R1.433 COc1cc(c(c(c1)OC)Cl)OC 34a_100010658696_200000210301 [0,2,0,0,0,0|1,0,0]=3 4042 B13R1.433 COc1cc(c(c(c1)OC)Cl)OC 7a_100010658696_200000210301 [0,2,0,0,0,0|1,0,0]=3 4043 B13R1.433 COc1cc(c(c(c1)OC)O)OC 271570a_203496583355_100000186544 [0,2,0,0,0,0|0,0,0]=2 4044 B13R1.433 COc1cc(c(c(c1)O[13CH3])Cl)OC 34a_100010658696_200025704644 [0,2,0,0,0,0|1,0,0]=3 4045 B13R1.433 COc1cc(c(c(c1)O[13CH3])Cl)OC 7a_100010658696_200025704644 [0,2,0,0,0,0|1,0,0]=3 4046 B13R1.433 COc1cc(cc(c1Cl)OC)N[13CH3] 34a_100009986809_200025704644 [0,2,0,0,0,0|1,0,0]=3 4047 B13R1.433 COc1cc(cc(c1F)OC)SC 62a_100015304952_200000210301 [0,2,0,0,0,0|1,0,0]=3 4048 B13R1.433 COc1cc(cc(c1F)OC)SC 62a_200000210301_100015304952 [0,2,0,0,0,0|1,0,0]=3 4049 B13R1.433 COc1cc(cc(c1F)OC)S[13CH3] 62a_100015304952_200025704644 [0,2,0,0,0,0|1,0,0]=3 4050 B13R1.433 COc1cc(cc(c1F)OC)S[13CH3] 62a_200025704644_100015304952 [0,2,0,0,0,0|1,0,0]=3 4051 B13R1.433 COc1cc(cc(c1O)C=O)SC 62a_200000210301_100000047136 [0,2,0,0,0,0|2,0,0]=4 4052 B13R1.433 COc1cc(cc(c1O)C=O)S[13CH3] 62a_200025704644_100000047136 [0,2,0,0,0,0|2,0,0]=4 4053 B13R1.433 COc1cc(cc(c1O)CO)SC 62a_200000210301_100000185604 [0,2,0,0,0,0|2,0,0]=4 4054 B13R1.433 COc1cc(cc(c1O)CO)S[13CH3] 62a_200025704644_100000185604 [0,2,0,0,0,0|2,0,0]=4 4055 B13R1.433 COc1cc(cc(c1O)OC)CO 271570a_203496583355_100010169844 [0,2,0,0,0,0|0,0,0]=2 4056 B13R1.433 COc1cc(cc(c1O)SC)C#N 62a_200000210301_100000188612 [0,2,0,0,0,0|0,1,0]=3 4057 B13R1.433 COc1cc(cc(c1O)SC)C=O 62a_200000210301_100000184534 [0,2,0,0,0,0|0,1,0]=3 4058 B13R1.433 COc1cc(cc(c1O)SC)CO 62a_200000210301_200000022573 [0,2,0,0,0,0|0,1,0]=3 4059 B13R1.433 COc1cc(cc(c1O)S[13CH3])C#N 62a_200025704644_100000188612 [0,2,0,0,0,0|0,1,0]=3 4060 B13R1.433 COc1cc(cc(c1O)S[13CH3])C=O 62a_200025704644_100000184534 [0,2,0,0,0,0|0,1,0]=3 4061 B13R1.433 COc1cc(cc(c1O)S[13CH3])CO 62a_200025704644_200000022573 [0,2,0,0,0,0|0,1,0]=3 4062 B13R1.3982 C=C=Cc1cc(cc(c1O)OC)F 271570a_100015277604_200010391102 [0,2,0,0,0,0|1,0,1]=4 4063 B13R1.3982 CC=Cc1cc(cc(c1N)OC)F 271570a_100016259895_100011004115 [0,2,0,0,0,0|2,0,0]=4 4064 B13R1.3982 CC=Cc1cc(cc(c1O)OC)F 271570a_100016259895_200010391102 [0,2,0,0,0,0|1,0,0]=3 4065 B13R1.3982 CCOc1cc(cc(c1F)OC)Br 34a_200015524394_100000210202 [0,2,0,0,0,0|1,0,0]=3 4066 B13R1.3982 CCOc1cc(cc(c1F)OC)Br 7a_200015524394_100000210202 [0,2,0,0,0,0|1,0,0]=3 4067 B13R1.3982 CCSc1cc(cc(c1N)OC)F 62a_100000210202_100011004115 [0,2,0,0,0,0|1,1,0]=4 4068 B13R1.3982 CCSc1cc(cc(c1N)OC)F 62a_100011004115_100000210202 [0,2,0,0,0,0|1,1,0]=4 4069 B13R1.3982 CCSc1cc(cc(c1O)OC)F 62a_100000210202_200010391102 [0,2,0,0,0,0|0,1,0]=3 4070 B13R1.3982 CNCc1cc(cc(c1Br)OC)Br 207a_100102657272_200010986846 [0,2,0,0,0,0|2,0,0]=4 4071 B13R1.3982 CNCc1cc(cc(c1Br)OC)Br 270004a_106832991635_200010986846 [0,2,0,0,0,0|2,0,0]=4 4072 B13R1.3982 CNCc1cc(cc(c1F)OC)Br 26a_100102657272_200015524394 [0,2,0,0,0,0|2,0,0]=4 4073 B13R1.3982 COCc1cc(cc(c1Cl)OC)Cl 34a_100021527317_200000210301 [0,2,0,0,0,0|1,0,0]=3 4074 B13R1.3982 COCc1cc(cc(c1Cl)OC)Cl 7a_100021527317_200000210301 [0,2,0,0,0,0|1,0,0]=3 4075 B13R1.3982 COCc1cc(cc(c1N)OC)Br 34a_100010235085_200000210301 [0,2,0,0,0,0|1,0,0]=3 4076 B13R1.3982 COCc1cc(cc(c1N)OC)Br 7a_100010235085_200000210301 [0,2,0,0,0,0|1,0,0]=3 4077 B13R1.3982 COc1cc(cc(c1Cl)CO[13CH3])Cl 34a_100021527317_200025704644 [0,2,0,0,0,0|1,0,0]=3 4078 B13R1.3982 COc1cc(cc(c1Cl)CO[13CH3])Cl 7a_100021527317_200025704644 [0,2,0,0,0,0|1,0,0]=3 4079 B13R1.3982 COc1cc(cc(c1F)OCF)Br 34a_200015524394_100015361967 [0,2,0,0,0,0|1,0,0]=3 4080 B13R1.3982 COc1cc(cc(c1F)OCF)Br 7a_200015524394_100015361967 [0,2,0,0,0,0|1,0,0]=3 4081 B13R1.3982 COc1cc(cc(c1N)CO[13CH3])Br 34a_100010235085_200025704644 [0,2,0,0,0,0|1,0,0]=3 4082 B13R1.3982 COc1cc(cc(c1N)CO[13CH3])Br 7a_100010235085_200025704644 [0,2,0,0,0,0|1,0,0]=3 4083 B13R1.3982 COc1cc(cc(c1N)SCF)F 62a_100011004115_100015361967 [0,2,0,0,0,0|1,1,0]=4 4084 B13R1.3982 COc1cc(cc(c1N)SCF)F 62a_100015361967_100011004115 [0,2,0,0,0,0|1,1,0]=4 4085 B13R1.3982 COc1cc(cc(c1O)SCF)F 62a_100015361967_200010391102 [0,2,0,0,0,0|0,1,0]=3 4086 B13R1.82 C=Cc1cccc(c1O)C(=O)OC 271570a_100011290941_100009816214 [0,2,0,0,0,0|1,0,1]=4 4087 B13R1.82 CCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210202 [0,2,0,0,0,0|2,0,0]=4 4088 B13R1.82 CCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210202 [0,2,0,0,0,0|2,0,0]=4 4089 B13R1.82 CCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210202 [0,2,0,0,0,0|2,0,0]=4 4090 B13R1.82 CCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210202 [0,2,0,0,0,0|2,0,0]=4 4091 B13R1.82 CCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210202 [0,2,0,0,0,0|2,0,0]=4 4092 B13R1.82 CCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210202 [0,2,0,0,0,0|1,0,0]=3 4093 B13R1.82 CCc1cccc(c1O)C(=O)OC 271570a_203496583355_200009992460 [0,2,0,0,0,0|1,0,0]=3 4094 B13R1.82 CNC(=O)c1cccc(c1Br)OC 11a_106832991635_100010245468 [0,2,0,0,0,0|2,0,0]=4 4095 B13R1.82 CNC(=O)c1cccc(c1Br)OC 1626a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 4096 B13R1.82 CNC(=O)c1cccc(c1Br)OC 240690a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 4097 B13R1.82 CNC(=O)c1cccc(c1Br)OC 527a_100102657272_100010245468 [0,2,0,0,0,0|2,0,0]=4 4098 B13R1.82 CNC(=O)c1cccc(c1C)OC 11a_106832991635_100011217801 [0,2,0,0,0,0|2,0,0]=4 4099 B13R1.82 CNC(=O)c1cccc(c1C)OC 1626a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 4100 B13R1.82 CNC(=O)c1cccc(c1C)OC 240690a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 4101 B13R1.82 CNC(=O)c1cccc(c1C)OC 527a_100102657272_100011217801 [0,2,0,0,0,0|2,0,0]=4 4102 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 11a_106832991635_100000068443 [0,2,0,0,0,0|2,0,0]=4 4103 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 1626a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 4104 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 240690a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 4105 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 527a_100102657272_100000068443 [0,2,0,0,0,0|2,0,0]=4 4106 B13R1.82 CNC(=O)c1cccc(c1F)OC 11a_106832991635_100000766180 [0,2,0,0,0,0|2,0,0]=4 4107 B13R1.82 CNC(=O)c1cccc(c1F)OC 1626a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 4108 B13R1.82 CNC(=O)c1cccc(c1F)OC 240690a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 4109 B13R1.82 CNC(=O)c1cccc(c1F)OC 527a_100102657272_100000766180 [0,2,0,0,0,0|2,0,0]=4 4110 B13R1.82 CNC(=O)c1cccc(c1I)OC 11a_106832991635_100010075502 [0,2,0,0,0,0|2,0,0]=4 4111 B13R1.82 CNC(=O)c1cccc(c1I)OC 1626a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 4112 B13R1.82 CNC(=O)c1cccc(c1I)OC 240690a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 4113 B13R1.82 CNC(=O)c1cccc(c1I)OC 527a_100102657272_100010075502 [0,2,0,0,0,0|2,0,0]=4 4114 B13R1.82 CNC(=O)c1cccc(c1O)OC 240690a_100102657272_100000212136 [0,2,0,0,0,0|1,0,0]=3 4115 B13R1.82 CNC(=O)c1cccc(c1O)OC 527a_100102657272_100000212136 [0,2,0,0,0,0|1,0,0]=3 4116 B13R1.82 CNC(C)c1cccc(c1F)OC 269862a_106832991636_100012180810 [0,2,0,0,0,0|2,0,0]=4 4117 B13R1.82 COC(=O)c1cccc(c1Br)OC 34a_200010230364_200000210301 [0,2,0,0,0,0|1,0,0]=3 4118 B13R1.82 COC(=O)c1cccc(c1Br)OC 7a_200010230364_200000210301 [0,2,0,0,0,0|1,0,0]=3 4119 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 34a_200010230364_200025704644 [0,2,0,0,0,0|1,0,0]=3 4120 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 7a_200010230364_200025704644 [0,2,0,0,0,0|1,0,0]=3 4121 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_100010240208_200000210301 [0,2,0,0,0,0|1,1,0]=4 4122 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_200000210301_100010240208 [0,2,0,0,0,0|1,1,0]=4 4123 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_100010240208_200025704644 [0,2,0,0,0,0|1,1,0]=4 4124 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_200025704644_100010240208 [0,2,0,0,0,0|1,1,0]=4 4125 B13R1.82 COC(=O)c1cccc(c1C)OC 34a_100011999632_200000210301 [0,2,0,0,0,0|1,0,0]=3 4126 B13R1.82 COC(=O)c1cccc(c1C)OC 7a_100011999632_200000210301 [0,2,0,0,0,0|1,0,0]=3 4127 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 34a_100011999632_200025704644 [0,2,0,0,0,0|1,0,0]=3 4128 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 7a_100011999632_200025704644 [0,2,0,0,0,0|1,0,0]=3 4129 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_100012298220_200000210301 [0,2,0,0,0,0|1,1,0]=4 4130 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_200000210301_100012298220 [0,2,0,0,0,0|1,1,0]=4 4131 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_100012298220_200025704644 [0,2,0,0,0,0|1,1,0]=4 4132 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298220 [0,2,0,0,0,0|1,1,0]=4 4133 B13R1.82 COC(=O)c1cccc(c1Cl)OC 34a_100009866855_200000210301 [0,2,0,0,0,0|1,0,0]=3 4134 B13R1.82 COC(=O)c1cccc(c1Cl)OC 7a_100009866855_200000210301 [0,2,0,0,0,0|1,0,0]=3 4135 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 34a_100009866855_200025704644 [0,2,0,0,0,0|1,0,0]=3 4136 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 7a_100009866855_200025704644 [0,2,0,0,0,0|1,0,0]=3 4137 B13R1.82 COC(=O)c1cccc(c1F)OC 34a_100009854753_200000210301 [0,2,0,0,0,0|1,0,0]=3 4138 B13R1.82 COC(=O)c1cccc(c1F)OC 7a_100009854753_200000210301 [0,2,0,0,0,0|1,0,0]=3 4139 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 34a_100009854753_200025704644 [0,2,0,0,0,0|1,0,0]=3 4140 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 7a_100009854753_200025704644 [0,2,0,0,0,0|1,0,0]=3 4141 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_100012355674_200000210301 [0,2,0,0,0,0|1,1,0]=4 4142 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_200000210301_100012355674 [0,2,0,0,0,0|1,1,0]=4 4143 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_100012355674_200025704644 [0,2,0,0,0,0|1,1,0]=4 4144 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355674 [0,2,0,0,0,0|1,1,0]=4 4145 B13R1.82 COC(=O)c1cccc(c1N)OC 34a_100015205654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4146 B13R1.82 COC(=O)c1cccc(c1N)OC 7a_100015205654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4147 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 34a_100015205654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4148 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 7a_100015205654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4149 B13R1.82 COC(=O)c1cccc(c1N)SC 62a_100011356556_200000210301 [0,2,0,0,0,0|1,1,0]=4 4150 B13R1.82 COC(=O)c1cccc(c1N)S[13CH3] 62a_100011356556_200025704644 [0,2,0,0,0,0|1,1,0]=4 4151 B13R1.82 COC(=O)c1cccc(c1O)OC 271570a_203496583355_100010189551 [0,2,0,0,0,0|0,0,0]=2 4152 B13R1.82 COC(=O)c1cccc(c1O)SC 62a_100009816214_200000210301 [0,2,0,0,0,0|0,1,0]=3 4153 B13R1.82 COC(=O)c1cccc(c1O)S[13CH3] 62a_100009816214_200025704644 [0,2,0,0,0,0|0,1,0]=3 4154 B13R1.82 COC(C)c1cccc(c1F)SC 62a_200000210301_200010365929 [0,2,0,0,0,0|1,1,0]=4 4155 B13R1.82 COC(C)c1cccc(c1F)SC 62a_200010365929_200000210301 [0,2,0,0,0,0|1,1,0]=4 4156 B13R1.82 COC(C)c1cccc(c1F)S[13CH3] 62a_200010365929_200025704644 [0,2,0,0,0,0|1,1,0]=4 4157 B13R1.82 COC(C)c1cccc(c1F)S[13CH3] 62a_200025704644_200010365929 [0,2,0,0,0,0|1,1,0]=4 4158 B13R1.82 COc1cccc(c1Br)C(=O)CF 1458a_100010245468_100015361967 [0,2,0,0,0,0|2,0,0]=4 4159 B13R1.82 COc1cccc(c1C)C(=O)CF 1458a_100011217801_100015361967 [0,2,0,0,0,0|2,0,0]=4 4160 B13R1.82 COc1cccc(c1Cl)C(=O)CF 1458a_100000068443_100015361967 [0,2,0,0,0,0|2,0,0]=4 4161 B13R1.82 COc1cccc(c1F)C(=O)CF 1458a_100000766180_100015361967 [0,2,0,0,0,0|2,0,0]=4 4162 B13R1.82 COc1cccc(c1I)C(=O)CF 1458a_100010075502_100015361967 [0,2,0,0,0,0|2,0,0]=4 4163 B13R1.82 COc1cccc(c1O)C(=O)CF 1458a_100000212136_100015361967 [0,2,0,0,0,0|1,0,0]=3 4164 B13R1.376 CC=Cc1cccc(c1C)COC 271570a_100016259895_100102485947 [0,2,0,0,0,0|2,0,0]=4 4165 B13R1.376 CC=Cc1cccc(c1N)OCC 271570a_100016259895_200103155331 [0,2,0,0,0,0|2,0,0]=4 4166 B13R1.376 CCOc1cccc(c1Br)CNC 207a_100102657272_200011094417 [0,2,0,0,0,0|2,0,0]=4 4167 B13R1.376 CCOc1cccc(c1Br)CNC 270004a_106832991635_200011094417 [0,2,0,0,0,0|2,0,0]=4 4168 B13R1.376 CCOc1cccc(c1F)CNC 207a_100102657272_100010624114 [0,2,0,0,0,0|2,0,0]=4 4169 B13R1.376 CCOc1cccc(c1F)CNC 270004a_106832991635_100010624114 [0,2,0,0,0,0|2,0,0]=4 4170 B13R1.376 CCOc1cccc(c1N)SCC 62a_200103155331_100000210202 [0,2,0,0,0,0|1,1,0]=4 4171 B13R1.376 CCOc1cccc(c1N)SCF 62a_200103155331_100015361967 [0,2,0,0,0,0|1,1,0]=4 4172 B13R1.376 CCSc1cccc(c1C)COC 62a_100000210202_100102485947 [0,2,0,0,0,0|1,1,0]=4 4173 B13R1.376 CCSc1cccc(c1C)COC 62a_100102485947_100000210202 [0,2,0,0,0,0|1,1,0]=4 4174 B13R1.376 COCc1cccc(c1C)SCF 62a_100015361967_100102485947 [0,2,0,0,0,0|1,1,0]=4 4175 B13R1.376 COCc1cccc(c1C)SCF 62a_100102485947_100015361967 [0,2,0,0,0,0|1,1,0]=4 4176 B13R1.377 C=C(C)c1cccc(c1C)COC 271570a_100000694244_100102485947 [0,2,0,0,0,0|2,0,0]=4 4177 B13R1.377 C=C(C)c1cccc(c1N)OCC 271570a_100000694244_200103155331 [0,2,0,0,0,0|2,0,0]=4 4178 B13R1.377 CC(=O)c1cccc(c1C)OCF 34a_200009877264_100015361967 [0,2,0,0,0,0|2,0,0]=4 4179 B13R1.377 CC(=O)c1cccc(c1C)OCF 7a_200009877264_100015361967 [0,2,0,0,0,0|2,0,0]=4 4180 B13R1.377 CC(=O)c1cccc(c1F)OCF 34a_100009856408_100015361967 [0,2,0,0,0,0|2,0,0]=4 4181 B13R1.377 CC(=O)c1cccc(c1F)OCF 7a_100009856408_100015361967 [0,2,0,0,0,0|2,0,0]=4 4182 B13R1.377 CC(=O)c1cccc(c1N)OCF 7a_100000036053_100015361967 [0,2,0,0,0,0|2,0,0]=4 4183 B13R1.377 CC=Cc1cccc(c1O)C(=O)C 271570a_100016259895_100009815558 [0,2,0,0,0,0|2,0,0]=4 4184 B13R1.377 CCOc1cccc(c1C)C(=O)C 34a_200009877264_100000210202 [0,2,0,0,0,0|2,0,0]=4 4185 B13R1.377 CCOc1cccc(c1C)C(=O)C 7a_200009877264_100000210202 [0,2,0,0,0,0|2,0,0]=4 4186 B13R1.377 CCOc1cccc(c1F)C(=O)C 1458a_100000100213_200000210301 [0,2,0,0,0,0|2,0,0]=4 4187 B13R1.377 CCOc1cccc(c1F)C(=O)C 34a_100009856408_100000210202 [0,2,0,0,0,0|2,0,0]=4 4188 B13R1.377 CCOc1cccc(c1F)C(=O)C 7a_100009856408_100000210202 [0,2,0,0,0,0|2,0,0]=4 4189 B13R1.377 CCOc1cccc(c1F)C(=O)[13CH3] 1458a_100000100213_200025704644 [0,2,0,0,0,0|2,0,0]=4 4190 B13R1.377 CCOc1cccc(c1N)C(=O)C 7a_100000036053_100000210202 [0,2,0,0,0,0|2,0,0]=4 4191 B13R1.569 C#CCNc1cccc(c1Br)OC 34a_100000703447_100000184674 [0,2,0,0,0,0|2,0,0]=4 4192 B13R1.569 C#CCNc1cccc(c1C)OC 34a_100011244893_100000184674 [0,2,0,0,0,0|2,0,0]=4 4193 B13R1.569 C#CCNc1cccc(c1C)OC 7a_100011244893_100000038162 [0,2,0,0,0,0|2,0,0]=4 4194 B13R1.569 C#CCNc1cccc(c1Cl)OC 34a_100000089720_100000184674 [0,2,0,0,0,0|2,0,0]=4 4195 B13R1.569 C#CCNc1cccc(c1F)OC 34a_100000100910_100000184674 [0,2,0,0,0,0|2,0,0]=4 4196 B13R1.569 C#CCNc1cccc(c1I)OC 34a_100010245509_100000184674 [0,2,0,0,0,0|2,0,0]=4 4197 B13R1.569 C#CCNc1cccc(c1O)OC 34a_100000123586_100000184674 [0,2,0,0,0,0|1,0,0]=3 4198 B13R1.569 C#CCOc1cccc(c1Br)OC 34a_100010202623_100000184674 [0,2,0,0,0,0|1,0,0]=3 4199 B13R1.569 C#CCOc1cccc(c1Br)OC 7a_100010202623_100000038162 [0,2,0,0,0,0|1,0,0]=3 4200 B13R1.569 C#CCOc1cccc(c1Cl)OC 34a_100000087810_100000184674 [0,2,0,0,0,0|1,0,0]=3 4201 B13R1.569 C#CCOc1cccc(c1Cl)OC 7a_100000087810_100000038162 [0,2,0,0,0,0|1,0,0]=3 4202 B13R1.569 C#CCOc1cccc(c1F)OC 34a_100000102366_100000184674 [0,2,0,0,0,0|1,0,0]=3 4203 B13R1.569 C#CCOc1cccc(c1F)OC 7a_100000102366_100000038162 [0,2,0,0,0,0|1,0,0]=3 4204 B13R1.569 C#CCOc1cccc(c1I)OC 34a_200010201982_100000184674 [0,2,0,0,0,0|1,0,0]=3 4205 B13R1.569 C#CCOc1cccc(c1I)OC 7a_200010201982_100000038162 [0,2,0,0,0,0|1,0,0]=3 4206 B13R1.569 C#CCOc1cccc(c1N)OC 34a_100012022766_100000184674 [0,2,0,0,0,0|1,0,0]=3 4207 B13R1.569 C#CCOc1cccc(c1N)OC 7a_100012022766_100000038162 [0,2,0,0,0,0|1,0,0]=3 4208 B13R1.569 C#CCSc1cccc(c1Br)OC 62a_100000038162_100010146559 [0,2,0,0,0,0|1,1,0]=4 4209 B13R1.569 C#CCSc1cccc(c1C)OC 62a_100000038162_100010002647 [0,2,0,0,0,0|1,1,0]=4 4210 B13R1.569 C#CCSc1cccc(c1Cl)OC 62a_100000038162_100010147677 [0,2,0,0,0,0|1,1,0]=4 4211 B13R1.569 C#CCSc1cccc(c1F)OC 62a_100000038162_100010185846 [0,2,0,0,0,0|1,1,0]=4 4212 B13R1.569 C#CCSc1cccc(c1O)CC 62a_100000038162_200010001580 [0,2,0,0,0,0|1,1,0]=4 4213 B13R1.569 C#CCSc1cccc(c1O)OC 62a_100000038162_100000686866 [0,2,0,0,0,0|0,1,0]=3 4214 B13R1.569 C=CCNc1cccc(c1Br)OC 34a_100000703447_100015514636 [0,2,0,0,0,0|2,0,0]=4 4215 B13R1.569 C=CCNc1cccc(c1C)OC 34a_100011244893_100015514636 [0,2,0,0,0,0|2,0,0]=4 4216 B13R1.569 C=CCNc1cccc(c1C)OC 7a_100011244893_100015514636 [0,2,0,0,0,0|2,0,0]=4 4217 B13R1.569 C=CCNc1cccc(c1Cl)OC 34a_100000089720_100015514636 [0,2,0,0,0,0|2,0,0]=4 4218 B13R1.569 C=CCNc1cccc(c1F)OC 34a_100000100910_100015514636 [0,2,0,0,0,0|2,0,0]=4 4219 B13R1.569 C=CCNc1cccc(c1I)OC 34a_100010245509_100015514636 [0,2,0,0,0,0|2,0,0]=4 4220 B13R1.569 C=CCNc1cccc(c1O)OC 34a_100000123586_100015514636 [0,2,0,0,0,0|1,0,0]=3 4221 B13R1.569 C=CCOc1cccc(c1Br)OC 34a_100010202623_100015514636 [0,2,0,0,0,0|1,0,0]=3 4222 B13R1.569 C=CCOc1cccc(c1Br)OC 7a_100010202623_100015514636 [0,2,0,0,0,0|1,0,0]=3 4223 B13R1.569 C=CCOc1cccc(c1Cl)OC 34a_100000087810_100015514636 [0,2,0,0,0,0|1,0,0]=3 4224 B13R1.569 C=CCOc1cccc(c1Cl)OC 7a_100000087810_100015514636 [0,2,0,0,0,0|1,0,0]=3 4225 B13R1.569 C=CCOc1cccc(c1F)OC 34a_100000102366_100015514636 [0,2,0,0,0,0|1,0,0]=3 4226 B13R1.569 C=CCOc1cccc(c1F)OC 7a_100000102366_100015514636 [0,2,0,0,0,0|1,0,0]=3 4227 B13R1.569 C=CCOc1cccc(c1I)OC 34a_200010201982_100015514636 [0,2,0,0,0,0|1,0,0]=3 4228 B13R1.569 C=CCOc1cccc(c1I)OC 7a_200010201982_100015514636 [0,2,0,0,0,0|1,0,0]=3 4229 B13R1.569 C=CCOc1cccc(c1N)OC 34a_100012022766_100015514636 [0,2,0,0,0,0|1,0,0]=3 4230 B13R1.569 C=CCOc1cccc(c1N)OC 7a_100012022766_100015514636 [0,2,0,0,0,0|1,0,0]=3 4231 B13R1.569 C=CCSc1cccc(c1Br)OC 62a_100000210623_100010146559 [0,2,0,0,0,0|1,1,0]=4 4232 B13R1.569 C=CCSc1cccc(c1Br)OC 62a_100010146559_100000210623 [0,2,0,0,0,0|1,1,0]=4 4233 B13R1.569 C=CCSc1cccc(c1C)OC 62a_100000210623_100010002647 [0,2,0,0,0,0|1,1,0]=4 4234 B13R1.569 C=CCSc1cccc(c1C)OC 62a_100010002647_100000210623 [0,2,0,0,0,0|1,1,0]=4 4235 B13R1.569 C=CCSc1cccc(c1Cl)OC 62a_100000210623_100010147677 [0,2,0,0,0,0|1,1,0]=4 4236 B13R1.569 C=CCSc1cccc(c1Cl)OC 62a_100010147677_100000210623 [0,2,0,0,0,0|1,1,0]=4 4237 B13R1.569 C=CCSc1cccc(c1F)OC 62a_100000210623_100010185846 [0,2,0,0,0,0|1,1,0]=4 4238 B13R1.569 C=CCSc1cccc(c1F)OC 62a_100010185846_100000210623 [0,2,0,0,0,0|1,1,0]=4 4239 B13R1.569 C=CCSc1cccc(c1N)OC 62a_100000708083_100000210623 [0,2,0,0,0,0|1,1,0]=4 4240 B13R1.569 C=CCSc1cccc(c1O)CC 62a_100000210623_200010001580 [0,2,0,0,0,0|1,1,0]=4 4241 B13R1.569 C=CCSc1cccc(c1O)CC 62a_200010001580_100000210623 [0,2,0,0,0,0|1,1,0]=4 4242 B13R1.569 C=CCSc1cccc(c1O)OC 62a_100000210623_100000686866 [0,2,0,0,0,0|0,1,0]=3 4243 B13R1.569 CCCCc1cccc(c1C)OC 271570a_100020621405_100010002647 [0,2,0,0,0,0|2,0,0]=4 4244 B13R1.569 CCCCc1cccc(c1Cl)OC 271570a_100020621405_100010147677 [0,2,0,0,0,0|2,0,0]=4 4245 B13R1.569 CCCCc1cccc(c1F)OC 271570a_100020621405_100010185846 [0,2,0,0,0,0|2,0,0]=4 4246 B13R1.569 CCCCc1cccc(c1N)OC 271570a_100020621405_100000708083 [0,2,0,0,0,0|2,0,0]=4 4247 B13R1.569 CCCCc1cccc(c1O)CC 271570a_100020621405_200010001580 [0,2,0,0,0,0|2,0,0]=4 4248 B13R1.569 CCCCc1cccc(c1O)OC 271570a_100020621405_100000686866 [0,2,0,0,0,0|1,0,0]=3 4249 B13R1.569 CCCNc1cccc(c1Br)OC 34a_100000703447_100000210303 [0,2,0,0,0,0|2,0,0]=4 4250 B13R1.569 CCCNc1cccc(c1C)OC 34a_100011244893_100000210303 [0,2,0,0,0,0|2,0,0]=4 4251 B13R1.569 CCCNc1cccc(c1C)OC 7a_100011244893_100000210303 [0,2,0,0,0,0|2,0,0]=4 4252 B13R1.569 CCCNc1cccc(c1Cl)OC 34a_100000089720_100000210303 [0,2,0,0,0,0|2,0,0]=4 4253 B13R1.569 CCCNc1cccc(c1F)OC 34a_100000100910_100000210303 [0,2,0,0,0,0|2,0,0]=4 4254 B13R1.569 CCCNc1cccc(c1I)OC 34a_100010245509_100000210303 [0,2,0,0,0,0|2,0,0]=4 4255 B13R1.569 CCCNc1cccc(c1O)OC 34a_100000123586_100000210303 [0,2,0,0,0,0|1,0,0]=3 4256 B13R1.569 CCCOc1cccc(c1Br)OC 34a_100010202623_100000210303 [0,2,0,0,0,0|1,0,0]=3 4257 B13R1.569 CCCOc1cccc(c1Br)OC 7a_100010202623_100000210303 [0,2,0,0,0,0|1,0,0]=3 4258 B13R1.569 CCCOc1cccc(c1Cl)OC 34a_100000087810_100000210303 [0,2,0,0,0,0|1,0,0]=3 4259 B13R1.569 CCCOc1cccc(c1Cl)OC 7a_100000087810_100000210303 [0,2,0,0,0,0|1,0,0]=3 4260 B13R1.569 CCCOc1cccc(c1F)OC 34a_100000102366_100000210303 [0,2,0,0,0,0|1,0,0]=3 4261 B13R1.569 CCCOc1cccc(c1F)OC 7a_100000102366_100000210303 [0,2,0,0,0,0|1,0,0]=3 4262 B13R1.569 CCCOc1cccc(c1I)OC 34a_200010201982_100000210303 [0,2,0,0,0,0|1,0,0]=3 4263 B13R1.569 CCCOc1cccc(c1I)OC 7a_200010201982_100000210303 [0,2,0,0,0,0|1,0,0]=3 4264 B13R1.569 CCCOc1cccc(c1N)OC 34a_100012022766_100000210303 [0,2,0,0,0,0|1,0,0]=3 4265 B13R1.569 CCCOc1cccc(c1N)OC 7a_100012022766_100000210303 [0,2,0,0,0,0|1,0,0]=3 4266 B13R1.569 CCCSc1cccc(c1Br)OC 62a_100000210303_100010146559 [0,2,0,0,0,0|1,1,0]=4 4267 B13R1.569 CCCSc1cccc(c1Br)OC 62a_100010146559_100000210303 [0,2,0,0,0,0|1,1,0]=4 4268 B13R1.569 CCCSc1cccc(c1C)OC 62a_100000210303_100010002647 [0,2,0,0,0,0|1,1,0]=4 4269 B13R1.569 CCCSc1cccc(c1C)OC 62a_100010002647_100000210303 [0,2,0,0,0,0|1,1,0]=4 4270 B13R1.569 CCCSc1cccc(c1Cl)OC 62a_100000210303_100010147677 [0,2,0,0,0,0|1,1,0]=4 4271 B13R1.569 CCCSc1cccc(c1Cl)OC 62a_100010147677_100000210303 [0,2,0,0,0,0|1,1,0]=4 4272 B13R1.569 CCCSc1cccc(c1F)OC 62a_100000210303_100010185846 [0,2,0,0,0,0|1,1,0]=4 4273 B13R1.569 CCCSc1cccc(c1F)OC 62a_100010185846_100000210303 [0,2,0,0,0,0|1,1,0]=4 4274 B13R1.569 CCCSc1cccc(c1N)OC 62a_100000708083_100000210303 [0,2,0,0,0,0|1,1,0]=4 4275 B13R1.569 CCCSc1cccc(c1O)CC 62a_100000210303_200010001580 [0,2,0,0,0,0|1,1,0]=4 4276 B13R1.569 CCCSc1cccc(c1O)CC 62a_200010001580_100000210303 [0,2,0,0,0,0|1,1,0]=4 4277 B13R1.569 CCCSc1cccc(c1O)OC 62a_100000210303_100000686866 [0,2,0,0,0,0|0,1,0]=3 4278 B13R1.569 CCNCc1cccc(c1Br)OC 207a_100015525214_100010209554 [0,2,0,0,0,0|2,0,0]=4 4279 B13R1.569 CCNCc1cccc(c1Br)OC 270004a_100015525214_100010209554 [0,2,0,0,0,0|2,0,0]=4 4280 B13R1.569 CCNCc1cccc(c1C)OC 207a_100015525214_100000101217 [0,2,0,0,0,0|2,0,0]=4 4281 B13R1.569 CCNCc1cccc(c1C)OC 2230a_100015525214_100009876938 [0,2,0,0,0,0|2,0,0]=4 4282 B13R1.569 CCNCc1cccc(c1C)OC 270004a_100015525214_100000101217 [0,2,0,0,0,0|2,0,0]=4 4283 B13R1.569 CCNCc1cccc(c1Cl)OC 207a_100015525214_100000068750 [0,2,0,0,0,0|2,0,0]=4 4284 B13R1.569 CCNCc1cccc(c1Cl)OC 2230a_100015525214_200010147866 [0,2,0,0,0,0|2,0,0]=4 4285 B13R1.569 CCNCc1cccc(c1Cl)OC 270004a_100015525214_100000068750 [0,2,0,0,0,0|2,0,0]=4 4286 B13R1.569 CCNCc1cccc(c1F)OC 207a_100015525214_100000692048 [0,2,0,0,0,0|2,0,0]=4 4287 B13R1.569 CCNCc1cccc(c1F)OC 2230a_100015525214_100011260763 [0,2,0,0,0,0|2,0,0]=4 4288 B13R1.569 CCNCc1cccc(c1F)OC 270004a_100015525214_100000692048 [0,2,0,0,0,0|2,0,0]=4 4289 B13R1.569 CCNCc1cccc(c1F)OC 34a_100137345169_100000210202 [0,2,0,0,0,0|2,0,0]=4 4290 B13R1.569 CCOCc1cccc(c1Br)OC 34a_100010146792_100000210202 [0,2,0,0,0,0|1,0,0]=3 4291 B13R1.569 CCOCc1cccc(c1Br)OC 7a_100010146792_100000210202 [0,2,0,0,0,0|1,0,0]=3 4292 B13R1.569 CCOCc1cccc(c1C)OC 34a_100009871736_100000210202 [0,2,0,0,0,0|1,0,0]=3 4293 B13R1.569 CCOCc1cccc(c1C)OC 34a_100121572206_100009876938 [0,2,0,0,0,0|1,0,0]=3 4294 B13R1.569 CCOCc1cccc(c1C)OC 7a_100009871736_100000210202 [0,2,0,0,0,0|1,0,0]=3 4295 B13R1.569 CCOCc1cccc(c1Cl)OC 34a_100121572206_200010147866 [0,2,0,0,0,0|1,0,0]=3 4296 B13R1.569 CCOCc1cccc(c1F)OC 34a_100011935170_100000210202 [0,2,0,0,0,0|1,0,0]=3 4297 B13R1.569 CCOCc1cccc(c1F)OC 34a_100121572206_100011260763 [0,2,0,0,0,0|1,0,0]=3 4298 B13R1.569 CCOCc1cccc(c1F)OC 7a_100011935170_100000210202 [0,2,0,0,0,0|1,0,0]=3 4299 B13R1.569 CCOCc1cccc(c1I)OC 34a_100010236476_100000210202 [0,2,0,0,0,0|1,0,0]=3 4300 B13R1.569 CCOCc1cccc(c1I)OC 7a_100010236476_100000210202 [0,2,0,0,0,0|1,0,0]=3 4301 B13R1.569 CCOCc1cccc(c1N)OC 34a_100011999522_100000210202 [0,2,0,0,0,0|1,0,0]=3 4302 B13R1.569 CCOCc1ccnc(c1Cl)OC 34a_100009844655_100000210202 [0,2,0,0,0,0|2,0,0]=4 4303 B13R1.569 CCOCc1nccc(c1C)OC 34a_100000087669_100000210202 [0,2,0,0,0,0|2,0,0]=4 4304 B13R1.569 CCOCc1nccc(c1C)OC 34a_100121572206_100016994983 [0,2,0,0,0,0|2,0,0]=4 4305 B13R1.569 CCSCc1cccc(c1C)OC 62a_100000210202_100009876938 [0,2,0,0,0,0|1,1,0]=4 4306 B13R1.569 CCSCc1cccc(c1C)OC 62a_100009876938_100000210202 [0,2,0,0,0,0|1,1,0]=4 4307 B13R1.569 CCSCc1cccc(c1Cl)OC 62a_100000210202_200010147866 [0,2,0,0,0,0|1,1,0]=4 4308 B13R1.569 CCSCc1cccc(c1Cl)OC 62a_200010147866_100000210202 [0,2,0,0,0,0|1,1,0]=4 4309 B13R1.569 CCSCc1cccc(c1F)OC 62a_100000210202_100011260763 [0,2,0,0,0,0|1,1,0]=4 4310 B13R1.569 CCSCc1cccc(c1F)OC 62a_100011260763_100000210202 [0,2,0,0,0,0|1,1,0]=4 4311 B13R1.569 CCc1cccc(c1O)SCC#N 62a_100011215382_200010001580 [0,2,0,0,0,0|1,1,0]=4 4312 B13R1.569 CCc1cccc(c1O)SCC#N 62a_200010001580_100011215382 [0,2,0,0,0,0|1,1,0]=4 4313 B13R1.569 CCc1cccc(c1O)SCC=O 62a_200010001580_200015260668 [0,2,0,0,0,0|1,1,0]=4 4314 B13R1.569 CCc1cccc(c1O)SCC=O 62a_200015260668_200010001580 [0,2,0,0,0,0|1,1,0]=4 4315 B13R1.569 CCc1cccc(c1O)SCCF 62a_100011217306_200010001580 [0,2,0,0,0,0|1,1,0]=4 4316 B13R1.569 CCc1cccc(c1O)SCCF 62a_200010001580_100011217306 [0,2,0,0,0,0|1,1,0]=4 4317 B13R1.569 CCc1cccc(c1O)SCCO 62a_100000211926_200010001580 [0,2,0,0,0,0|1,1,0]=4 4318 B13R1.569 CCc1cccc(c1O)SCCO 62a_200010001580_100000211926 [0,2,0,0,0,0|1,1,0]=4 4319 B13R1.569 CCc1cccc(c1O)SCOC 62a_100000766300_200010001580 [0,2,0,0,0,0|1,0,0]=3 4320 B13R1.569 CCc1cccc(c1O)SCOC 62a_200010001580_100000766300 [0,2,0,0,0,0|1,0,0]=3 4321 B13R1.569 CCc1cccc(c1O)SCSC 62a_100011218213_200010001580 [0,2,0,0,0,0|1,1,0]=4 4322 B13R1.569 CCc1cccc(c1O)SCSC 62a_200010001580_100011218213 [0,2,0,0,0,0|1,1,0]=4 4323 B13R1.569 CNc1cccc(c1N)SCOC 62a_100000695761_100000766300 [0,2,0,0,0,0|2,0,0]=4 4324 B13R1.569 COCSc1cccc(c1Br)OC 62a_100000766300_100010146559 [0,2,0,0,0,0|1,0,0]=3 4325 B13R1.569 COCSc1cccc(c1Br)OC 62a_100010146559_100000766300 [0,2,0,0,0,0|1,0,0]=3 4326 B13R1.569 COCSc1cccc(c1C)OC 62a_100000766300_100010002647 [0,2,0,0,0,0|1,0,0]=3 4327 B13R1.569 COCSc1cccc(c1C)OC 62a_100010002647_100000766300 [0,2,0,0,0,0|1,0,0]=3 4328 B13R1.569 COCSc1cccc(c1Cl)OC 62a_100000766300_100010147677 [0,2,0,0,0,0|1,0,0]=3 4329 B13R1.569 COCSc1cccc(c1Cl)OC 62a_100010147677_100000766300 [0,2,0,0,0,0|1,0,0]=3 4330 B13R1.569 COCSc1cccc(c1F)OC 62a_100000766300_100010185846 [0,2,0,0,0,0|1,0,0]=3 4331 B13R1.569 COCSc1cccc(c1F)OC 62a_100010185846_100000766300 [0,2,0,0,0,0|1,0,0]=3 4332 B13R1.569 COCSc1cccc(c1N)OC 62a_100000708083_100000766300 [0,2,0,0,0,0|1,0,0]=3 4333 B13R1.569 COCSc1cccc(c1O)C#N 62a_100000766300_100009817103 [0,2,0,0,0,0|2,0,0]=4 4334 B13R1.569 COCSc1cccc(c1O)C=O 62a_100000766300_100010171435 [0,2,0,0,0,0|2,0,0]=4 4335 B13R1.569 COCSc1cccc(c1O)OC 62a_100000766300_100000686866 [0,2,0,0,0,0|0,0,0]=2 4336 B13R1.569 COCSc1ccnc(c1C)OC 62a_100000766300_100010068544 [0,2,0,0,0,0|2,0,0]=4 4337 B13R1.569 COCSc1ccnc(c1C)OC 62a_100010068544_100000766300 [0,2,0,0,0,0|2,0,0]=4 4338 B13R1.569 COCSc1ccnc(c1F)OC 62a_100000766300_100009885657 [0,2,0,0,0,0|2,0,0]=4 4339 B13R1.569 COCSc1ccnc(c1F)OC 62a_100009885657_100000766300 [0,2,0,0,0,0|2,0,0]=4 4340 B13R1.569 COCSc1cncc(c1C)OC 62a_100000766300_100010136163 [0,2,0,0,0,0|2,0,0]=4 4341 B13R1.569 COCSc1cncc(c1C)OC 62a_100010136163_100000766300 [0,2,0,0,0,0|2,0,0]=4 4342 B13R1.569 COCSc1nccc(c1C)OC 62a_100000766300_100010067686 [0,2,0,0,0,0|2,0,0]=4 4343 B13R1.569 COCSc1nccc(c1C)OC 62a_100010067686_100000766300 [0,2,0,0,0,0|2,0,0]=4 4344 B13R1.569 COCSc1nccc(c1F)OC 62a_100000766300_200010136267 [0,2,0,0,0,0|2,0,0]=4 4345 B13R1.569 COCSc1nccc(c1F)OC 62a_200010136267_100000766300 [0,2,0,0,0,0|2,0,0]=4 4346 B13R1.569 COCSc1nccc(c1N)OC 62a_100000766300_100000100113 [0,2,0,0,0,0|2,0,0]=4 4347 B13R1.569 COCSc1nccc(c1N)OC 62a_100010233645_100000766300 [0,2,0,0,0,0|2,0,0]=4 4348 B13R1.569 COc1cccc(c1Br)COCF 34a_100010146792_100015361967 [0,2,0,0,0,0|1,0,0]=3 4349 B13R1.569 COc1cccc(c1Br)COCF 7a_100010146792_100015361967 [0,2,0,0,0,0|1,0,0]=3 4350 B13R1.569 COc1cccc(c1Br)NCC=O 34a_100000703447_200009817547 [0,2,0,0,0,0|2,0,0]=4 4351 B13R1.569 COc1cccc(c1Br)NCCF 34a_100000703447_100011217306 [0,2,0,0,0,0|2,0,0]=4 4352 B13R1.569 COc1cccc(c1Br)NCCO 34a_100000703447_100000211926 [0,2,0,0,0,0|2,0,0]=4 4353 B13R1.569 COc1cccc(c1Br)NCSC 34a_100000703447_100011218213 [0,2,0,0,0,0|1,1,0]=4 4354 B13R1.569 COc1cccc(c1Br)OCC#N 7a_100010202623_100011215382 [0,2,0,0,0,0|1,0,0]=3 4355 B13R1.569 COc1cccc(c1Br)OCC=O 34a_100010202623_200009817547 [0,2,0,0,0,0|1,0,0]=3 4356 B13R1.569 COc1cccc(c1Br)OCC=O 7a_100010202623_200015260668 [0,2,0,0,0,0|1,0,0]=3 4357 B13R1.569 COc1cccc(c1Br)OCCF 34a_100010202623_100011217306 [0,2,0,0,0,0|1,0,0]=3 4358 B13R1.569 COc1cccc(c1Br)OCCF 7a_100010202623_100011217306 [0,2,0,0,0,0|1,0,0]=3 4359 B13R1.569 COc1cccc(c1Br)OCCO 34a_100010202623_100000211926 [0,2,0,0,0,0|1,0,0]=3 4360 B13R1.569 COc1cccc(c1Br)OCCO 7a_100010202623_100000211926 [0,2,0,0,0,0|1,0,0]=3 4361 B13R1.569 COc1cccc(c1Br)OCSC 34a_100010202623_100011218213 [0,2,0,0,0,0|1,0,0]=3 4362 B13R1.569 COc1cccc(c1Br)SCC#N 62a_100010146559_100011215382 [0,2,0,0,0,0|1,1,0]=4 4363 B13R1.569 COc1cccc(c1Br)SCC#N 62a_100011215382_100010146559 [0,2,0,0,0,0|1,1,0]=4 4364 B13R1.569 COc1cccc(c1Br)SCC=O 62a_100010146559_200015260668 [0,2,0,0,0,0|1,1,0]=4 4365 B13R1.569 COc1cccc(c1Br)SCC=O 62a_200015260668_100010146559 [0,2,0,0,0,0|1,1,0]=4 4366 B13R1.569 COc1cccc(c1Br)SCCF 62a_100010146559_100011217306 [0,2,0,0,0,0|1,1,0]=4 4367 B13R1.569 COc1cccc(c1Br)SCCF 62a_100011217306_100010146559 [0,2,0,0,0,0|1,1,0]=4 4368 B13R1.569 COc1cccc(c1Br)SCCO 62a_100000211926_100010146559 [0,2,0,0,0,0|1,1,0]=4 4369 B13R1.569 COc1cccc(c1Br)SCCO 62a_100010146559_100000211926 [0,2,0,0,0,0|1,1,0]=4 4370 B13R1.569 COc1cccc(c1Br)SCSC 62a_100010146559_100011218213 [0,2,0,0,0,0|1,1,0]=4 4371 B13R1.569 COc1cccc(c1Br)SCSC 62a_100011218213_100010146559 [0,2,0,0,0,0|1,1,0]=4 4372 B13R1.569 COc1cccc(c1C)COCF 34a_100009871736_100015361967 [0,2,0,0,0,0|1,0,0]=3 4373 B13R1.569 COc1cccc(c1C)COCF 7a_100009871736_100015361967 [0,2,0,0,0,0|1,0,0]=3 4374 B13R1.569 COc1cccc(c1C)CSCF 62a_100009876938_100015361967 [0,2,0,0,0,0|1,1,0]=4 4375 B13R1.569 COc1cccc(c1C)CSCF 62a_100015361967_100009876938 [0,2,0,0,0,0|1,1,0]=4 4376 B13R1.569 COc1cccc(c1C)NCC#N 7a_100011244893_100011215382 [0,2,0,0,0,0|2,0,0]=4 4377 B13R1.569 COc1cccc(c1C)NCC=O 34a_100011244893_200009817547 [0,2,0,0,0,0|2,0,0]=4 4378 B13R1.569 COc1cccc(c1C)NCC=O 7a_100011244893_200015260668 [0,2,0,0,0,0|2,0,0]=4 4379 B13R1.569 COc1cccc(c1C)NCCF 34a_100011244893_100011217306 [0,2,0,0,0,0|2,0,0]=4 4380 B13R1.569 COc1cccc(c1C)NCCF 7a_100011244893_100011217306 [0,2,0,0,0,0|2,0,0]=4 4381 B13R1.569 COc1cccc(c1C)NCCO 34a_100011244893_100000211926 [0,2,0,0,0,0|2,0,0]=4 4382 B13R1.569 COc1cccc(c1C)NCCO 7a_100011244893_100000211926 [0,2,0,0,0,0|2,0,0]=4 4383 B13R1.569 COc1cccc(c1C)NCSC 34a_100011244893_100011218213 [0,2,0,0,0,0|1,1,0]=4 4384 B13R1.569 COc1cccc(c1C)SCC#N 62a_100010002647_100011215382 [0,2,0,0,0,0|1,1,0]=4 4385 B13R1.569 COc1cccc(c1C)SCC#N 62a_100011215382_100010002647 [0,2,0,0,0,0|1,1,0]=4 4386 B13R1.569 COc1cccc(c1C)SCC=O 62a_100010002647_200015260668 [0,2,0,0,0,0|1,1,0]=4 4387 B13R1.569 COc1cccc(c1C)SCC=O 62a_200015260668_100010002647 [0,2,0,0,0,0|1,1,0]=4 4388 B13R1.569 COc1cccc(c1C)SCCF 62a_100010002647_100011217306 [0,2,0,0,0,0|1,1,0]=4 4389 B13R1.569 COc1cccc(c1C)SCCF 62a_100011217306_100010002647 [0,2,0,0,0,0|1,1,0]=4 4390 B13R1.569 COc1cccc(c1C)SCCO 62a_100000211926_100010002647 [0,2,0,0,0,0|1,1,0]=4 4391 B13R1.569 COc1cccc(c1C)SCCO 62a_100010002647_100000211926 [0,2,0,0,0,0|1,1,0]=4 4392 B13R1.569 COc1cccc(c1C)SCSC 62a_100010002647_100011218213 [0,2,0,0,0,0|1,1,0]=4 4393 B13R1.569 COc1cccc(c1C)SCSC 62a_100011218213_100010002647 [0,2,0,0,0,0|1,1,0]=4 4394 B13R1.569 COc1cccc(c1Cl)CSCF 62a_100015361967_200010147866 [0,2,0,0,0,0|1,1,0]=4 4395 B13R1.569 COc1cccc(c1Cl)CSCF 62a_200010147866_100015361967 [0,2,0,0,0,0|1,1,0]=4 4396 B13R1.569 COc1cccc(c1Cl)NCC=O 34a_100000089720_200009817547 [0,2,0,0,0,0|2,0,0]=4 4397 B13R1.569 COc1cccc(c1Cl)NCCF 34a_100000089720_100011217306 [0,2,0,0,0,0|2,0,0]=4 4398 B13R1.569 COc1cccc(c1Cl)NCCO 34a_100000089720_100000211926 [0,2,0,0,0,0|2,0,0]=4 4399 B13R1.569 COc1cccc(c1Cl)NCSC 34a_100000089720_100011218213 [0,2,0,0,0,0|1,1,0]=4 4400 B13R1.569 COc1cccc(c1Cl)OCC#N 7a_100000087810_100011215382 [0,2,0,0,0,0|1,0,0]=3 4401 B13R1.569 COc1cccc(c1Cl)OCC=O 34a_100000087810_200009817547 [0,2,0,0,0,0|1,0,0]=3 4402 B13R1.569 COc1cccc(c1Cl)OCC=O 7a_100000087810_200015260668 [0,2,0,0,0,0|1,0,0]=3 4403 B13R1.569 COc1cccc(c1Cl)OCCF 34a_100000087810_100011217306 [0,2,0,0,0,0|1,0,0]=3 4404 B13R1.569 COc1cccc(c1Cl)OCCF 7a_100000087810_100011217306 [0,2,0,0,0,0|1,0,0]=3 4405 B13R1.569 COc1cccc(c1Cl)OCCO 34a_100000087810_100000211926 [0,2,0,0,0,0|1,0,0]=3 4406 B13R1.569 COc1cccc(c1Cl)OCCO 7a_100000087810_100000211926 [0,2,0,0,0,0|1,0,0]=3 4407 B13R1.569 COc1cccc(c1Cl)OCSC 34a_100000087810_100011218213 [0,2,0,0,0,0|1,0,0]=3 4408 B13R1.569 COc1cccc(c1Cl)SCC#N 62a_100010147677_100011215382 [0,2,0,0,0,0|1,1,0]=4 4409 B13R1.569 COc1cccc(c1Cl)SCC#N 62a_100011215382_100010147677 [0,2,0,0,0,0|1,1,0]=4 4410 B13R1.569 COc1cccc(c1Cl)SCC=O 62a_100010147677_200015260668 [0,2,0,0,0,0|1,1,0]=4 4411 B13R1.569 COc1cccc(c1Cl)SCC=O 62a_200015260668_100010147677 [0,2,0,0,0,0|1,1,0]=4 4412 B13R1.569 COc1cccc(c1Cl)SCCF 62a_100010147677_100011217306 [0,2,0,0,0,0|1,1,0]=4 4413 B13R1.569 COc1cccc(c1Cl)SCCF 62a_100011217306_100010147677 [0,2,0,0,0,0|1,1,0]=4 4414 B13R1.569 COc1cccc(c1Cl)SCCO 62a_100000211926_100010147677 [0,2,0,0,0,0|1,1,0]=4 4415 B13R1.569 COc1cccc(c1Cl)SCCO 62a_100010147677_100000211926 [0,2,0,0,0,0|1,1,0]=4 4416 B13R1.569 COc1cccc(c1Cl)SCSC 62a_100010147677_100011218213 [0,2,0,0,0,0|1,1,0]=4 4417 B13R1.569 COc1cccc(c1Cl)SCSC 62a_100011218213_100010147677 [0,2,0,0,0,0|1,1,0]=4 4418 B13R1.569 COc1cccc(c1F)CNCF 34a_100137345169_100015361967 [0,2,0,0,0,0|2,0,0]=4 4419 B13R1.569 COc1cccc(c1F)COCF 34a_100011935170_100015361967 [0,2,0,0,0,0|1,0,0]=3 4420 B13R1.569 COc1cccc(c1F)COCF 7a_100011935170_100015361967 [0,2,0,0,0,0|1,0,0]=3 4421 B13R1.569 COc1cccc(c1F)CSCF 62a_100011260763_100015361967 [0,2,0,0,0,0|1,1,0]=4 4422 B13R1.569 COc1cccc(c1F)CSCF 62a_100015361967_100011260763 [0,2,0,0,0,0|1,1,0]=4 4423 B13R1.569 COc1cccc(c1F)NCC=O 34a_100000100910_200009817547 [0,2,0,0,0,0|2,0,0]=4 4424 B13R1.569 COc1cccc(c1F)NCCF 34a_100000100910_100011217306 [0,2,0,0,0,0|2,0,0]=4 4425 B13R1.569 COc1cccc(c1F)NCCO 34a_100000100910_100000211926 [0,2,0,0,0,0|2,0,0]=4 4426 B13R1.569 COc1cccc(c1F)NCSC 34a_100000100910_100011218213 [0,2,0,0,0,0|1,1,0]=4 4427 B13R1.569 COc1cccc(c1F)OCC#N 7a_100000102366_100011215382 [0,2,0,0,0,0|1,0,0]=3 4428 B13R1.569 COc1cccc(c1F)OCC=O 34a_100000102366_200009817547 [0,2,0,0,0,0|1,0,0]=3 4429 B13R1.569 COc1cccc(c1F)OCC=O 7a_100000102366_200015260668 [0,2,0,0,0,0|1,0,0]=3 4430 B13R1.569 COc1cccc(c1F)OCCF 34a_100000102366_100011217306 [0,2,0,0,0,0|1,0,0]=3 4431 B13R1.569 COc1cccc(c1F)OCCF 7a_100000102366_100011217306 [0,2,0,0,0,0|1,0,0]=3 4432 B13R1.569 COc1cccc(c1F)OCCO 34a_100000102366_100000211926 [0,2,0,0,0,0|1,0,0]=3 4433 B13R1.569 COc1cccc(c1F)OCCO 7a_100000102366_100000211926 [0,2,0,0,0,0|1,0,0]=3 4434 B13R1.569 COc1cccc(c1F)OCSC 34a_100000102366_100011218213 [0,2,0,0,0,0|1,0,0]=3 4435 B13R1.569 COc1cccc(c1F)SCC#N 62a_100010185846_100011215382 [0,2,0,0,0,0|1,1,0]=4 4436 B13R1.569 COc1cccc(c1F)SCC#N 62a_100011215382_100010185846 [0,2,0,0,0,0|1,1,0]=4 4437 B13R1.569 COc1cccc(c1F)SCC=O 62a_100010185846_200015260668 [0,2,0,0,0,0|1,1,0]=4 4438 B13R1.569 COc1cccc(c1F)SCC=O 62a_200015260668_100010185846 [0,2,0,0,0,0|1,1,0]=4 4439 B13R1.569 COc1cccc(c1F)SCCF 62a_100010185846_100011217306 [0,2,0,0,0,0|1,1,0]=4 4440 B13R1.569 COc1cccc(c1F)SCCF 62a_100011217306_100010185846 [0,2,0,0,0,0|1,1,0]=4 4441 B13R1.569 COc1cccc(c1F)SCCO 62a_100000211926_100010185846 [0,2,0,0,0,0|1,1,0]=4 4442 B13R1.569 COc1cccc(c1F)SCCO 62a_100010185846_100000211926 [0,2,0,0,0,0|1,1,0]=4 4443 B13R1.569 COc1cccc(c1F)SCSC 62a_100010185846_100011218213 [0,2,0,0,0,0|1,1,0]=4 4444 B13R1.569 COc1cccc(c1F)SCSC 62a_100011218213_100010185846 [0,2,0,0,0,0|1,1,0]=4 4445 B13R1.569 COc1cccc(c1I)COCF 34a_100010236476_100015361967 [0,2,0,0,0,0|1,0,0]=3 4446 B13R1.569 COc1cccc(c1I)COCF 7a_100010236476_100015361967 [0,2,0,0,0,0|1,0,0]=3 4447 B13R1.569 COc1cccc(c1I)NCC=O 34a_100010245509_200009817547 [0,2,0,0,0,0|2,0,0]=4 4448 B13R1.569 COc1cccc(c1I)NCCF 34a_100010245509_100011217306 [0,2,0,0,0,0|2,0,0]=4 4449 B13R1.569 COc1cccc(c1I)NCCO 34a_100010245509_100000211926 [0,2,0,0,0,0|2,0,0]=4 4450 B13R1.569 COc1cccc(c1I)NCSC 34a_100010245509_100011218213 [0,2,0,0,0,0|1,1,0]=4 4451 B13R1.569 COc1cccc(c1I)OCC#N 7a_200010201982_100011215382 [0,2,0,0,0,0|1,0,0]=3 4452 B13R1.569 COc1cccc(c1I)OCC=O 34a_200010201982_200009817547 [0,2,0,0,0,0|1,0,0]=3 4453 B13R1.569 COc1cccc(c1I)OCC=O 7a_200010201982_200015260668 [0,2,0,0,0,0|1,0,0]=3 4454 B13R1.569 COc1cccc(c1I)OCCF 34a_200010201982_100011217306 [0,2,0,0,0,0|1,0,0]=3 4455 B13R1.569 COc1cccc(c1I)OCCF 7a_200010201982_100011217306 [0,2,0,0,0,0|1,0,0]=3 4456 B13R1.569 COc1cccc(c1I)OCCO 34a_200010201982_100000211926 [0,2,0,0,0,0|1,0,0]=3 4457 B13R1.569 COc1cccc(c1I)OCCO 7a_200010201982_100000211926 [0,2,0,0,0,0|1,0,0]=3 4458 B13R1.569 COc1cccc(c1I)OCSC 34a_200010201982_100011218213 [0,2,0,0,0,0|1,0,0]=3 4459 B13R1.569 COc1cccc(c1N)COCF 34a_100011999522_100015361967 [0,2,0,0,0,0|1,0,0]=3 4460 B13R1.569 COc1cccc(c1N)OCC#N 7a_100012022766_100011215382 [0,2,0,0,0,0|1,0,0]=3 4461 B13R1.569 COc1cccc(c1N)OCC=O 34a_100012022766_200009817547 [0,2,0,0,0,0|1,0,0]=3 4462 B13R1.569 COc1cccc(c1N)OCC=O 7a_100012022766_200015260668 [0,2,0,0,0,0|1,0,0]=3 4463 B13R1.569 COc1cccc(c1N)OCCF 34a_100012022766_100011217306 [0,2,0,0,0,0|1,0,0]=3 4464 B13R1.569 COc1cccc(c1N)OCCF 7a_100012022766_100011217306 [0,2,0,0,0,0|1,0,0]=3 4465 B13R1.569 COc1cccc(c1N)OCCO 34a_100012022766_100000211926 [0,2,0,0,0,0|1,0,0]=3 4466 B13R1.569 COc1cccc(c1N)OCCO 7a_100012022766_100000211926 [0,2,0,0,0,0|1,0,0]=3 4467 B13R1.569 COc1cccc(c1N)OCSC 34a_100012022766_100011218213 [0,2,0,0,0,0|1,0,0]=3 4468 B13R1.569 COc1cccc(c1N)SCC#N 62a_100000708083_100011215382 [0,2,0,0,0,0|1,1,0]=4 4469 B13R1.569 COc1cccc(c1N)SCC=O 62a_100000708083_200015260668 [0,2,0,0,0,0|1,1,0]=4 4470 B13R1.569 COc1cccc(c1N)SCCF 62a_100000708083_100011217306 [0,2,0,0,0,0|1,1,0]=4 4471 B13R1.569 COc1cccc(c1N)SCCO 62a_100000708083_100000211926 [0,2,0,0,0,0|1,1,0]=4 4472 B13R1.569 COc1cccc(c1N)SCSC 62a_100000708083_100011218213 [0,2,0,0,0,0|1,1,0]=4 4473 B13R1.569 COc1cccc(c1O)NCC=O 34a_100000123586_200009817547 [0,2,0,0,0,0|1,0,0]=3 4474 B13R1.569 COc1cccc(c1O)NCCF 34a_100000123586_100011217306 [0,2,0,0,0,0|1,0,0]=3 4475 B13R1.569 COc1cccc(c1O)NCCO 34a_100000123586_100000211926 [0,2,0,0,0,0|1,0,0]=3 4476 B13R1.569 COc1cccc(c1O)NCSC 34a_100000123586_100011218213 [0,2,0,0,0,0|0,1,0]=3 4477 B13R1.569 COc1cccc(c1O)SCC#N 62a_100011215382_100000686866 [0,2,0,0,0,0|0,1,0]=3 4478 B13R1.569 COc1cccc(c1O)SCC=O 62a_200015260668_100000686866 [0,2,0,0,0,0|0,1,0]=3 4479 B13R1.569 COc1cccc(c1O)SCCF 62a_100011217306_100000686866 [0,2,0,0,0,0|0,1,0]=3 4480 B13R1.569 COc1cccc(c1O)SCCO 62a_100000211926_100000686866 [0,2,0,0,0,0|0,1,0]=3 4481 B13R1.569 COc1cccc(c1O)SCSC 62a_100011218213_100000686866 [0,2,0,0,0,0|0,1,0]=3 4482 B13R1.569 COc1ccnc(c1C)COCF 34a_100000087669_100015361967 [0,2,0,0,0,0|2,0,0]=4 4483 B13R1.569 COc1nccc(c1Cl)COCF 34a_100009844655_100015361967 [0,2,0,0,0,0|2,0,0]=4 4484 B13R1.641 CCc1cccc(c1O)C=C(C)C 271570a_100102525489_200010001580 [0,2,0,0,0,0|2,0,0]=4 4485 B13R1.641 CCc1cccc(c1O)SC(C)C 62a_100000210206_200010001580 [0,2,0,0,0,0|1,1,0]=4 4486 B13R1.641 CCc1cccc(c1O)SC(C)C 62a_200010001580_100000210206 [0,2,0,0,0,0|1,1,0]=4 4487 B13R1.641 COc1cccc(c1Br)CN(C)C 270004a_100102631434_100010209554 [0,2,0,0,0,0|2,0,0]=4 4488 B13R1.641 COc1cccc(c1Br)NC(=O)C 11a_100000703447_100015343762 [0,2,0,0,0,0|2,0,0]=4 4489 B13R1.641 COc1cccc(c1Br)NC(=O)C 1626a_100000703447_100015343762 [0,2,0,0,0,0|2,0,0]=4 4490 B13R1.641 COc1cccc(c1Br)NC(=O)C 22a_100000703447_100000070787 [0,2,0,0,0,0|2,0,0]=4 4491 B13R1.641 COc1cccc(c1Br)NC(=O)C 527a_100000703447_100103153847 [0,2,0,0,0,0|2,0,0]=4 4492 B13R1.641 COc1cccc(c1Br)NC(C)C 34a_100000703447_100000210206 [0,2,0,0,0,0|2,0,0]=4 4493 B13R1.641 COc1cccc(c1Br)OC(C)C 34a_100010202623_100000210206 [0,2,0,0,0,0|1,0,0]=3 4494 B13R1.641 COc1cccc(c1Br)OC(C)C 7a_100010202623_100000210206 [0,2,0,0,0,0|1,0,0]=3 4495 B13R1.641 COc1cccc(c1Br)SC(C)C 62a_100000210206_100010146559 [0,2,0,0,0,0|1,1,0]=4 4496 B13R1.641 COc1cccc(c1Br)SC(C)C 62a_100010146559_100000210206 [0,2,0,0,0,0|1,1,0]=4 4497 B13R1.641 COc1cccc(c1C)C=C(C)C 271570a_100102525489_100010002647 [0,2,0,0,0,0|2,0,0]=4 4498 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [0,2,0,0,0,0|2,0,0]=4 4499 B13R1.641 COc1cccc(c1C)CN(C)C 2230a_100102631434_100009876938 [0,2,0,0,0,0|2,0,0]=4 4500 B13R1.641 COc1cccc(c1C)CN(C)C 269982a_100102631434_100009876938 [0,2,0,0,0,0|2,0,0]=4 4501 B13R1.641 COc1cccc(c1C)CN(C)C 270004a_100102631434_100000101217 [0,2,0,0,0,0|2,0,0]=4 4502 B13R1.641 COc1cccc(c1C)NC(=O)C 11a_100011244893_100015343762 [0,2,0,0,0,0|2,0,0]=4 4503 B13R1.641 COc1cccc(c1C)NC(=O)C 1626a_100011244893_100015343762 [0,2,0,0,0,0|2,0,0]=4 4504 B13R1.641 COc1cccc(c1C)NC(=O)C 22a_100011244893_100000070787 [0,2,0,0,0,0|2,0,0]=4 4505 B13R1.641 COc1cccc(c1C)NC(=O)C 527a_100011244893_100103153847 [0,2,0,0,0,0|2,0,0]=4 4506 B13R1.641 COc1cccc(c1C)NC(C)C 34a_100011244893_100000210206 [0,2,0,0,0,0|2,0,0]=4 4507 B13R1.641 COc1cccc(c1C)NC(C)C 7a_100011244893_100000210206 [0,2,0,0,0,0|2,0,0]=4 4508 B13R1.641 COc1cccc(c1C)SC(C)C 62a_100000210206_100010002647 [0,2,0,0,0,0|1,1,0]=4 4509 B13R1.641 COc1cccc(c1C)SC(C)C 62a_100010002647_100000210206 [0,2,0,0,0,0|1,1,0]=4 4510 B13R1.641 COc1cccc(c1Cl)C=C(C)C 271570a_100102525489_100010147677 [0,2,0,0,0,0|2,0,0]=4 4511 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [0,2,0,0,0,0|2,0,0]=4 4512 B13R1.641 COc1cccc(c1Cl)CN(C)C 2230a_100102631434_200010147866 [0,2,0,0,0,0|2,0,0]=4 4513 B13R1.641 COc1cccc(c1Cl)CN(C)C 269982a_100102631434_200010147866 [0,2,0,0,0,0|2,0,0]=4 4514 B13R1.641 COc1cccc(c1Cl)CN(C)C 270004a_100102631434_100000068750 [0,2,0,0,0,0|2,0,0]=4 4515 B13R1.641 COc1cccc(c1Cl)NC(=O)C 11a_100000089720_100015343762 [0,2,0,0,0,0|2,0,0]=4 4516 B13R1.641 COc1cccc(c1Cl)NC(=O)C 1626a_100000089720_100015343762 [0,2,0,0,0,0|2,0,0]=4 4517 B13R1.641 COc1cccc(c1Cl)NC(=O)C 22a_100000089720_100000070787 [0,2,0,0,0,0|2,0,0]=4 4518 B13R1.641 COc1cccc(c1Cl)NC(=O)C 527a_100000089720_100103153847 [0,2,0,0,0,0|2,0,0]=4 4519 B13R1.641 COc1cccc(c1Cl)NC(C)C 34a_100000089720_100000210206 [0,2,0,0,0,0|2,0,0]=4 4520 B13R1.641 COc1cccc(c1Cl)OC(C)C 34a_100000087810_100000210206 [0,2,0,0,0,0|1,0,0]=3 4521 B13R1.641 COc1cccc(c1Cl)OC(C)C 7a_100000087810_100000210206 [0,2,0,0,0,0|1,0,0]=3 4522 B13R1.641 COc1cccc(c1Cl)SC(C)C 62a_100000210206_100010147677 [0,2,0,0,0,0|1,1,0]=4 4523 B13R1.641 COc1cccc(c1Cl)SC(C)C 62a_100010147677_100000210206 [0,2,0,0,0,0|1,1,0]=4 4524 B13R1.641 COc1cccc(c1F)C=C(C)C 271570a_100102525489_100010185846 [0,2,0,0,0,0|2,0,0]=4 4525 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [0,2,0,0,0,0|2,0,0]=4 4526 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [0,2,0,0,0,0|2,0,0]=4 4527 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [0,2,0,0,0,0|2,0,0]=4 4528 B13R1.641 COc1cccc(c1F)CN(C)C 2230a_100102631434_100011260763 [0,2,0,0,0,0|2,0,0]=4 4529 B13R1.641 COc1cccc(c1F)CN(C)C 2230a_106430512896_200000210301 [0,2,0,0,0,0|2,0,0]=4 4530 B13R1.641 COc1cccc(c1F)CN(C)C 269982a_100102631434_100011260763 [0,2,0,0,0,0|2,0,0]=4 4531 B13R1.641 COc1cccc(c1F)CN(C)C 269982a_106430512896_200000210301 [0,2,0,0,0,0|2,0,0]=4 4532 B13R1.641 COc1cccc(c1F)CN(C)C 270004a_100102631434_100000692048 [0,2,0,0,0,0|2,0,0]=4 4533 B13R1.641 COc1cccc(c1F)CN(C)C 34a_106430512896_200000210301 [0,2,0,0,0,0|2,0,0]=4 4534 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 2230a_106430512896_200025704644 [0,2,0,0,0,0|2,0,0]=4 4535 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 269982a_106430512896_200025704644 [0,2,0,0,0,0|2,0,0]=4 4536 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 34a_106430512896_200025704644 [0,2,0,0,0,0|2,0,0]=4 4537 B13R1.641 COc1cccc(c1F)NC(=O)C 11a_100000100910_100015343762 [0,2,0,0,0,0|2,0,0]=4 4538 B13R1.641 COc1cccc(c1F)NC(=O)C 1626a_100000100910_100015343762 [0,2,0,0,0,0|2,0,0]=4 4539 B13R1.641 COc1cccc(c1F)NC(=O)C 22a_100000100910_100000070787 [0,2,0,0,0,0|2,0,0]=4 4540 B13R1.641 COc1cccc(c1F)NC(=O)C 527a_100000100910_100103153847 [0,2,0,0,0,0|2,0,0]=4 4541 B13R1.641 COc1cccc(c1F)NC(C)C 34a_100000100910_100000210206 [0,2,0,0,0,0|2,0,0]=4 4542 B13R1.641 COc1cccc(c1F)OC(C)C 34a_100000102366_100000210206 [0,2,0,0,0,0|1,0,0]=3 4543 B13R1.641 COc1cccc(c1F)OC(C)C 7a_100000102366_100000210206 [0,2,0,0,0,0|1,0,0]=3 4544 B13R1.641 COc1cccc(c1F)SC(C)C 62a_100000210206_100010185846 [0,2,0,0,0,0|1,1,0]=4 4545 B13R1.641 COc1cccc(c1F)SC(C)C 62a_100010185846_100000210206 [0,2,0,0,0,0|1,1,0]=4 4546 B13R1.641 COc1cccc(c1I)NC(=O)C 11a_100010245509_100015343762 [0,2,0,0,0,0|2,0,0]=4 4547 B13R1.641 COc1cccc(c1I)NC(=O)C 1626a_100010245509_100015343762 [0,2,0,0,0,0|2,0,0]=4 4548 B13R1.641 COc1cccc(c1I)NC(C)C 34a_100010245509_100000210206 [0,2,0,0,0,0|2,0,0]=4 4549 B13R1.641 COc1cccc(c1I)OC(C)C 34a_200010201982_100000210206 [0,2,0,0,0,0|1,0,0]=3 4550 B13R1.641 COc1cccc(c1I)OC(C)C 7a_200010201982_100000210206 [0,2,0,0,0,0|1,0,0]=3 4551 B13R1.641 COc1cccc(c1N)C=C(C)C 271570a_100102525489_100000708083 [0,2,0,0,0,0|2,0,0]=4 4552 B13R1.641 COc1cccc(c1N)OC(C)C 34a_100012022766_100000210206 [0,2,0,0,0,0|1,0,0]=3 4553 B13R1.641 COc1cccc(c1N)OC(C)C 7a_100012022766_100000210206 [0,2,0,0,0,0|1,0,0]=3 4554 B13R1.641 COc1cccc(c1N)SC(C)C 62a_100000708083_100000210206 [0,2,0,0,0,0|1,1,0]=4 4555 B13R1.641 COc1cccc(c1O)C=C(C)C 271570a_100102525489_100000686866 [0,2,0,0,0,0|1,0,0]=3 4556 B13R1.641 COc1cccc(c1O)NC(=O)C 22a_100000123586_100000070787 [0,2,0,0,0,0|1,0,0]=3 4557 B13R1.641 COc1cccc(c1O)NC(=O)C 527a_100000123586_100103153847 [0,2,0,0,0,0|1,0,0]=3 4558 B13R1.641 COc1cccc(c1O)NC(C)C 34a_100000123586_100000210206 [0,2,0,0,0,0|1,0,0]=3 4559 B13R1.641 COc1cccc(c1O)SC(C)C 62a_100000210206_100000686866 [0,2,0,0,0,0|0,1,0]=3 4560 B13R1.641 CSc1cccc(c1C)OC(F)F 62a_200000210301_200010148667 [0,2,0,0,0,0|1,1,0]=4 4561 B13R1.641 CSc1cccc(c1C)OC(F)F 62a_200010148667_200000210301 [0,2,0,0,0,0|1,1,0]=4 4562 B13R1.641 Cc1c(cccc1S[13CH3])OC(F)F 62a_200010148667_200025704644 [0,2,0,0,0,0|1,1,0]=4 4563 B13R1.641 Cc1c(cccc1S[13CH3])OC(F)F 62a_200025704644_200010148667 [0,2,0,0,0,0|1,1,0]=4 4564 B13R1.1255 CC=Cc1ccc(c(c1F)OC)Cl 271570a_100016259895_200135222481 [0,2,0,0,0,0|2,0,0]=4 4565 B13R1.1255 CC=Cc1ccc(c(c1F)OC)N 271570a_100016259895_100010734149 [0,2,0,0,0,0|2,0,0]=4 4566 B13R1.1255 CCNc1ccc(c(c1F)OC)F 34a_100137314619_100000210202 [0,2,0,0,0,0|2,0,0]=4 4567 B13R1.1255 CCOc1ccc(c(c1F)NC)F 34a_100000061554_200000210301 [0,2,0,0,0,0|2,0,0]=4 4568 B13R1.1255 CCOc1ccc(c(c1F)N[13CH3])F 34a_100000061554_200025704644 [0,2,0,0,0,0|2,0,0]=4 4569 B13R1.1255 CCOc1ccc(c(c1F)OC)F 34a_100000062073_100000210202 [0,2,0,0,0,0|1,0,0]=3 4570 B13R1.1255 CCOc1ccc(c(c1F)OC)F 7a_100000062073_100000210202 [0,2,0,0,0,0|1,0,0]=3 4571 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_100000210202_200135222481 [0,2,0,0,0,0|1,1,0]=4 4572 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000210202 [0,2,0,0,0,0|1,1,0]=4 4573 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100000210202_100010734149 [0,2,0,0,0,0|1,1,0]=4 4574 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100010734149_100000210202 [0,2,0,0,0,0|1,1,0]=4 4575 B13R1.1255 CNCc1ccc(c(c1F)OC)Br 207a_100102657272_200010981996 [0,2,0,0,0,0|2,0,0]=4 4576 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 207a_100102657272_100009889114 [0,2,0,0,0,0|2,0,0]=4 4577 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 2230a_106832991635_100010116237 [0,2,0,0,0,0|2,0,0]=4 4578 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 270004a_106832991635_100009889114 [0,2,0,0,0,0|2,0,0]=4 4579 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_100102657272_100010116237 [0,2,0,0,0,0|2,0,0]=4 4580 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_200009889119_200000210301 [0,2,0,0,0,0|2,0,0]=4 4581 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 7a_106832991635_100010116237 [0,2,0,0,0,0|2,0,0]=4 4582 B13R1.1255 CNCc1ccc(c(c1F)OC)F 207a_100102657272_100000050928 [0,2,0,0,0,0|2,0,0]=4 4583 B13R1.1255 CNCc1ccc(c(c1F)OC)F 2230a_106832991635_100009814548 [0,2,0,0,0,0|2,0,0]=4 4584 B13R1.1255 CNCc1ccc(c(c1F)OC)F 270004a_106832991635_100000050928 [0,2,0,0,0,0|2,0,0]=4 4585 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_100102657272_100009814548 [0,2,0,0,0,0|2,0,0]=4 4586 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_115082355467_200000210301 [0,2,0,0,0,0|2,0,0]=4 4587 B13R1.1255 CNCc1ccc(c(c1F)OC)F 7a_106832991635_100009814548 [0,2,0,0,0,0|2,0,0]=4 4588 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100009889115_200000210301 [0,2,0,0,0,0|1,0,0]=3 4589 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100138415774_100010116237 [0,2,0,0,0,0|1,0,0]=3 4590 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 7a_100009889115_200000210301 [0,2,0,0,0,0|1,0,0]=3 4591 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100000081355_200000210301 [0,2,0,0,0,0|1,0,0]=3 4592 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100138415774_100009814548 [0,2,0,0,0,0|1,0,0]=3 4593 B13R1.1255 COCc1ccc(c(c1F)OC)F 7a_100000081355_200000210301 [0,2,0,0,0,0|1,0,0]=3 4594 B13R1.1255 COCc1ncc(c(c1C)OC)C 34a_100011217710_200000210301 [0,2,0,0,0,0|2,0,0]=4 4595 B13R1.1255 COCc1ncc(c(c1C)OC)C 34a_100138415774_100000737168 [0,2,0,0,0,0|2,0,0]=4 4596 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])Cl 34a_200009889119_200025704644 [0,2,0,0,0,0|2,0,0]=4 4597 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])F 34a_115082355467_200025704644 [0,2,0,0,0,0|2,0,0]=4 4598 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 34a_100009889115_200025704644 [0,2,0,0,0,0|1,0,0]=3 4599 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 7a_100009889115_200025704644 [0,2,0,0,0,0|1,0,0]=3 4600 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 34a_100000081355_200025704644 [0,2,0,0,0,0|1,0,0]=3 4601 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 7a_100000081355_200025704644 [0,2,0,0,0,0|1,0,0]=3 4602 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_100010116237_200000210301 [0,2,0,0,0,0|1,1,0]=4 4603 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_200000210301_100010116237 [0,2,0,0,0,0|1,1,0]=4 4604 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_100009814548_200000210301 [0,2,0,0,0,0|1,1,0]=4 4605 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_200000210301_100009814548 [0,2,0,0,0,0|1,1,0]=4 4606 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_100010116237_200025704644 [0,2,0,0,0,0|1,1,0]=4 4607 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_200025704644_100010116237 [0,2,0,0,0,0|1,1,0]=4 4608 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_100009814548_200025704644 [0,2,0,0,0,0|1,1,0]=4 4609 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_200025704644_100009814548 [0,2,0,0,0,0|1,1,0]=4 4610 B13R1.1255 COc1c(ccc(c1F)NCF)F 34a_100137314619_100015361967 [0,2,0,0,0,0|2,0,0]=4 4611 B13R1.1255 COc1c(ccc(c1F)OCF)F 34a_100000062073_100015361967 [0,2,0,0,0,0|1,0,0]=3 4612 B13R1.1255 COc1c(ccc(c1F)OCF)F 7a_100000062073_100015361967 [0,2,0,0,0,0|1,0,0]=3 4613 B13R1.1255 COc1c(ccc(c1F)SCF)Cl 62a_100015361967_200135222481 [0,2,0,0,0,0|1,1,0]=4 4614 B13R1.1255 COc1c(ccc(c1F)SCF)Cl 62a_200135222481_100015361967 [0,2,0,0,0,0|1,1,0]=4 4615 B13R1.1255 COc1c(ccc(c1F)SCF)N 62a_100010734149_100015361967 [0,2,0,0,0,0|1,1,0]=4 4616 B13R1.1255 COc1c(ccc(c1F)SCF)N 62a_100015361967_100010734149 [0,2,0,0,0,0|1,1,0]=4 4617 B13R1.1255 COc1c(cnc(c1C)CO[13CH3])C 34a_100011217710_200025704644 [0,2,0,0,0,0|2,0,0]=4 4618 B13R1.3911 C=C=Cc1cccc(c1OC)OC 271570a_100015277604_100009815961 [0,2,0,0,0,0|1,0,1]=4 4619 B13R1.3911 CC=Cc1cccc(c1C#N)OC 271570a_100016259895_100012356440 [0,2,0,0,0,0|2,0,0]=4 4620 B13R1.3911 CC=Cc1cccc(c1C=O)OC 271570a_100016259895_100009814803 [0,2,0,0,0,0|1,0,1]=4 4621 B13R1.3911 CC=Cc1cccc(c1OC)OC 271570a_100016259895_100009815961 [0,2,0,0,0,0|1,0,0]=3 4622 B13R1.3911 CCNc1cccc(c1OC)OC 34a_100011217386_100000210202 [0,2,0,0,0,0|1,0,0]=3 4623 B13R1.3911 CCOc1cccc(c1OC)C#N 34a_200009874251_100000210202 [0,2,0,0,0,0|2,0,0]=4 4624 B13R1.3911 CCOc1cccc(c1OC)OC 34a_100000032319_100000210202 [0,2,0,0,0,0|0,0,0]=2 4625 B13R1.3911 CCSc1cccc(c1C#N)OC 62a_100000210202_100012356440 [0,2,0,0,0,0|1,1,0]=4 4626 B13R1.3911 CCSc1cccc(c1C=O)OC 62a_100009814803_100000210202 [0,2,0,0,0,0|0,1,1]=4 4627 B13R1.3911 CCSc1cccc(c1OC)OC 62a_100000210202_100010163134 [0,2,0,0,0,0|0,1,0]=3 4628 B13R1.3911 CNCc1cccc(c1OC)OC 207a_100102657272_100000210086 [0,2,0,0,0,0|1,0,0]=3 4629 B13R1.3911 CNCc1cccc(c1OC)OC 2230a_106832991635_100011217692 [0,2,0,0,0,0|1,0,0]=3 4630 B13R1.3911 CNCc1cccc(c1OC)OC 270004a_106832991635_100000210086 [0,2,0,0,0,0|1,0,0]=3 4631 B13R1.3911 CNCc1cccc(c1OC)OC 34a_100000737870_200000210301 [0,2,0,0,0,0|1,0,0]=3 4632 B13R1.3911 CNCc1cccc(c1OC)OC 34a_100102657272_100011217692 [0,2,0,0,0,0|1,0,0]=3 4633 B13R1.3911 CNCc1cccc(c1OC)OC 7a_106832991635_100011217692 [0,2,0,0,0,0|1,0,0]=3 4634 B13R1.3911 CNCc1ccnc(c1OC)OC 207a_100102657272_100000099779 [0,2,0,0,0,0|2,0,0]=4 4635 B13R1.3911 CNCc1ccnc(c1OC)OC 270004a_106832991635_100000099779 [0,2,0,0,0,0|2,0,0]=4 4636 B13R1.3911 CNCc1nccc(c1OC)OC 2230a_106832991635_100000718141 [0,2,0,0,0,0|2,0,0]=4 4637 B13R1.3911 CNCc1nccc(c1OC)OC 7a_106832991635_100000718141 [0,2,0,0,0,0|2,0,0]=4 4638 B13R1.3911 COCc1cccc(c1OC)OC 34a_100000211494_200000210301 [0,2,0,0,0,0|0,0,0]=2 4639 B13R1.3911 COCc1cccc(c1OC)OC 34a_100138415774_100011217692 [0,2,0,0,0,0|0,0,0]=2 4640 B13R1.3911 COc1c(cccc1OCF)C#N 34a_200009874251_100015361967 [0,2,0,0,0,0|2,0,0]=4 4641 B13R1.3911 COc1cccc(c1C#N)SCF 62a_100015361967_100012356440 [0,2,0,0,0,0|1,1,0]=4 4642 B13R1.3911 COc1cccc(c1C=O)SCF 62a_100009814803_100015361967 [0,2,0,0,0,0|0,1,1]=4 4643 B13R1.3911 COc1cccc(c1OC)CN[13CH3] 34a_100000737870_200025704644 [0,2,0,0,0,0|1,0,0]=3 4644 B13R1.3911 COc1cccc(c1OC)CO[13CH3] 34a_100000211494_200025704644 [0,2,0,0,0,0|0,0,0]=2 4645 B13R1.3911 COc1cccc(c1OC)CSC 62a_100011217692_200000210301 [0,2,0,0,0,0|0,1,0]=3 4646 B13R1.3911 COc1cccc(c1OC)CSC 62a_200000210301_100011217692 [0,2,0,0,0,0|0,1,0]=3 4647 B13R1.3911 COc1cccc(c1OC)CS[13CH3] 62a_100011217692_200025704644 [0,2,0,0,0,0|0,1,0]=3 4648 B13R1.3911 COc1cccc(c1OC)CS[13CH3] 62a_200025704644_100011217692 [0,2,0,0,0,0|0,1,0]=3 4649 B13R1.3911 COc1cccc(c1OC)NCF 34a_100011217386_100015361967 [0,2,0,0,0,0|1,0,0]=3 4650 B13R1.3911 COc1cccc(c1OC)OCF 34a_100000032319_100015361967 [0,2,0,0,0,0|0,0,0]=2 4651 B13R1.3911 COc1cccc(c1OC)SCF 62a_100015361967_100010163134 [0,2,0,0,0,0|0,1,0]=3 4652 B13R1.3911 COc1ccnc(c1OC)CSC 62a_100000718141_200000210301 [0,2,0,0,0,0|1,1,0]=4 4653 B13R1.3911 COc1ccnc(c1OC)CSC 62a_200000210301_100000718141 [0,2,0,0,0,0|1,1,0]=4 4654 B13R1.3911 COc1ccnc(c1OC)CS[13CH3] 62a_100000718141_200025704644 [0,2,0,0,0,0|1,1,0]=4 4655 B13R1.3911 COc1ccnc(c1OC)CS[13CH3] 62a_200025704644_100000718141 [0,2,0,0,0,0|1,1,0]=4 4656 B13R1.4021 CC=Cc1c(ccc(c1C)OC)C 271570a_100016259895_100016151084 [0,2,0,0,0,0|2,0,0]=4 4657 B13R1.4021 CC=Cc1c(ccc(c1F)OC)F 271570a_100016259895_100010946477 [0,2,0,0,0,0|2,0,0]=4 4658 B13R1.4021 CCNc1c(ccc(c1C)OC)C 34a_100000089760_100000210202 [0,2,0,0,0,0|2,0,0]=4 4659 B13R1.4021 CCNc1c(ccc(c1C)OC)C 7a_100000089760_100000210202 [0,2,0,0,0,0|2,0,0]=4 4660 B13R1.4021 CCNc1c(ccc(c1Cl)OC)Cl 34a_100009956855_100000210202 [0,2,0,0,0,0|2,0,0]=4 4661 B13R1.4021 CCNc1c(ccc(c1Cl)OC)F 34a_100000061512_100000210202 [0,2,0,0,0,0|2,0,0]=4 4662 B13R1.4021 CCNc1c(ccc(c1F)OC)Cl 34a_100000061519_100000210202 [0,2,0,0,0,0|2,0,0]=4 4663 B13R1.4021 CCNc1c(ccc(c1F)OC)F 34a_200000062051_100000210202 [0,2,0,0,0,0|2,0,0]=4 4664 B13R1.4021 CCOc1c(ccc(c1Br)OC)Cl 34a_200020794976_100000210202 [0,2,0,0,0,0|1,0,0]=3 4665 B13R1.4021 CCOc1c(ccc(c1Br)OC)Cl 7a_200020794976_100000210202 [0,2,0,0,0,0|1,0,0]=3 4666 B13R1.4021 CCOc1c(ccc(c1Cl)OC)F 34a_200000061507_100000210202 [0,2,0,0,0,0|1,0,0]=3 4667 B13R1.4021 CCOc1c(ccc(c1Cl)OC)F 7a_200000061507_100000210202 [0,2,0,0,0,0|1,0,0]=3 4668 B13R1.4021 CCOc1c(ccc(c1F)NC)F 34a_100000061556_200000210301 [0,2,0,0,0,0|2,0,0]=4 4669 B13R1.4021 CCOc1c(ccc(c1F)N[13CH3])F 34a_100000061556_200025704644 [0,2,0,0,0,0|2,0,0]=4 4670 B13R1.4021 CCOc1c(ccc(c1F)OC)F 34a_100000062056_100000210202 [0,2,0,0,0,0|1,0,0]=3 4671 B13R1.4021 CCOc1c(ccc(c1F)OC)F 7a_100000062056_100000210202 [0,2,0,0,0,0|1,0,0]=3 4672 B13R1.4021 CCSc1c(ccc(c1Br)OC)F 62a_100000210202_200055343962 [0,2,0,0,0,0|1,1,0]=4 4673 B13R1.4021 CCSc1c(ccc(c1Br)OC)F 62a_200055343962_100000210202 [0,2,0,0,0,0|1,1,0]=4 4674 B13R1.4021 CCSc1c(ccc(c1C)OC)C 62a_100000210202_100016151084 [0,2,0,0,0,0|1,1,0]=4 4675 B13R1.4021 CCSc1c(ccc(c1C)OC)C 62a_100016151084_100000210202 [0,2,0,0,0,0|1,1,0]=4 4676 B13R1.4021 CCSc1c(ccc(c1F)OC)F 62a_100000210202_100010946477 [0,2,0,0,0,0|1,1,0]=4 4677 B13R1.4021 CCSc1c(ccc(c1F)OC)F 62a_100010946477_100000210202 [0,2,0,0,0,0|1,1,0]=4 4678 B13R1.4021 CNCc1c(ccc(c1Br)OC)Br 207a_100102657272_200021145408 [0,2,0,0,0,0|2,0,0]=4 4679 B13R1.4021 CNCc1c(ccc(c1Br)OC)Br 270004a_106832991635_200021145408 [0,2,0,0,0,0|2,0,0]=4 4680 B13R1.4021 CNCc1c(ccc(c1Br)OC)Cl 26a_100102657272_200020794976 [0,2,0,0,0,0|2,0,0]=4 4681 B13R1.4021 CNCc1c(ccc(c1Br)OC)F 207a_100102657272_200010245882 [0,2,0,0,0,0|2,0,0]=4 4682 B13R1.4021 CNCc1c(ccc(c1Br)OC)F 270004a_106832991635_200010245882 [0,2,0,0,0,0|2,0,0]=4 4683 B13R1.4021 CNCc1c(ccc(c1Cl)OC)Br 207a_100102657272_200021056636 [0,2,0,0,0,0|2,0,0]=4 4684 B13R1.4021 CNCc1c(ccc(c1Cl)OC)Br 270004a_106832991635_200021056636 [0,2,0,0,0,0|2,0,0]=4 4685 B13R1.4021 CNCc1c(ccc(c1Cl)OC)F 207a_100102657272_100000062075 [0,2,0,0,0,0|2,0,0]=4 4686 B13R1.4021 CNCc1c(ccc(c1Cl)OC)F 26a_100102657272_200000061507 [0,2,0,0,0,0|2,0,0]=4 4687 B13R1.4021 CNCc1c(ccc(c1Cl)OC)F 270004a_106832991635_100000062075 [0,2,0,0,0,0|2,0,0]=4 4688 B13R1.4021 CNCc1c(ccc(c1Cl)OC)F 34a_100000062220_200000210301 [0,2,0,0,0,0|2,0,0]=4 4689 B13R1.4021 CNCc1c(ccc(c1F)OC)Br 207a_100102657272_100010204294 [0,2,0,0,0,0|2,0,0]=4 4690 B13R1.4021 CNCc1c(ccc(c1F)OC)Br 2230a_106832991635_200011099544 [0,2,0,0,0,0|2,0,0]=4 4691 B13R1.4021 CNCc1c(ccc(c1F)OC)Br 270004a_106832991635_100010204294 [0,2,0,0,0,0|2,0,0]=4 4692 B13R1.4021 CNCc1c(ccc(c1F)OC)Br 34a_100102657272_200011099544 [0,2,0,0,0,0|2,0,0]=4 4693 B13R1.4021 CNCc1c(ccc(c1F)OC)Br 7a_106832991635_200011099544 [0,2,0,0,0,0|2,0,0]=4 4694 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 207a_100102657272_100000062077 [0,2,0,0,0,0|2,0,0]=4 4695 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 2230a_106832991635_100009814550 [0,2,0,0,0,0|2,0,0]=4 4696 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 2230a_115082355833_200000210301 [0,2,0,0,0,0|2,0,0]=4 4697 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 270004a_106832991635_100000062077 [0,2,0,0,0,0|2,0,0]=4 4698 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 34a_100102657272_100009814550 [0,2,0,0,0,0|2,0,0]=4 4699 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 34a_115082355833_200000210301 [0,2,0,0,0,0|2,0,0]=4 4700 B13R1.4021 CNCc1c(ccc(c1F)OC)Cl 7a_106832991635_100009814550 [0,2,0,0,0,0|2,0,0]=4 4701 B13R1.4021 CNCc1c(ccc(c1F)OC)F 207a_100102657272_100000062052 [0,2,0,0,0,0|2,0,0]=4 4702 B13R1.4021 CNCc1c(ccc(c1F)OC)F 2230a_106832991635_100009814547 [0,2,0,0,0,0|2,0,0]=4 4703 B13R1.4021 CNCc1c(ccc(c1F)OC)F 270004a_106832991635_100000062052 [0,2,0,0,0,0|2,0,0]=4 4704 B13R1.4021 CNCc1c(ccc(c1F)OC)F 34a_100102657272_100009814547 [0,2,0,0,0,0|2,0,0]=4 4705 B13R1.4021 CNCc1c(ccc(c1F)OC)F 34a_114901603625_200000210301 [0,2,0,0,0,0|2,0,0]=4 4706 B13R1.4021 CNCc1c(ccc(c1F)OC)F 7a_106832991635_100009814547 [0,2,0,0,0,0|2,0,0]=4 4707 B13R1.4021 COCc1c(ccc(c1Br)OC)F 34a_200010942130_200000210301 [0,2,0,0,0,0|1,0,0]=3 4708 B13R1.4021 COCc1c(ccc(c1Br)OC)F 7a_200010942130_200000210301 [0,2,0,0,0,0|1,0,0]=3 4709 B13R1.4021 COCc1c(ccc(c1Cl)OC)F 34a_200000081357_200000210301 [0,2,0,0,0,0|1,0,0]=3 4710 B13R1.4021 COCc1c(ccc(c1Cl)OC)F 7a_200000081357_200000210301 [0,2,0,0,0,0|1,0,0]=3 4711 B13R1.4021 COCc1c(ccc(c1F)OC)Br 34a_100138415774_200011099544 [0,2,0,0,0,0|1,0,0]=3 4712 B13R1.4021 COCc1c(ccc(c1F)OC)Cl 34a_100000081358_200000210301 [0,2,0,0,0,0|1,0,0]=3 4713 B13R1.4021 COCc1c(ccc(c1F)OC)Cl 34a_100138415774_100009814550 [0,2,0,0,0,0|1,0,0]=3 4714 B13R1.4021 COCc1c(ccc(c1F)OC)Cl 7a_100000081358_200000210301 [0,2,0,0,0,0|1,0,0]=3 4715 B13R1.4021 COCc1c(ccc(c1F)OC)F 34a_100000081351_200000210301 [0,2,0,0,0,0|1,0,0]=3 4716 B13R1.4021 COCc1c(ccc(c1F)OC)F 34a_100138415774_100009814547 [0,2,0,0,0,0|1,0,0]=3 4717 B13R1.4021 COCc1c(ccc(c1F)OC)F 7a_100000081351_200000210301 [0,2,0,0,0,0|1,0,0]=3 4718 B13R1.4021 COc1ccc(c(c1Br)CO[13CH3])F 34a_200010942130_200025704644 [0,2,0,0,0,0|1,0,0]=3 4719 B13R1.4021 COc1ccc(c(c1Br)CO[13CH3])F 7a_200010942130_200025704644 [0,2,0,0,0,0|1,0,0]=3 4720 B13R1.4021 COc1ccc(c(c1Br)OCF)Cl 34a_200020794976_100015361967 [0,2,0,0,0,0|1,0,0]=3 4721 B13R1.4021 COc1ccc(c(c1Br)OCF)Cl 7a_200020794976_100015361967 [0,2,0,0,0,0|1,0,0]=3 4722 B13R1.4021 COc1ccc(c(c1Br)SCF)F 62a_100015361967_200055343962 [0,2,0,0,0,0|1,1,0]=4 4723 B13R1.4021 COc1ccc(c(c1Br)SCF)F 62a_200055343962_100015361967 [0,2,0,0,0,0|1,1,0]=4 4724 B13R1.4021 COc1ccc(c(c1C)NCF)C 34a_100000089760_100015361967 [0,2,0,0,0,0|2,0,0]=4 4725 B13R1.4021 COc1ccc(c(c1C)NCF)C 7a_100000089760_100015361967 [0,2,0,0,0,0|2,0,0]=4 4726 B13R1.4021 COc1ccc(c(c1C)SCF)C 62a_100015361967_100016151084 [0,2,0,0,0,0|1,1,0]=4 4727 B13R1.4021 COc1ccc(c(c1C)SCF)C 62a_100016151084_100015361967 [0,2,0,0,0,0|1,1,0]=4 4728 B13R1.4021 COc1ccc(c(c1Cl)CN[13CH3])F 34a_100000062220_200025704644 [0,2,0,0,0,0|2,0,0]=4 4729 B13R1.4021 COc1ccc(c(c1Cl)CO[13CH3])F 34a_200000081357_200025704644 [0,2,0,0,0,0|1,0,0]=3 4730 B13R1.4021 COc1ccc(c(c1Cl)CO[13CH3])F 7a_200000081357_200025704644 [0,2,0,0,0,0|1,0,0]=3 4731 B13R1.4021 COc1ccc(c(c1Cl)NCF)Cl 34a_100009956855_100015361967 [0,2,0,0,0,0|2,0,0]=4 4732 B13R1.4021 COc1ccc(c(c1Cl)NCF)F 34a_100000061512_100015361967 [0,2,0,0,0,0|2,0,0]=4 4733 B13R1.4021 COc1ccc(c(c1Cl)OCF)F 34a_200000061507_100015361967 [0,2,0,0,0,0|1,0,0]=3 4734 B13R1.4021 COc1ccc(c(c1Cl)OCF)F 7a_200000061507_100015361967 [0,2,0,0,0,0|1,0,0]=3 4735 B13R1.4021 COc1ccc(c(c1F)CN[13CH3])Cl 2230a_115082355833_200025704644 [0,2,0,0,0,0|2,0,0]=4 4736 B13R1.4021 COc1ccc(c(c1F)CN[13CH3])Cl 34a_115082355833_200025704644 [0,2,0,0,0,0|2,0,0]=4 4737 B13R1.4021 COc1ccc(c(c1F)CN[13CH3])F 34a_114901603625_200025704644 [0,2,0,0,0,0|2,0,0]=4 4738 B13R1.4021 COc1ccc(c(c1F)CO[13CH3])Cl 34a_100000081358_200025704644 [0,2,0,0,0,0|1,0,0]=3 4739 B13R1.4021 COc1ccc(c(c1F)CO[13CH3])Cl 7a_100000081358_200025704644 [0,2,0,0,0,0|1,0,0]=3 4740 B13R1.4021 COc1ccc(c(c1F)CO[13CH3])F 34a_100000081351_200025704644 [0,2,0,0,0,0|1,0,0]=3 4741 B13R1.4021 COc1ccc(c(c1F)CO[13CH3])F 7a_100000081351_200025704644 [0,2,0,0,0,0|1,0,0]=3 4742 B13R1.4021 COc1ccc(c(c1F)CSC)Br 62a_200000210301_200011099544 [0,2,0,0,0,0|1,1,0]=4 4743 B13R1.4021 COc1ccc(c(c1F)CSC)Br 62a_200011099544_200000210301 [0,2,0,0,0,0|1,1,0]=4 4744 B13R1.4021 COc1ccc(c(c1F)CSC)Cl 62a_100009814550_200000210301 [0,2,0,0,0,0|1,1,0]=4 4745 B13R1.4021 COc1ccc(c(c1F)CSC)Cl 62a_200000210301_100009814550 [0,2,0,0,0,0|1,1,0]=4 4746 B13R1.4021 COc1ccc(c(c1F)CSC)F 62a_100009814547_200000210301 [0,2,0,0,0,0|1,1,0]=4 4747 B13R1.4021 COc1ccc(c(c1F)CSC)F 62a_200000210301_100009814547 [0,2,0,0,0,0|1,1,0]=4 4748 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])Br 62a_200011099544_200025704644 [0,2,0,0,0,0|1,1,0]=4 4749 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])Br 62a_200025704644_200011099544 [0,2,0,0,0,0|1,1,0]=4 4750 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])Cl 62a_100009814550_200025704644 [0,2,0,0,0,0|1,1,0]=4 4751 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])Cl 62a_200025704644_100009814550 [0,2,0,0,0,0|1,1,0]=4 4752 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])F 62a_100009814547_200025704644 [0,2,0,0,0,0|1,1,0]=4 4753 B13R1.4021 COc1ccc(c(c1F)CS[13CH3])F 62a_200025704644_100009814547 [0,2,0,0,0,0|1,1,0]=4 4754 B13R1.4021 COc1ccc(c(c1F)NCF)Cl 34a_100000061519_100015361967 [0,2,0,0,0,0|2,0,0]=4 4755 B13R1.4021 COc1ccc(c(c1F)NCF)F 34a_200000062051_100015361967 [0,2,0,0,0,0|2,0,0]=4 4756 B13R1.4021 COc1ccc(c(c1F)OCF)F 34a_100000062056_100015361967 [0,2,0,0,0,0|1,0,0]=3 4757 B13R1.4021 COc1ccc(c(c1F)OCF)F 7a_100000062056_100015361967 [0,2,0,0,0,0|1,0,0]=3 4758 B13R1.4021 COc1ccc(c(c1F)SCF)F 62a_100010946477_100015361967 [0,2,0,0,0,0|1,1,0]=4 4759 B13R1.4021 COc1ccc(c(c1F)SCF)F 62a_100015361967_100010946477 [0,2,0,0,0,0|1,1,0]=4 4760 B13R1.645 CC(C)(C)c1cccc(c1O)S[13CH3] 62a_100010083445_200025704644 [0,2,0,0,0,0|1,1,0]=4 4761 B13R1.645 CC(C)(C)c1cccc(c1O)S[13CH3] 62a_200025704644_100010083445 [0,2,0,0,0,0|1,1,0]=4 4762 B13R1.645 CSc1cccc(c1O)C(C)(C)C 62a_100010083445_200000210301 [0,2,0,0,0,0|1,1,0]=4 4763 B13R1.645 CSc1cccc(c1O)C(C)(C)C 62a_200000210301_100010083445 [0,2,0,0,0,0|1,1,0]=4 4764 B13R1.2137 C=C(C)c1cccc(c1C#N)OC 271570a_100000694244_100012356440 [0,2,0,0,0,0|2,0,0]=4 4765 B13R1.2137 C=C(C)c1cccc(c1C=O)OC 271570a_100000694244_100009814803 [0,2,0,0,0,0|1,0,1]=4 4766 B13R1.2137 C=C(C)c1cccc(c1OC)OC 271570a_100000694244_100009815961 [0,2,0,0,0,0|1,0,0]=3 4767 B13R1.2137 CCc1c(cccc1C(=O)C)OC 1458a_100000101922_200000210301 [0,2,0,0,0,0|2,0,0]=4 4768 B13R1.2137 CCc1c(cccc1C(=O)[13CH3])OC 1458a_100000101922_200025704644 [0,2,0,0,0,0|2,0,0]=4 4769 B13R1.2137 COc1c(cccc1C(=O)C)SC 62a_100010725610_200000210301 [0,2,0,0,0,0|1,1,0]=4 4770 B13R1.2137 COc1c(cccc1C(=O)C)S[13CH3] 62a_100010725610_200025704644 [0,2,0,0,0,0|1,1,0]=4 4771 B13R1.2137 COc1c(cccc1[N+](=O)[O-])O[13CH3] 34a_200000064994_200025704644 [0,2,0,0,0,0|2,0,0]=4 4772 B13R1.2137 COc1cccc(c1C#N)N(C)C 2230a_100009950947_200000210301 [0,2,0,0,0,0|2,0,0]=4 4773 B13R1.2137 COc1cccc(c1C#N)N(C)C 269982a_100009950947_200000210301 [0,2,0,0,0,0|2,0,0]=4 4774 B13R1.2137 COc1cccc(c1C#N)N(C)[13CH3] 2230a_100009950947_200025704644 [0,2,0,0,0,0|2,0,0]=4 4775 B13R1.2137 COc1cccc(c1C#N)N(C)[13CH3] 269982a_100009950947_200025704644 [0,2,0,0,0,0|2,0,0]=4 4776 B13R1.2137 COc1cccc(c1OC)C(=O)C 1458a_100000210806_200000210301 [0,2,0,0,0,0|1,0,0]=3 4777 B13R1.2137 COc1cccc(c1OC)C(=O)[13CH3] 1458a_100000210806_200025704644 [0,2,0,0,0,0|1,0,0]=3 4778 B13R1.2137 COc1cccc(c1OC)[N+](=O)[O-] 34a_200000064994_200000210301 [0,2,0,0,0,0|2,0,0]=4 4779 B13R1.3097 C=C(C)c1c(ccc(c1C)OC)C 271570a_100000694244_100016151084 [0,2,0,0,0,0|2,0,0]=4 4780 B13R1.3097 C=C(C)c1c(ccc(c1F)OC)F 271570a_100000694244_100010946477 [0,2,0,0,0,0|2,0,0]=4 4781 B13R1.3097 COc1ccc(c(c1Br)C(=O)C)Br 1458a_200020932704_200000210301 [0,2,0,0,0,0|2,0,0]=4 4782 B13R1.3097 COc1ccc(c(c1Br)C(=O)[13CH3])Br 1458a_200020932704_200025704644 [0,2,0,0,0,0|2,0,0]=4 4783 B13R1.3097 COc1ccc(c(c1C)C(=O)C)Br 1458a_100010074600_200000210301 [0,2,0,0,0,0|2,0,0]=4 4784 B13R1.3097 COc1ccc(c(c1C)C(=O)[13CH3])Br 1458a_100010074600_200025704644 [0,2,0,0,0,0|2,0,0]=4 4785 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)Cl 1458a_200010760820_200000210301 [0,2,0,0,0,0|2,0,0]=4 4786 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)F 1458a_100000062076_200000210301 [0,2,0,0,0,0|2,0,0]=4 4787 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])Cl 1458a_200010760820_200025704644 [0,2,0,0,0,0|2,0,0]=4 4788 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000062076_200025704644 [0,2,0,0,0,0|2,0,0]=4 4789 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Br 1458a_100010204293_200000210301 [0,2,0,0,0,0|2,0,0]=4 4790 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Cl 1458a_100000062078_200000210301 [0,2,0,0,0,0|2,0,0]=4 4791 B13R1.3097 COc1ccc(c(c1F)C(=O)C)F 1458a_100000062053_200000210301 [0,2,0,0,0,0|2,0,0]=4 4792 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010204293_200025704644 [0,2,0,0,0,0|2,0,0]=4 4793 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000062078_200025704644 [0,2,0,0,0,0|2,0,0]=4 4794 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000062053_200025704644 [0,2,0,0,0,0|2,0,0]=4 4795 B13R1.3230 C=C(C)c1ccc(c(c1F)OC)Cl 271570a_100000694244_200135222481 [0,2,0,0,0,0|2,0,0]=4 4796 B13R1.3230 C=C(C)c1ccc(c(c1F)OC)N 271570a_100000694244_100010734149 [0,2,0,0,0,0|2,0,0]=4 4797 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Br 1458a_100009816242_200000210301 [0,2,0,0,0,0|2,0,0]=4 4798 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Cl 1458a_100010116254_200000210301 [0,2,0,0,0,0|2,0,0]=4 4799 B13R1.3230 COc1c(ccc(c1F)C(=O)C)F 1458a_100000061937_200000210301 [0,2,0,0,0,0|2,0,0]=4 4800 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100009816242_200025704644 [0,2,0,0,0,0|2,0,0]=4 4801 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100010116254_200025704644 [0,2,0,0,0,0|2,0,0]=4 4802 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000061937_200025704644 [0,2,0,0,0,0|2,0,0]=4 4803 B13R1.3801 C=C(C)c1cccc(c1O)C(=O)C 271570a_100000694244_100009815558 [0,2,0,0,0,0|2,0,0]=4 4804 B13R1.3801 CC(=O)c1cccc(c1O)C(C)C 1458a_200011217578_200000210301 [0,2,0,0,0,0|2,0,0]=4 4805 B13R1.3801 CC(C)c1cccc(c1O)C(=O)[13CH3] 1458a_200011217578_200025704644 [0,2,0,0,0,0|2,0,0]=4 4806 B13R1.3801 CC(C)c1cccc(c1O)C(C)C 271570a_203496583355_100009817198 [0,2,0,0,0,0|2,0,0]=4 4807 B13R1.2277 C=Cc1c(ccc(c1SC)F)OC 271570a_100011290941_200021624531 [0,2,0,0,0,0|1,1,0]=4 4808 B13R1.2277 COc1ccc(c(c1C=O)SC)F 62a_100021272739_200000210301 [0,2,0,0,0,0|0,1,1]=4 4809 B13R1.2277 COc1ccc(c(c1C=O)S[13CH3])F 62a_100021272739_200025704644 [0,2,0,0,0,0|0,1,1]=4 4810 B13R1.2277 COc1ccc(c(c1OC)OC)O 271570a_203496583355_100011320274 [0,2,0,0,0,0|0,0,0]=2 4811 B13R1.2277 COc1ccc(c(c1SC)SC)F 62a_200000210301_200021624531 [0,2,0,0,0,0|0,2,0]=4 4812 B13R1.2277 COc1ccc(c(c1SC)SC)F 62a_200021624531_200000210301 [0,2,0,0,0,0|0,2,0]=4 4813 B13R1.2277 COc1ccc(c(c1S[13CH3])SC)F 62a_200021624531_200025704644 [0,2,0,0,0,0|0,2,0]=4 4814 B13R1.2277 COc1ccc(c(c1S[13CH3])SC)F 62a_200025704644_200021624531 [0,2,0,0,0,0|0,2,0]=4 4815 B13R1.2422 C=Cc1ccc(c(c1C=O)O)OC 271570a_100011290941_100009813834 [0,2,0,0,0,0|2,0,0]=4 4816 B13R1.2422 C=Cc1ccc(c(c1OC)C)OC 271570a_100011290941_100010234078 [0,2,0,0,0,0|1,0,0]=3 4817 B13R1.2422 C=Cc1ccc(c(c1OC)F)OC 271570a_100011290941_200010341284 [0,2,0,0,0,0|1,0,0]=3 4818 B13R1.2422 C=Cc1ccc(c(c1SC)F)OC 271570a_100011290941_200011099385 [0,2,0,0,0,0|1,1,0]=4 4819 B13R1.2422 CNc1ccc(c(c1OC)F)OC 34a_100000070076_200000210301 [0,2,0,0,0,0|1,0,0]=3 4820 B13R1.2422 COc1c(ccc(c1F)SC)C#N 62a_200000210301_200010764283 [0,2,0,0,0,0|1,1,0]=4 4821 B13R1.2422 COc1c(ccc(c1F)S[13CH3])C#N 62a_200025704644_200010764283 [0,2,0,0,0,0|1,1,0]=4 4822 B13R1.2422 COc1ccc(c(c1C)OC)SC 62a_100010234078_200000210301 [0,2,0,0,0,0|1,0,0]=3 4823 B13R1.2422 COc1ccc(c(c1C)OC)SC 62a_200000210301_100010234078 [0,2,0,0,0,0|1,0,0]=3 4824 B13R1.2422 COc1ccc(c(c1C)OC)S[13CH3] 62a_100010234078_200025704644 [0,2,0,0,0,0|1,0,0]=3 4825 B13R1.2422 COc1ccc(c(c1C)OC)S[13CH3] 62a_200025704644_100010234078 [0,2,0,0,0,0|1,0,0]=3 4826 B13R1.2422 COc1ccc(c(c1F)OC)N[13CH3] 34a_100000070076_200025704644 [0,2,0,0,0,0|1,0,0]=3 4827 B13R1.2422 COc1ccc(c(c1F)OC)SC 62a_200000210301_200010341284 [0,2,0,0,0,0|1,0,0]=3 4828 B13R1.2422 COc1ccc(c(c1F)OC)SC 62a_200010341284_200000210301 [0,2,0,0,0,0|1,0,0]=3 4829 B13R1.2422 COc1ccc(c(c1F)OC)S[13CH3] 62a_200010341284_200025704644 [0,2,0,0,0,0|1,0,0]=3 4830 B13R1.2422 COc1ccc(c(c1F)OC)S[13CH3] 62a_200025704644_200010341284 [0,2,0,0,0,0|1,0,0]=3 4831 B13R1.2422 COc1ccc(c(c1F)SC)OC 62a_200000210301_200016180952 [0,2,0,0,0,0|1,1,0]=4 4832 B13R1.2422 COc1ccc(c(c1F)SC)OC 62a_200016180952_200000210301 [0,2,0,0,0,0|1,1,0]=4 4833 B13R1.2422 COc1ccc(c(c1F)SC)SC 62a_200000210301_200011099385 [0,2,0,0,0,0|1,1,0]=4 4834 B13R1.2422 COc1ccc(c(c1F)SC)SC 62a_200011099385_200000210301 [0,2,0,0,0,0|1,1,0]=4 4835 B13R1.2422 COc1ccc(c(c1F)SC)S[13CH3] 62a_200011099385_200025704644 [0,2,0,0,0,0|1,1,0]=4 4836 B13R1.2422 COc1ccc(c(c1F)SC)S[13CH3] 62a_200025704644_200011099385 [0,2,0,0,0,0|1,1,0]=4 4837 B13R1.2422 COc1ccc(c(c1F)S[13CH3])OC 62a_200016180952_200025704644 [0,2,0,0,0,0|1,1,0]=4 4838 B13R1.2422 COc1ccc(c(c1F)S[13CH3])OC 62a_200025704644_200016180952 [0,2,0,0,0,0|1,1,0]=4 4839 B13R1.2422 COc1ccc(c(c1O)SC)C=O 62a_200000210301_200009828465 [0,2,0,0,0,0|0,1,0]=3 4840 B13R1.2422 COc1ccc(c(c1O)S[13CH3])C=O 62a_200025704644_200009828465 [0,2,0,0,0,0|0,1,0]=3 4841 B13R1.2422 COc1ccc(c(c1OC)C)SC 62a_200000210301_100010000156 [0,2,0,0,0,0|1,1,0]=4 4842 B13R1.2422 COc1ccc(c(c1OC)C)S[13CH3] 62a_200025704644_100010000156 [0,2,0,0,0,0|1,1,0]=4 4843 B13R1.2422 COc1ccc(c(c1OC)O)C=O 271570a_203496583355_100009814707 [0,2,0,0,0,0|2,0,0]=4 4844 B13R1.3378 CCc1c(cc(c(c1Cl)OC)N)Cl 34a_100020625787_200000210301 [0,2,0,0,0,0|2,0,0]=4 4845 B13R1.3378 CCc1c(cc(c(c1Cl)OC)N)Cl 7a_100020625787_200000210301 [0,2,0,0,0,0|2,0,0]=4 4846 B13R1.3378 CCc1c(cc(c(c1Cl)O[13CH3])N)Cl 34a_100020625787_200025704644 [0,2,0,0,0,0|2,0,0]=4 4847 B13R1.3378 CCc1c(cc(c(c1Cl)O[13CH3])N)Cl 7a_100020625787_200025704644 [0,2,0,0,0,0|2,0,0]=4 4848 B13R1.2356 C=C(C)c1c(cccc1OC)OC 271570a_100000694244_100000050062 [0,2,0,0,0,0|1,0,0]=3 4849 B13R1.2356 C=C(C)c1c(ccnc1OC)OC 271570a_100000694244_100010114374 [0,2,0,0,0,0|2,0,0]=4 4850 B13R1.2356 C=C(C)c1c(cncc1OC)OC 271570a_100000694244_200010191558 [0,2,0,0,0,0|2,0,0]=4 4851 B13R1.2356 CNc1cccc(c1C(=O)N)OC 34a_200012186629_200000210301 [0,2,0,0,0,0|1,0,1]=4 4852 B13R1.2356 COc1cccc(c1C(=O)C)OC 1458a_100000188675_200000210301 [0,2,0,0,0,0|0,0,1]=3 4853 B13R1.2356 COc1cccc(c1C(=O)C)OC 34a_100000691520_200000210301 [0,2,0,0,0,0|0,0,1]=3 4854 B13R1.2356 COc1cccc(c1C(=O)C)OC 7a_100000691520_200000210301 [0,2,0,0,0,0|0,0,1]=3 4855 B13R1.2356 COc1cccc(c1C(=O)C)O[13CH3] 34a_100000691520_200025704644 [0,2,0,0,0,0|0,0,1]=3 4856 B13R1.2356 COc1cccc(c1C(=O)C)O[13CH3] 7a_100000691520_200025704644 [0,2,0,0,0,0|0,0,1]=3 4857 B13R1.2356 COc1cccc(c1C(=O)C)SC 62a_100010725609_200000210301 [0,2,0,0,0,0|0,1,1]=4 4858 B13R1.2356 COc1cccc(c1C(=O)C)S[13CH3] 62a_100010725609_200025704644 [0,2,0,0,0,0|0,1,1]=4 4859 B13R1.2356 COc1cccc(c1C(=O)N)N[13CH3] 34a_200012186629_200025704644 [0,2,0,0,0,0|1,0,1]=4 4860 B13R1.2356 COc1cccc(c1C(=O)N)SC 62a_200010146778_200000210301 [0,2,0,0,0,0|0,1,1]=4 4861 B13R1.2356 COc1cccc(c1C(=O)N)S[13CH3] 62a_200010146778_200025704644 [0,2,0,0,0,0|0,1,1]=4 4862 B13R1.2356 COc1cccc(c1C(=O)[13CH3])OC 1458a_100000188675_200025704644 [0,2,0,0,0,0|0,0,1]=3 4863 B13R1.2356 COc1cccc(c1[N+](=O)[O-])OC 34a_200012185171_200000210301 [0,2,0,0,0,0|0,0,1]=3 4864 B13R1.2356 COc1cccc(c1[N+](=O)[O-])OC 7a_200012185171_200000210301 [0,2,0,0,0,0|0,0,1]=3 4865 B13R1.2356 COc1cccc(c1[N+](=O)[O-])O[13CH3] 34a_200012185171_200025704644 [0,2,0,0,0,0|0,0,1]=3 4866 B13R1.2356 COc1cccc(c1[N+](=O)[O-])O[13CH3] 7a_200012185171_200025704644 [0,2,0,0,0,0|0,0,1]=3 4867 B13R1.3904 C=C=Cc1c(cccc1OC)OC 271570a_100015277604_100000050062 [0,2,0,0,0,0|1,0,0]=3 4868 B13R1.3904 C=C=Cc1c(ccnc1OC)OC 271570a_100015277604_100010114374 [0,2,0,0,0,0|2,0,0]=4 4869 B13R1.3904 C=C=Cc1c(cncc1OC)OC 271570a_100015277604_200010191558 [0,2,0,0,0,0|2,0,0]=4 4870 B13R1.3904 CC=Cc1c(cccc1OC)OC 271570a_100016259895_100000050062 [0,2,0,0,0,0|1,0,0]=3 4871 B13R1.3904 CC=Cc1c(ccnc1OC)OC 271570a_100016259895_100010114374 [0,2,0,0,0,0|2,0,0]=4 4872 B13R1.3904 CC=Cc1c(cncc1OC)OC 271570a_100016259895_200010191558 [0,2,0,0,0,0|2,0,0]=4 4873 B13R1.3904 CCNc1c(cccc1OC)OC 2230a_100011218430_100000210202 [0,2,0,0,0,0|1,0,0]=3 4874 B13R1.3904 CCNc1c(cccc1OC)OC 34a_100011218430_100000210202 [0,2,0,0,0,0|1,0,0]=3 4875 B13R1.3904 CCNc1c(cccc1SC)OC 2230a_200012283368_100000210202 [0,2,0,0,0,0|1,1,0]=4 4876 B13R1.3904 CCNc1c(cccc1SC)OC 34a_200012283368_100000210202 [0,2,0,0,0,0|1,1,0]=4 4877 B13R1.3904 CCOc1c(cccc1CC)CC 34a_100000078057_100000210202 [0,2,0,0,0,0|2,0,0]=4 4878 B13R1.3904 CCOc1c(cccc1CC)CC 7a_100000078057_100000210202 [0,2,0,0,0,0|2,0,0]=4 4879 B13R1.3904 CCOc1c(cccc1OC)C#N 34a_100011934230_100000210202 [0,2,0,0,0,0|2,0,0]=4 4880 B13R1.3904 CCOc1c(cccc1OC)CO 34a_100011218668_100000210202 [0,2,0,0,0,0|2,0,0]=4 4881 B13R1.3904 CCOc1c(cccc1OC)OC 34a_100000211025_100000210202 [0,2,0,0,0,0|0,0,0]=2 4882 B13R1.3904 CCSc1c(cccc1OC)OC 62a_100000210202_100000690108 [0,2,0,0,0,0|0,1,0]=3 4883 B13R1.3904 CCSc1c(cccc1OC)OC 62a_100000690108_100000210202 [0,2,0,0,0,0|0,1,0]=3 4884 B13R1.3904 CCSc1c(ccnc1OC)OC 62a_100000210202_100010114374 [0,2,0,0,0,0|1,1,0]=4 4885 B13R1.3904 CCSc1c(ccnc1OC)OC 62a_100010114374_100000210202 [0,2,0,0,0,0|1,1,0]=4 4886 B13R1.3904 CCSc1c(cncc1OC)OC 62a_100000210202_200010191558 [0,2,0,0,0,0|1,1,0]=4 4887 B13R1.3904 CCSc1c(cncc1OC)OC 62a_200010191558_100000210202 [0,2,0,0,0,0|1,1,0]=4 4888 B13R1.3904 CCc1cccc(c1OCF)CC 34a_100000078057_100015361967 [0,2,0,0,0,0|2,0,0]=4 4889 B13R1.3904 CCc1cccc(c1OCF)CC 7a_100000078057_100015361967 [0,2,0,0,0,0|2,0,0]=4 4890 B13R1.3904 CNCc1c(cccc1OC)OC 207a_100102657272_100000691606 [0,2,0,0,0,0|1,0,0]=3 4891 B13R1.3904 CNCc1c(cccc1OC)OC 2230a_100011211632_200000210301 [0,2,0,0,0,0|1,0,0]=3 4892 B13R1.3904 CNCc1c(cccc1OC)OC 270004a_106832991635_100000691606 [0,2,0,0,0,0|1,0,0]=3 4893 B13R1.3904 CNCc1c(cccc1OC)OC 34a_100011211632_200000210301 [0,2,0,0,0,0|1,0,0]=3 4894 B13R1.3904 COCc1c(cccc1OC)OC 34a_100000686646_200000210301 [0,2,0,0,0,0|0,0,0]=2 4895 B13R1.3904 COCc1c(cccc1OC)OC 7a_100000686646_200000210301 [0,2,0,0,0,0|0,0,0]=2 4896 B13R1.3904 COCc1c(cccc1SC)OC 34a_200009828978_200000210301 [0,2,0,0,0,0|0,1,0]=3 4897 B13R1.3904 COc1cccc(c1CN[13CH3])OC 2230a_100011211632_200025704644 [0,2,0,0,0,0|1,0,0]=3 4898 B13R1.3904 COc1cccc(c1CN[13CH3])OC 34a_100011211632_200025704644 [0,2,0,0,0,0|1,0,0]=3 4899 B13R1.3904 COc1cccc(c1CO[13CH3])OC 34a_100000686646_200025704644 [0,2,0,0,0,0|0,0,0]=2 4900 B13R1.3904 COc1cccc(c1CO[13CH3])OC 7a_100000686646_200025704644 [0,2,0,0,0,0|0,0,0]=2 4901 B13R1.3904 COc1cccc(c1CO[13CH3])SC 34a_200009828978_200025704644 [0,2,0,0,0,0|0,1,0]=3 4902 B13R1.3904 COc1cccc(c1NCF)OC 34a_100011218430_100015361967 [0,2,0,0,0,0|1,0,0]=3 4903 B13R1.3904 COc1cccc(c1NCF)SC 34a_200012283368_100015361967 [0,2,0,0,0,0|1,1,0]=4 4904 B13R1.3904 COc1cccc(c1OCF)C#N 34a_100011934230_100015361967 [0,2,0,0,0,0|2,0,0]=4 4905 B13R1.3904 COc1cccc(c1OCF)CO 34a_100011218668_100015361967 [0,2,0,0,0,0|2,0,0]=4 4906 B13R1.3904 COc1cccc(c1OCF)OC 34a_100000211025_100015361967 [0,2,0,0,0,0|0,0,0]=2 4907 B13R1.3904 COc1cccc(c1SCF)OC 62a_100000690108_100015361967 [0,2,0,0,0,0|0,1,0]=3 4908 B13R1.3904 COc1cccc(c1SCF)OC 62a_100015361967_100000690108 [0,2,0,0,0,0|0,1,0]=3 4909 B13R1.3904 COc1ccnc(c1SCF)OC 62a_100010114374_100015361967 [0,2,0,0,0,0|1,1,0]=4 4910 B13R1.3904 COc1ccnc(c1SCF)OC 62a_100015361967_100010114374 [0,2,0,0,0,0|1,1,0]=4 4911 B13R1.3904 COc1cncc(c1SCF)OC 62a_100015361967_200010191558 [0,2,0,0,0,0|1,1,0]=4 4912 B13R1.3904 COc1cncc(c1SCF)OC 62a_200010191558_100015361967 [0,2,0,0,0,0|1,1,0]=4 4913 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,0,1,1,0,0|2,0,0]=4 4914 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,0,1,1,0,0|2,0,0]=4 4915 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,0,1,1,0,0|2,0,0]=4 4916 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,0,1,1,0,0|2,0,0]=4 4917 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,0,1,1,0,0|2,0,0]=4 4918 B11R1.41 CC=Cc1ncccc1OC 271570a_100016259895_100000690851 [0,0,1,1,0,0|2,0,0]=4 4919 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,0,1,1,0,0|1,0,1]=4 4920 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,0,1,1,0,0|1,0,1]=4 4921 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,0,1,1,0,0|1,0,1]=4 4922 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,0,1,1,0,0|1,0,1]=4 4923 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,0,1,1,0,0|1,0,1]=4 4924 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,0,1,1,0,0|1,0,1]=4 4925 B11R1.41 COCc1ncccc1OC 34a_100011998681_200000210301 [0,0,1,1,0,0|1,0,1]=4 4926 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,0,1,1,0,0|1,0,1]=4 4927 B11R1.41 COc1cccnc1CO[13CH3] 34a_100011998681_200025704644 [0,0,1,1,0,0|1,0,1]=4 4928 B11R1.277 COc1cc(c(cc1O)C)F 271570a_203496583355_100010201977 [0,0,1,1,0,0|2,0,0]=4 4929 B11R1.277 COc1cc(c(cc1O)C)N 271570a_203496583355_100010232211 [0,0,1,1,0,0|2,0,0]=4 4930 B11R1.59 COC(=O)c1[nH]ccc1OC 34a_100000131702_200000210301 [0,0,1,1,0,0|2,0,0]=4 4931 B11R1.59 COC(=O)c1[nH]ccc1O[13CH3] 34a_100000131702_200025704644 [0,0,1,1,0,0|2,0,0]=4 4932 B11R1.59 COC(=O)c1occc1SC 62a_200000210301_100012676306 [0,0,1,1,0,0|1,1,0]=4 4933 B11R1.59 COC(=O)c1occc1S[13CH3] 62a_200025704644_100012676306 [0,0,1,1,0,0|1,1,0]=4 4934 B11R1.59 COC(=O)c1sccc1OC 7a_100000043449_200000210301 [0,0,1,1,0,0|1,1,0]=4 4935 B11R1.59 COC(=O)c1sccc1O[13CH3] 7a_100000043449_200025704644 [0,0,1,1,0,0|1,1,0]=4 4936 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [0,0,1,1,0,0|2,0,0]=4 4937 B11R1.83 CC=Cc1ccc(cn1)OC 271570a_100016259895_100000755202 [0,0,1,1,0,0|2,0,0]=4 4938 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [0,0,1,1,0,0|1,0,1]=4 4939 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [0,0,1,1,0,0|1,0,1]=4 4940 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [0,0,1,1,0,0|1,0,1]=4 4941 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [0,0,1,1,0,0|1,0,1]=4 4942 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [0,0,1,1,0,0|1,0,1]=4 4943 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [0,0,1,1,0,0|1,0,1]=4 4944 B11R1.83 COCc1ccc(cn1)OC 34a_100011998694_200000210301 [0,0,1,1,0,0|1,0,1]=4 4945 B11R1.83 COCc1ccc(cn1)OC 34a_100138415774_200000757186 [0,0,1,1,0,0|1,0,1]=4 4946 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [0,0,1,1,0,0|1,0,1]=4 4947 B11R1.83 COc1ccc(nc1)CO[13CH3] 34a_100011998694_200025704644 [0,0,1,1,0,0|1,0,1]=4 4948 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [1,0,0,1,0,0|2,0,0]=4 4949 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [1,0,0,1,0,0|2,0,0]=4 4950 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,0,0,1,0,0|1,0,0]=3 4951 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [1,0,0,1,0,0|2,0,0]=4 4952 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,0,0,1,0,0|1,0,0]=3 4953 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [1,0,0,1,0,0|0,0,0]=2 4954 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,0,0,1,0,0|1,0,1]=4 4955 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,0,0,1,0,0|2,0,0]=4 4956 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,0,0,1,0,0|1,0,1]=4 4957 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,0,0,1,0,0|1,0,1]=4 4958 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,0,0,1,0,0|1,0,1]=4 4959 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,0,0,1,0,0|2,0,0]=4 4960 B11R2.190 CSc1ccc2c(c1)CC2 62a_100009818592_200000210301 [1,0,0,1,0,0|1,1,0]=4 4961 B11R2.190 CSc1ccc2c(c1)CC2 62a_200000210301_100009818592 [1,0,0,1,0,0|1,1,0]=4 4962 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_100009818592_200025704644 [1,0,0,1,0,0|1,1,0]=4 4963 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_200025704644_100009818592 [1,0,0,1,0,0|1,1,0]=4 4964 B13R2.623 CNc1cc(cc2c1OCC2)F 2230a_200009983616_200000210301 [0,1,0,1,0,0|2,0,0]=4 4965 B13R2.623 CNc1cc(cc2c1OCC2)F 34a_200009983616_200000210301 [0,1,0,1,0,0|2,0,0]=4 4966 B13R2.623 [13CH3]Nc1cc(cc2c1OCC2)F 2230a_200009983616_200025704644 [0,1,0,1,0,0|2,0,0]=4 4967 B13R2.623 [13CH3]Nc1cc(cc2c1OCC2)F 34a_200009983616_200025704644 [0,1,0,1,0,0|2,0,0]=4 4968 B13R2.82 CCc1cccc(c1O)C2CC2 271570a_100011220607_200010001580 [0,1,0,1,0,0|2,0,0]=4 4969 B13R2.82 COc1cccc(c1C)C2CC2 271570a_100011220607_100010002647 [0,1,0,1,0,0|2,0,0]=4 4970 B13R2.82 COc1cccc(c1Cl)C2CC2 271570a_100011220607_100010147677 [0,1,0,1,0,0|2,0,0]=4 4971 B13R2.82 COc1cccc(c1F)C2CC2 271570a_100011220607_100010185846 [0,1,0,1,0,0|2,0,0]=4 4972 B13R2.82 COc1cccc(c1F)C2CC2 34a_100102445790_200000210301 [0,1,0,1,0,0|2,0,0]=4 4973 B13R2.82 COc1cccc(c1F)C2CC2 7a_100102445790_200000210301 [0,1,0,1,0,0|2,0,0]=4 4974 B13R2.82 COc1cccc(c1N)C2CC2 271570a_100011220607_100000708083 [0,1,0,1,0,0|2,0,0]=4 4975 B13R2.82 COc1cccc(c1O)C2CC2 271570a_100011220607_100000686866 [0,1,0,1,0,0|1,0,0]=3 4976 B13R2.82 CSc1cccc(c1O)C2CC2 62a_100010664954_200000210301 [0,1,0,1,0,0|1,1,0]=4 4977 B13R2.82 CSc1cccc(c1O)C2CC2 62a_200000210301_100010664954 [0,1,0,1,0,0|1,1,0]=4 4978 B13R2.82 [13CH3]Oc1cccc(c1F)C2CC2 34a_100102445790_200025704644 [0,1,0,1,0,0|2,0,0]=4 4979 B13R2.82 [13CH3]Oc1cccc(c1F)C2CC2 7a_100102445790_200025704644 [0,1,0,1,0,0|2,0,0]=4 4980 B13R2.82 [13CH3]Sc1cccc(c1O)C2CC2 62a_100010664954_200025704644 [0,1,0,1,0,0|1,1,0]=4 4981 B13R2.82 [13CH3]Sc1cccc(c1O)C2CC2 62a_200025704644_100010664954 [0,1,0,1,0,0|1,1,0]=4 4982 B13R2.84 COc1ccc2[nH]ccc2c1O 271570a_203496583355_100010169049 [0,1,0,1,0,0|1,0,1]=4 4983 B13R2.84 COc1ccc2[nH]ncc2c1O 271570a_203496583355_100010125576 [0,1,0,1,0,0|2,0,0]=4 4984 B13R2.84 CSc1ccc2c(c1C)OCO2 62a_100010335860_200000210301 [0,1,0,1,0,0|1,1,0]=4 4985 B13R2.84 CSc1ccc2c(c1F)OCO2 62a_100010223184_200000210301 [0,1,0,1,0,0|1,1,0]=4 4986 B13R2.84 CSc1ccc2c(c1O)CCC2 62a_100010662108_200000210301 [0,1,0,1,0,0|1,1,0]=4 4987 B13R2.84 CSc1ccc2c(c1O)CCC2 62a_200000210301_100010662108 [0,1,0,1,0,0|1,1,0]=4 4988 B13R2.84 Cc1c(ccc2c1OCO2)S[13CH3] 62a_100010335860_200025704644 [0,1,0,1,0,0|1,1,0]=4 4989 B13R2.84 [13CH3]Sc1ccc2c(c1F)OCO2 62a_100010223184_200025704644 [0,1,0,1,0,0|1,1,0]=4 4990 B13R2.84 [13CH3]Sc1ccc2c(c1O)CCC2 62a_100010662108_200025704644 [0,1,0,1,0,0|1,1,0]=4 4991 B13R2.84 [13CH3]Sc1ccc2c(c1O)CCC2 62a_200025704644_100010662108 [0,1,0,1,0,0|1,1,0]=4 4992 B13R2.292 C=C=Cc1cccc2c1OCO2 271570a_100015277604_100009814252 [0,1,0,1,0,0|1,0,1]=4 4993 B13R2.292 CC=Cc1cccc2c1CCO2 271570a_100016259895_100009819624 [0,1,0,1,0,0|2,0,0]=4 4994 B13R2.292 CC=Cc1cccc2c1OCC2 271570a_100016259895_100009818991 [0,1,0,1,0,0|2,0,0]=4 4995 B13R2.292 CC=Cc1cccc2c1OCO2 271570a_100016259895_100009814252 [0,1,0,1,0,0|1,0,0]=3 4996 B13R2.292 CCNc1cccc2c1CCO2 2230a_100000084147_100000210202 [0,1,0,1,0,0|2,0,0]=4 4997 B13R2.292 CCNc1cccc2c1CCO2 34a_100000084147_100000210202 [0,1,0,1,0,0|2,0,0]=4 4998 B13R2.292 CCNc1cccc2c1OCC2 2230a_100000102157_100000210202 [0,1,0,1,0,0|2,0,0]=4 4999 B13R2.292 CCNc1cccc2c1OCC2 34a_100000102157_100000210202 [0,1,0,1,0,0|2,0,0]=4 5000 B13R2.292 CCNc1cccc2c1OCO2 2230a_100000699912_100000210202 [0,1,0,1,0,0|1,0,0]=3 5001 B13R2.292 CCNc1cccc2c1OCO2 34a_100000699912_100000210202 [0,1,0,1,0,0|1,0,0]=3 5002 B13R2.292 CCOc1cccc2c1CCC2 34a_100000074356_100000210202 [0,1,0,1,0,0|2,0,0]=4 5003 B13R2.292 CCOc1cccc2c1CCC2 7a_100000074356_100000210202 [0,1,0,1,0,0|2,0,0]=4 5004 B13R2.292 CCOc1cccc2c1CCN2 34a_100000703684_100000210202 [0,1,0,1,0,0|2,0,0]=4 5005 B13R2.292 CCOc1cccc2c1CCO2 34a_100000090053_100000210202 [0,1,0,1,0,0|1,0,0]=3 5006 B13R2.292 CCOc1cccc2c1CCO2 7a_100000090053_100000210202 [0,1,0,1,0,0|1,0,0]=3 5007 B13R2.292 CCOc1cccc2c1OCO2 34a_100000046630_100000210202 [0,1,0,1,0,0|0,0,0]=2 5008 B13R2.292 CCOc1cccc2c1OCO2 7a_100000046630_100000210202 [0,1,0,1,0,0|0,0,0]=2 5009 B13R2.292 CCSc1cccc2c1CCO2 62a_100000210202_100009819624 [0,1,0,1,0,0|1,1,0]=4 5010 B13R2.292 CCSc1cccc2c1CCO2 62a_100009819624_100000210202 [0,1,0,1,0,0|1,1,0]=4 5011 B13R2.292 CCSc1cccc2c1OCC2 62a_100000210202_100009818991 [0,1,0,1,0,0|1,1,0]=4 5012 B13R2.292 CCSc1cccc2c1OCC2 62a_100009818991_100000210202 [0,1,0,1,0,0|1,1,0]=4 5013 B13R2.292 CNCc1cccc2c1CCO2 207a_100102657272_100000045544 [0,1,0,1,0,0|2,0,0]=4 5014 B13R2.292 CNCc1cccc2c1CCO2 26a_100102657272_100000090053 [0,1,0,1,0,0|2,0,0]=4 5015 B13R2.292 CNCc1cccc2c1CCO2 270004a_106832991635_100000045544 [0,1,0,1,0,0|2,0,0]=4 5016 B13R2.292 CNCc1cccc2c1OCC2 207a_100102657272_100011934426 [0,1,0,1,0,0|2,0,0]=4 5017 B13R2.292 CNCc1cccc2c1OCC2 2230a_200000703977_200000210301 [0,1,0,1,0,0|2,0,0]=4 5018 B13R2.292 CNCc1cccc2c1OCC2 270004a_106832991635_100011934426 [0,1,0,1,0,0|2,0,0]=4 5019 B13R2.292 CNCc1cccc2c1OCC2 34a_200000703977_200000210301 [0,1,0,1,0,0|2,0,0]=4 5020 B13R2.292 CNCc1cccc2c1OCO2 207a_100102657272_100000028116 [0,1,0,1,0,0|1,0,0]=3 5021 B13R2.292 CNCc1cccc2c1OCO2 2230a_100000743722_200000210301 [0,1,0,1,0,0|1,0,0]=3 5022 B13R2.292 CNCc1cccc2c1OCO2 34a_100000743722_200000210301 [0,1,0,1,0,0|1,0,0]=3 5023 B13R2.292 CNCc1cccc2c1OCO2 7a_106832991635_100010369185 [0,1,0,1,0,0|1,0,0]=3 5024 B13R2.292 COCc1cccc2c1OCC2 34a_100011934603_200000210301 [0,1,0,1,0,0|1,0,0]=3 5025 B13R2.292 COCc1cccc2c1OCC2 7a_100011934603_200000210301 [0,1,0,1,0,0|1,0,0]=3 5026 B13R2.292 COCc1cccc2c1OCO2 34a_100011219355_200000210301 [0,1,0,1,0,0|0,0,0]=2 5027 B13R2.292 CSCc1cccc2c1OCO2 62a_100010369185_200000210301 [0,1,0,1,0,0|0,1,0]=3 5028 B13R2.292 FCNc1cccc2c1CCO2 34a_100000084147_100015361967 [0,1,0,1,0,0|2,0,0]=4 5029 B13R2.292 FCNc1cccc2c1OCC2 34a_100000102157_100015361967 [0,1,0,1,0,0|2,0,0]=4 5030 B13R2.292 FCNc1cccc2c1OCO2 34a_100000699912_100015361967 [0,1,0,1,0,0|1,0,0]=3 5031 B13R2.292 FCOc1cccc2c1CCC2 34a_100000074356_100015361967 [0,1,0,1,0,0|2,0,0]=4 5032 B13R2.292 FCOc1cccc2c1CCC2 7a_100000074356_100015361967 [0,1,0,1,0,0|2,0,0]=4 5033 B13R2.292 FCOc1cccc2c1CCN2 34a_100000703684_100015361967 [0,1,0,1,0,0|2,0,0]=4 5034 B13R2.292 FCOc1cccc2c1CCO2 34a_100000090053_100015361967 [0,1,0,1,0,0|1,0,0]=3 5035 B13R2.292 FCOc1cccc2c1CCO2 7a_100000090053_100015361967 [0,1,0,1,0,0|1,0,0]=3 5036 B13R2.292 FCOc1cccc2c1OCO2 34a_100000046630_100015361967 [0,1,0,1,0,0|0,0,0]=2 5037 B13R2.292 FCOc1cccc2c1OCO2 7a_100000046630_100015361967 [0,1,0,1,0,0|0,0,0]=2 5038 B13R2.292 FCSc1cccc2c1CCO2 62a_100009819624_100015361967 [0,1,0,1,0,0|1,1,0]=4 5039 B13R2.292 FCSc1cccc2c1CCO2 62a_100015361967_100009819624 [0,1,0,1,0,0|1,1,0]=4 5040 B13R2.292 FCSc1cccc2c1OCC2 62a_100009818991_100015361967 [0,1,0,1,0,0|1,1,0]=4 5041 B13R2.292 FCSc1cccc2c1OCC2 62a_100015361967_100009818991 [0,1,0,1,0,0|1,1,0]=4 5042 B13R2.292 [13CH3]NCc1cccc2c1OCC2 2230a_200000703977_200025704644 [0,1,0,1,0,0|2,0,0]=4 5043 B13R2.292 [13CH3]NCc1cccc2c1OCC2 34a_200000703977_200025704644 [0,1,0,1,0,0|2,0,0]=4 5044 B13R2.292 [13CH3]NCc1cccc2c1OCO2 2230a_100000743722_200025704644 [0,1,0,1,0,0|1,0,0]=3 5045 B13R2.292 [13CH3]NCc1cccc2c1OCO2 34a_100000743722_200025704644 [0,1,0,1,0,0|1,0,0]=3 5046 B13R2.292 [13CH3]OCc1cccc2c1OCC2 34a_100011934603_200025704644 [0,1,0,1,0,0|1,0,0]=3 5047 B13R2.292 [13CH3]OCc1cccc2c1OCC2 7a_100011934603_200025704644 [0,1,0,1,0,0|1,0,0]=3 5048 B13R2.292 [13CH3]OCc1cccc2c1OCO2 34a_100011219355_200025704644 [0,1,0,1,0,0|0,0,0]=2 5049 B13R2.292 [13CH3]SCc1cccc2c1OCO2 62a_100010369185_200025704644 [0,1,0,1,0,0|0,1,0]=3 5050 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 2230a_100000124160_200025704644 [0,1,0,1,0,0|2,0,0]=4 5051 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 34a_100000124160_200025704644 [0,1,0,1,0,0|2,0,0]=4 5052 B13R2.581 CNc1cccc2c1OC(C2)C 2230a_100000124160_200000210301 [0,1,0,1,0,0|2,0,0]=4 5053 B13R2.581 CNc1cccc2c1OC(C2)C 34a_100000124160_200000210301 [0,1,0,1,0,0|2,0,0]=4 5054 B13R2.581 CNc1cccc2c1nc(o2)C 34a_100011934982_200000210301 [0,1,0,1,0,0|2,0,0]=4 5055 B13R2.581 CNc1cccc2c1oc(c2)C 34a_200015185323_200000210301 [0,1,0,1,0,0|2,0,0]=4 5056 B13R2.581 COc1cccc2c1CN(C2)C 2230a_100016991506_200000210301 [0,1,0,1,0,0|2,0,0]=4 5057 B13R2.581 COc1cccc2c1CN(C2)C 269982a_100016991506_200000210301 [0,1,0,1,0,0|2,0,0]=4 5058 B13R2.581 COc1cccc2c1CN(C2)C 34a_100016991506_200000210301 [0,1,0,1,0,0|2,0,0]=4 5059 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 2230a_100016991506_200025704644 [0,1,0,1,0,0|2,0,0]=4 5060 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 269982a_100016991506_200025704644 [0,1,0,1,0,0|2,0,0]=4 5061 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 34a_100016991506_200025704644 [0,1,0,1,0,0|2,0,0]=4 5062 B13R2.581 COc1cccc2c1cc([nH]2)C 34a_200000059750_200000210301 [0,1,0,1,0,0|2,0,0]=4 5063 B13R2.581 COc1cccc2c1cn(n2)C 34a_100000106842_200000210301 [0,1,0,1,0,0|2,0,0]=4 5064 B13R2.581 COc1cccc2c1nc(o2)N 7a_100009892541_200000210301 [0,1,0,1,0,0|1,0,1]=4 5065 B13R2.581 CSc1cccc2c1nc(o2)C 62a_200000210301_100010883239 [0,1,0,1,0,0|1,1,0]=4 5066 B13R2.581 CSc1cccc2c1oc(n2)C 62a_200000210301_100010168998 [0,1,0,1,0,0|1,1,0]=4 5067 B13R2.581 Cc1cc2c(cccc2[nH]1)O[13CH3] 34a_200000059750_200025704644 [0,1,0,1,0,0|2,0,0]=4 5068 B13R2.581 Cc1cc2cccc(c2o1)N[13CH3] 34a_200015185323_200025704644 [0,1,0,1,0,0|2,0,0]=4 5069 B13R2.581 Cc1nc2c(cccc2o1)N[13CH3] 34a_100011934982_200025704644 [0,1,0,1,0,0|2,0,0]=4 5070 B13R2.581 Cc1nc2c(cccc2o1)S[13CH3] 62a_200025704644_100010883239 [0,1,0,1,0,0|1,1,0]=4 5071 B13R2.581 Cc1nc2cccc(c2o1)S[13CH3] 62a_200025704644_100010168998 [0,1,0,1,0,0|1,1,0]=4 5072 B13R2.581 Cn1cc2c(cccc2n1)O[13CH3] 34a_100000106842_200025704644 [0,1,0,1,0,0|2,0,0]=4 5073 B13R2.581 [13CH3]Oc1cccc2c1nc(o2)N 7a_100009892541_200025704644 [0,1,0,1,0,0|1,0,1]=4 5074 B13R2.1613 C=Cc1cccc2c1OCCO2 271570a_100011290941_100009815980 [0,1,0,1,0,0|1,0,1]=4 5075 B13R2.1613 CNc1cccc2c1OCCO2 34a_100000694162_200000210301 [0,1,0,1,0,0|1,0,0]=3 5076 B13R2.1613 COc1cccc2c1CCCC2 34a_100011202923_200000210301 [0,1,0,1,0,0|2,0,0]=4 5077 B13R2.1613 COc1cccc2c1CCCC2 7a_100011202923_200000210301 [0,1,0,1,0,0|2,0,0]=4 5078 B13R2.1613 COc1cccc2c1CCNC2 34a_100020635587_200000210301 [0,1,0,1,0,0|2,0,0]=4 5079 B13R2.1613 COc1cccc2c1CNCC2 34a_100016995156_200000210301 [0,1,0,1,0,0|2,0,0]=4 5080 B13R2.1613 COc1cccc2c1OCCO2 34a_100000045995_200000210301 [0,1,0,1,0,0|0,0,0]=2 5081 B13R2.1613 COc1cccc2c1OCCO2 7a_100000045995_200000210301 [0,1,0,1,0,0|0,0,0]=2 5082 B13R2.1613 CSc1cccc2c1CCCO2 62a_100010188023_200000210301 [0,1,0,1,0,0|1,1,0]=4 5083 B13R2.1613 CSc1cccc2c1CCCO2 62a_200000210301_100010188023 [0,1,0,1,0,0|1,1,0]=4 5084 B13R2.1613 CSc1cccc2c1NCCO2 62a_200000210301_100015018771 [0,1,0,1,0,0|1,1,0]=4 5085 B13R2.1613 CSc1cccc2c1OCCC2 62a_100010204675_200000210301 [0,1,0,1,0,0|1,1,0]=4 5086 B13R2.1613 CSc1cccc2c1OCCC2 62a_200000210301_100010204675 [0,1,0,1,0,0|1,1,0]=4 5087 B13R2.1613 CSc1cccc2c1OCCN2 62a_100000726803_200000210301 [0,1,0,1,0,0|1,1,0]=4 5088 B13R2.1613 CSc1cccc2c1OCCN2 62a_200000210301_100000726803 [0,1,0,1,0,0|1,1,0]=4 5089 B13R2.1613 CSc1cccc2c1OCCO2 62a_100009815980_200000210301 [0,1,0,1,0,0|0,1,0]=3 5090 B13R2.1613 CSc1cccc2c1OCCO2 62a_200000210301_100009815980 [0,1,0,1,0,0|0,1,0]=3 5091 B13R2.1613 [13CH3]Nc1cccc2c1OCCO2 34a_100000694162_200025704644 [0,1,0,1,0,0|1,0,0]=3 5092 B13R2.1613 [13CH3]Oc1cccc2c1CCCC2 34a_100011202923_200025704644 [0,1,0,1,0,0|2,0,0]=4 5093 B13R2.1613 [13CH3]Oc1cccc2c1CCCC2 7a_100011202923_200025704644 [0,1,0,1,0,0|2,0,0]=4 5094 B13R2.1613 [13CH3]Oc1cccc2c1CCNC2 34a_100020635587_200025704644 [0,1,0,1,0,0|2,0,0]=4 5095 B13R2.1613 [13CH3]Oc1cccc2c1CNCC2 34a_100016995156_200025704644 [0,1,0,1,0,0|2,0,0]=4 5096 B13R2.1613 [13CH3]Oc1cccc2c1OCCO2 34a_100000045995_200025704644 [0,1,0,1,0,0|0,0,0]=2 5097 B13R2.1613 [13CH3]Oc1cccc2c1OCCO2 7a_100000045995_200025704644 [0,1,0,1,0,0|0,0,0]=2 5098 B13R2.1613 [13CH3]Sc1cccc2c1CCCO2 62a_100010188023_200025704644 [0,1,0,1,0,0|1,1,0]=4 5099 B13R2.1613 [13CH3]Sc1cccc2c1CCCO2 62a_200025704644_100010188023 [0,1,0,1,0,0|1,1,0]=4 5100 B13R2.1613 [13CH3]Sc1cccc2c1NCCO2 62a_200025704644_100015018771 [0,1,0,1,0,0|1,1,0]=4 5101 B13R2.1613 [13CH3]Sc1cccc2c1OCCC2 62a_100010204675_200025704644 [0,1,0,1,0,0|1,1,0]=4 5102 B13R2.1613 [13CH3]Sc1cccc2c1OCCC2 62a_200025704644_100010204675 [0,1,0,1,0,0|1,1,0]=4 5103 B13R2.1613 [13CH3]Sc1cccc2c1OCCN2 62a_100000726803_200025704644 [0,1,0,1,0,0|1,1,0]=4 5104 B13R2.1613 [13CH3]Sc1cccc2c1OCCN2 62a_200025704644_100000726803 [0,1,0,1,0,0|1,1,0]=4 5105 B13R2.1613 [13CH3]Sc1cccc2c1OCCO2 62a_100009815980_200025704644 [0,1,0,1,0,0|0,1,0]=3 5106 B13R2.1613 [13CH3]Sc1cccc2c1OCCO2 62a_200025704644_100009815980 [0,1,0,1,0,0|0,1,0]=3 5107 B13R2.573 COc1cccc2c1CCC2=O 34a_100000240044_200000210301 [0,1,0,1,0,0|2,0,0]=4 5108 B13R2.573 COc1cccc2c1CCC2=O 7a_100000240044_200000210301 [0,1,0,1,0,0|2,0,0]=4 5109 B13R2.573 COc1cccc2c1CC[C@@H]2N 34a_100134616730_200000210301 [0,1,0,1,0,0|2,0,0]=4 5110 B13R2.573 COc1cccc2c1ccn2C 34a_100000094269_200000210301 [0,1,0,1,0,0|2,0,0]=4 5111 B13R2.573 COc1cccc2c1cnn2C 34a_100009856027_200000210301 [0,1,0,1,0,0|2,0,0]=4 5112 B13R2.573 CSc1cccc2c1OCC2=O 62a_200000210301_100011230590 [0,1,0,1,0,0|1,1,0]=4 5113 B13R2.573 CSc1cccc2c1OCC2N 62a_100025715106_200000210301 [0,1,0,1,0,0|1,1,0]=4 5114 B13R2.573 CSc1cccc2c1OCC2N 62a_200000210301_100025715106 [0,1,0,1,0,0|1,1,0]=4 5115 B13R2.573 Cn1ccc2c1cccc2O[13CH3] 34a_100000094269_200025704644 [0,1,0,1,0,0|2,0,0]=4 5116 B13R2.573 Cn1ncc2c1cccc2O[13CH3] 34a_100009856027_200025704644 [0,1,0,1,0,0|2,0,0]=4 5117 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 34a_100000240044_200025704644 [0,1,0,1,0,0|2,0,0]=4 5118 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 7a_100000240044_200025704644 [0,1,0,1,0,0|2,0,0]=4 5119 B13R2.573 [13CH3]Oc1cccc2c1CC[C@@H]2N 34a_100134616730_200025704644 [0,1,0,1,0,0|2,0,0]=4 5120 B13R2.573 [13CH3]Sc1cccc2c1OCC2=O 62a_200025704644_100011230590 [0,1,0,1,0,0|1,1,0]=4 5121 B13R2.573 [13CH3]Sc1cccc2c1OCC2N 62a_100025715106_200025704644 [0,1,0,1,0,0|1,1,0]=4 5122 B13R2.573 [13CH3]Sc1cccc2c1OCC2N 62a_200025704644_100025715106 [0,1,0,1,0,0|1,1,0]=4 5123 B13R2.5569 C=C(C)c1cccc2c1CCO2 271570a_100000694244_100009819624 [0,1,0,1,0,0|2,0,0]=4 5124 B13R2.5569 C=C(C)c1cccc2c1OCC2 271570a_100000694244_100009818991 [0,1,0,1,0,0|2,0,0]=4 5125 B13R2.5569 C=C(C)c1cccc2c1OCO2 271570a_100000694244_100009814252 [0,1,0,1,0,0|1,0,0]=3 5126 B13R2.5569 CC(=O)c1cccc2c1OCC2 1458a_100011216994_200000210301 [0,1,0,1,0,0|2,0,0]=4 5127 B13R2.5569 CC(=O)c1cccc2c1OCO2 1458a_100000048783_200000210301 [0,1,0,1,0,0|1,0,0]=3 5128 B13R2.5569 [13CH3]C(=O)c1cccc2c1OCC2 1458a_100011216994_200025704644 [0,1,0,1,0,0|2,0,0]=4 5129 B13R2.5569 [13CH3]C(=O)c1cccc2c1OCO2 1458a_100000048783_200025704644 [0,1,0,1,0,0|1,0,0]=3 5130 B13R2.121 CNc1c(ccc2c1OCO2)Cl 34a_100000087791_200000210301 [0,1,0,1,0,0|1,0,0]=3 5131 B13R2.121 CNc1c(ccc2c1OCO2)F 34a_100000091648_200000210301 [0,1,0,1,0,0|1,0,0]=3 5132 B13R2.121 COc1c(ccc2c1CCC2)Br 34a_100010662108_200000210301 [0,1,0,1,0,0|2,0,0]=4 5133 B13R2.121 COc1c(ccc2c1CCC2)Br 7a_100010662108_200000210301 [0,1,0,1,0,0|2,0,0]=4 5134 B13R2.121 O=Cc1c(ccc2c1OCO2)O 271570a_203496583355_100009816621 [0,1,0,1,0,0|2,0,0]=4 5135 B13R2.121 [13CH3]Nc1c(ccc2c1OCO2)Cl 34a_100000087791_200025704644 [0,1,0,1,0,0|1,0,0]=3 5136 B13R2.121 [13CH3]Nc1c(ccc2c1OCO2)F 34a_100000091648_200025704644 [0,1,0,1,0,0|1,0,0]=3 5137 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 34a_100010662108_200025704644 [0,1,0,1,0,0|2,0,0]=4 5138 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 7a_100010662108_200025704644 [0,1,0,1,0,0|2,0,0]=4 5139 B13R2.611 COc1ccc(c2c1CCC2)C 34a_100000035953_200000210301 [0,1,0,1,0,0|2,0,0]=4 5140 B13R2.611 COc1ccc(c2c1CCC2)C 7a_100000035953_200000210301 [0,1,0,1,0,0|2,0,0]=4 5141 B13R2.611 COc1ccc(c2c1CCC2)Cl 34a_100000073669_200000210301 [0,1,0,1,0,0|2,0,0]=4 5142 B13R2.611 COc1ccc(c2c1CCC2)Cl 7a_100000073669_200000210301 [0,1,0,1,0,0|2,0,0]=4 5143 B13R2.611 COc1ccc(c2c1occ2)Br 34a_200020711608_200000210301 [0,1,0,1,0,0|1,0,1]=4 5144 B13R2.611 COc1ccc(c2c1occ2)Br 7a_200020711608_200000210301 [0,1,0,1,0,0|1,0,1]=4 5145 B13R2.611 Cc1ccc(c2c1CCC2)O[13CH3] 34a_100000035953_200025704644 [0,1,0,1,0,0|2,0,0]=4 5146 B13R2.611 Cc1ccc(c2c1CCC2)O[13CH3] 7a_100000035953_200025704644 [0,1,0,1,0,0|2,0,0]=4 5147 B13R2.611 [13CH3]Oc1ccc(c2c1CCC2)Cl 34a_100000073669_200025704644 [0,1,0,1,0,0|2,0,0]=4 5148 B13R2.611 [13CH3]Oc1ccc(c2c1CCC2)Cl 7a_100000073669_200025704644 [0,1,0,1,0,0|2,0,0]=4 5149 B13R2.611 [13CH3]Oc1ccc(c2c1occ2)Br 34a_200020711608_200025704644 [0,1,0,1,0,0|1,0,1]=4 5150 B13R2.611 [13CH3]Oc1ccc(c2c1occ2)Br 7a_200020711608_200025704644 [0,1,0,1,0,0|1,0,1]=4 5151 B13R2.582 COc1cccc2c1C(=O)CC2 34a_100000066596_200000210301 [0,1,0,1,0,0|1,0,1]=4 5152 B13R2.582 COc1cccc2c1C(=O)CC2 7a_100000066596_200000210301 [0,1,0,1,0,0|1,0,1]=4 5153 B13R2.582 COc1cccc2c1C(=O)CO2 34a_200009856558_200000210301 [0,1,0,1,0,0|0,0,1]=3 5154 B13R2.582 COc1cccc2c1c(n[nH]2)O 271570a_203496583355_100010231497 [0,1,0,1,0,0|2,0,0]=4 5155 B13R2.582 CSc1cccc2c1C(=O)CO2 62a_200000210301_100010205902 [0,1,0,1,0,0|0,1,1]=4 5156 B13R2.582 CSc1cccc2c1C(CS2)O 62a_200000210301_200010991195 [0,1,0,1,0,0|0,2,0]=4 5157 B13R2.582 CSc1cccc2c1C(CS2)O 62a_200010991195_200000210301 [0,1,0,1,0,0|0,2,0]=4 5158 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 34a_100000066596_200025704644 [0,1,0,1,0,0|1,0,1]=4 5159 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 7a_100000066596_200025704644 [0,1,0,1,0,0|1,0,1]=4 5160 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CO2 34a_200009856558_200025704644 [0,1,0,1,0,0|0,0,1]=3 5161 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CO2 62a_200025704644_100010205902 [0,1,0,1,0,0|0,1,1]=4 5162 B13R2.582 [13CH3]Sc1cccc2c1C(CS2)O 62a_200010991195_200025704644 [0,1,0,1,0,0|0,2,0]=4 5163 B13R2.582 [13CH3]Sc1cccc2c1C(CS2)O 62a_200025704644_200010991195 [0,1,0,1,0,0|0,2,0]=4 5164 B11R1.279 C=Cc1ccc(c(c1)O)OC 271570a_100011290941_100009816560 [0,0,0,0,1,1|1,0,1]=4 5165 B11R1.279 C=Cc1ccc(cc1O)OC 271570a_100011290941_100000719091 [0,0,0,0,1,1|1,0,1]=4 5166 B11R1.279 CCc1ccc(c(c1)Br)OC 34a_100012339963_200000210301 [0,0,0,0,1,1|2,0,0]=4 5167 B11R1.279 CCc1ccc(c(c1)Br)OC 7a_100012339963_200000210301 [0,0,0,0,1,1|2,0,0]=4 5168 B11R1.279 CCc1ccc(c(c1)Br)O[13CH3] 34a_100012339963_200025704644 [0,0,0,0,1,1|2,0,0]=4 5169 B11R1.279 CCc1ccc(c(c1)Br)O[13CH3] 7a_100012339963_200025704644 [0,0,0,0,1,1|2,0,0]=4 5170 B11R1.279 CCc1ccc(c(c1)N)OC 34a_100000765835_200000210301 [0,0,0,0,1,1|2,0,0]=4 5171 B11R1.279 CCc1ccc(c(c1)N)OC 7a_100000765835_200000210301 [0,0,0,0,1,1|2,0,0]=4 5172 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 34a_100000765835_200025704644 [0,0,0,0,1,1|2,0,0]=4 5173 B11R1.279 CCc1ccc(c(c1)N)O[13CH3] 7a_100000765835_200025704644 [0,0,0,0,1,1|2,0,0]=4 5174 B11R1.279 CCc1ccc(c(c1)O)NC 34a_100000124328_200000210301 [0,0,0,0,1,1|2,0,0]=4 5175 B11R1.279 CCc1ccc(c(c1)O)N[13CH3] 34a_100000124328_200025704644 [0,0,0,0,1,1|2,0,0]=4 5176 B11R1.279 CCc1ccc(c(c1)O)OC 271570a_203496583355_100010062400 [0,0,0,0,1,1|1,0,0]=3 5177 B11R1.279 CCc1ccc(cc1Cl)OC 34a_100009886192_200000210301 [0,0,0,0,1,1|2,0,0]=4 5178 B11R1.279 CCc1ccc(cc1Cl)OC 7a_100009886192_200000210301 [0,0,0,0,1,1|2,0,0]=4 5179 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 34a_100009886192_200025704644 [0,0,0,0,1,1|2,0,0]=4 5180 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 7a_100009886192_200025704644 [0,0,0,0,1,1|2,0,0]=4 5181 B11R1.279 CNc1ccc(c(c1)Br)OC 34a_100000187427_200000210301 [0,0,0,0,1,1|2,0,0]=4 5182 B11R1.279 CNc1ccc(c(c1)C)OC 2230a_100000743268_200000210301 [0,0,0,0,1,1|2,0,0]=4 5183 B11R1.279 CNc1ccc(c(c1)C)OC 34a_100000743268_200000210301 [0,0,0,0,1,1|2,0,0]=4 5184 B11R1.279 CNc1ccc(c(c1)C)OC 7a_100000743268_200000210301 [0,0,0,0,1,1|2,0,0]=4 5185 B11R1.279 CNc1ccc(c(c1)Cl)OC 2230a_100000211044_200000210301 [0,0,0,0,1,1|2,0,0]=4 5186 B11R1.279 CNc1ccc(c(c1)Cl)OC 34a_100000211044_200000210301 [0,0,0,0,1,1|2,0,0]=4 5187 B11R1.279 CNc1ccc(c(c1)F)OC 2230a_100000740183_200000210301 [0,0,0,0,1,1|2,0,0]=4 5188 B11R1.279 CNc1ccc(c(c1)F)OC 34a_100000740183_200000210301 [0,0,0,0,1,1|2,0,0]=4 5189 B11R1.279 CNc1ccc(c(c1)I)OC 34a_100011356947_200000210301 [0,0,0,0,1,1|2,0,0]=4 5190 B11R1.279 CNc1ccc(c(c1)O)OC 271570a_203496583355_114948341033 [0,0,0,0,1,1|1,0,0]=3 5191 B11R1.279 CNc1ccc(c(c1)O)OC 34a_100000211920_200000210301 [0,0,0,0,1,1|1,0,0]=3 5192 B11R1.279 CNc1ccc(c(n1)F)OC 27a_100102657272_100010138636 [0,0,0,0,1,1|2,0,0]=4 5193 B11R1.279 CNc1ccc(cc1Br)OC 34a_100015195136_200000210301 [0,0,0,0,1,1|2,0,0]=4 5194 B11R1.279 CNc1ccc(cc1C)OC 34a_100000750285_200000210301 [0,0,0,0,1,1|2,0,0]=4 5195 B11R1.279 CNc1ccc(cc1C)OC 34a_100161107805_200000210301 [0,0,0,0,1,1|2,0,0]=4 5196 B11R1.279 CNc1ccc(cc1C)OC 7a_100161107805_200000210301 [0,0,0,0,1,1|2,0,0]=4 5197 B11R1.279 CNc1ccc(cc1C)O[13CH3] 34a_100161107805_200025704644 [0,0,0,0,1,1|2,0,0]=4 5198 B11R1.279 CNc1ccc(cc1C)O[13CH3] 7a_100161107805_200025704644 [0,0,0,0,1,1|2,0,0]=4 5199 B11R1.279 CNc1ccc(cc1Cl)OC 34a_100000747055_200000210301 [0,0,0,0,1,1|2,0,0]=4 5200 B11R1.279 CNc1ccc(cc1F)OC 34a_100011299463_200000210301 [0,0,0,0,1,1|2,0,0]=4 5201 B11R1.279 CNc1ccc(cc1I)OC 34a_100000049804_200000210301 [0,0,0,0,1,1|2,0,0]=4 5202 B11R1.279 CNc1ccc(cc1O)OC 34a_100016989039_200000210301 [0,0,0,0,1,1|1,0,0]=3 5203 B11R1.279 COc1cc(c(cn1)SC)O 62a_100010738159_200000210301 [0,0,0,0,1,1|1,1,0]=4 5204 B11R1.279 COc1cc(c(cn1)SC)O 62a_200000210301_100010738159 [0,0,0,0,1,1|1,1,0]=4 5205 B11R1.279 COc1cc(c(cn1)S[13CH3])O 62a_100010738159_200025704644 [0,0,0,0,1,1|1,1,0]=4 5206 B11R1.279 COc1cc(c(cn1)S[13CH3])O 62a_200025704644_100010738159 [0,0,0,0,1,1|1,1,0]=4 5207 B11R1.279 COc1ccc(c(c1)Br)N[13CH3] 34a_100015195136_200025704644 [0,0,0,0,1,1|2,0,0]=4 5208 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100000685887_200000210301 [0,0,0,0,1,1|1,0,0]=3 5209 B11R1.279 COc1ccc(c(c1)Br)OC 34a_100010234764_200000210301 [0,0,0,0,1,1|1,0,0]=3 5210 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100000685887_200000210301 [0,0,0,0,1,1|1,0,0]=3 5211 B11R1.279 COc1ccc(c(c1)Br)OC 7a_100010234764_200000210301 [0,0,0,0,1,1|1,0,0]=3 5212 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 34a_100000685887_200025704644 [0,0,0,0,1,1|1,0,0]=3 5213 B11R1.279 COc1ccc(c(c1)Br)O[13CH3] 7a_100000685887_200025704644 [0,0,0,0,1,1|1,0,0]=3 5214 B11R1.279 COc1ccc(c(c1)Br)SC 62a_100012349170_200000210301 [0,0,0,0,1,1|1,1,0]=4 5215 B11R1.279 COc1ccc(c(c1)Br)SC 62a_200000210301_100012349170 [0,0,0,0,1,1|1,1,0]=4 5216 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_100012349170_200025704644 [0,0,0,0,1,1|1,1,0]=4 5217 B11R1.279 COc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100012349170 [0,0,0,0,1,1|1,1,0]=4 5218 B11R1.279 COc1ccc(c(c1)C)N[13CH3] 34a_100000750285_200025704644 [0,0,0,0,1,1|2,0,0]=4 5219 B11R1.279 COc1ccc(c(c1)C)OC 34a_100000759738_200000210301 [0,0,0,0,1,1|1,0,0]=3 5220 B11R1.279 COc1ccc(c(c1)C)OC 34a_100012002223_200000210301 [0,0,0,0,1,1|1,0,0]=3 5221 B11R1.279 COc1ccc(c(c1)C)OC 7a_100000759738_200000210301 [0,0,0,0,1,1|1,0,0]=3 5222 B11R1.279 COc1ccc(c(c1)C)OC 7a_100012002223_200000210301 [0,0,0,0,1,1|1,0,0]=3 5223 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 34a_100012002223_200025704644 [0,0,0,0,1,1|1,0,0]=3 5224 B11R1.279 COc1ccc(c(c1)C)O[13CH3] 7a_100012002223_200025704644 [0,0,0,0,1,1|1,0,0]=3 5225 B11R1.279 COc1ccc(c(c1)C)SC 34a_100000030144_200000210301 [0,0,0,0,1,1|1,1,0]=4 5226 B11R1.279 COc1ccc(c(c1)C)SC 62a_100000759875_200000210301 [0,0,0,0,1,1|1,1,0]=4 5227 B11R1.279 COc1ccc(c(c1)C)SC 62a_200000210301_100000759875 [0,0,0,0,1,1|1,1,0]=4 5228 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_100000759875_200025704644 [0,0,0,0,1,1|1,1,0]=4 5229 B11R1.279 COc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000759875 [0,0,0,0,1,1|1,1,0]=4 5230 B11R1.279 COc1ccc(c(c1)Cl)N[13CH3] 34a_100000747055_200025704644 [0,0,0,0,1,1|2,0,0]=4 5231 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_100000038596_200000210301 [0,0,0,0,1,1|1,0,0]=3 5232 B11R1.279 COc1ccc(c(c1)Cl)OC 34a_200009861682_200000210301 [0,0,0,0,1,1|1,0,0]=3 5233 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_100000038596_200000210301 [0,0,0,0,1,1|1,0,0]=3 5234 B11R1.279 COc1ccc(c(c1)Cl)OC 7a_200009861682_200000210301 [0,0,0,0,1,1|1,0,0]=3 5235 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 34a_100000038596_200025704644 [0,0,0,0,1,1|1,0,0]=3 5236 B11R1.279 COc1ccc(c(c1)Cl)O[13CH3] 7a_100000038596_200025704644 [0,0,0,0,1,1|1,0,0]=3 5237 B11R1.279 COc1ccc(c(c1)F)N[13CH3] 34a_100011299463_200025704644 [0,0,0,0,1,1|2,0,0]=4 5238 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000036999_200000210301 [0,0,0,0,1,1|1,0,0]=3 5239 B11R1.279 COc1ccc(c(c1)F)OC 34a_100000746305_200000210301 [0,0,0,0,1,1|1,0,0]=3 5240 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000036999_200000210301 [0,0,0,0,1,1|1,0,0]=3 5241 B11R1.279 COc1ccc(c(c1)F)OC 7a_100000746305_200000210301 [0,0,0,0,1,1|1,0,0]=3 5242 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 34a_100000036999_200025704644 [0,0,0,0,1,1|1,0,0]=3 5243 B11R1.279 COc1ccc(c(c1)F)O[13CH3] 7a_100000036999_200025704644 [0,0,0,0,1,1|1,0,0]=3 5244 B11R1.279 COc1ccc(c(c1)F)SC 62a_100000753793_200000210301 [0,0,0,0,1,1|1,1,0]=4 5245 B11R1.279 COc1ccc(c(c1)F)SC 62a_200000210301_100000753793 [0,0,0,0,1,1|1,1,0]=4 5246 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_100000753793_200025704644 [0,0,0,0,1,1|1,1,0]=4 5247 B11R1.279 COc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000753793 [0,0,0,0,1,1|1,1,0]=4 5248 B11R1.279 COc1ccc(c(c1)I)N[13CH3] 34a_100000049804_200025704644 [0,0,0,0,1,1|2,0,0]=4 5249 B11R1.279 COc1ccc(c(c1)I)OC 34a_100010084122_200000210301 [0,0,0,0,1,1|1,0,0]=3 5250 B11R1.279 COc1ccc(c(c1)I)OC 7a_100010084122_200000210301 [0,0,0,0,1,1|1,0,0]=3 5251 B11R1.279 COc1ccc(c(c1)N)OC 34a_100000188146_200000210301 [0,0,0,0,1,1|1,0,0]=3 5252 B11R1.279 COc1ccc(c(c1)N)O[13CH3] 34a_100000188146_200025704644 [0,0,0,0,1,1|1,0,0]=3 5253 B11R1.279 COc1ccc(c(c1)N)SC 62a_100000748021_200000210301 [0,0,0,0,1,1|1,1,0]=4 5254 B11R1.279 COc1ccc(c(c1)N)SC 62a_200000210301_100000748021 [0,0,0,0,1,1|1,1,0]=4 5255 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_100000748021_200025704644 [0,0,0,0,1,1|1,1,0]=4 5256 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100000748021 [0,0,0,0,1,1|1,1,0]=4 5257 B11R1.279 COc1ccc(c(c1)O)C#N 271570a_203496583355_100012355471 [0,0,0,0,1,1|2,0,0]=4 5258 B11R1.279 COc1ccc(c(c1)O)C=O 271570a_203496583355_100000723261 [0,0,0,0,1,1|2,0,0]=4 5259 B11R1.279 COc1ccc(c(c1)O)CO 271570a_203496583355_100011982768 [0,0,0,0,1,1|2,0,0]=4 5260 B11R1.279 COc1ccc(c(c1)O)N[13CH3] 34a_100016989039_200025704644 [0,0,0,0,1,1|1,0,0]=3 5261 B11R1.279 COc1ccc(c(c1)O)OC 271570a_203496583355_100011215452 [0,0,0,0,1,1|0,0,0]=2 5262 B11R1.279 COc1ccc(c(c1)O)SC 62a_200000210301_100000719091 [0,0,0,0,1,1|0,1,0]=3 5263 B11R1.279 COc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100000719091 [0,0,0,0,1,1|0,1,0]=3 5264 B11R1.279 COc1ccc(c(n1)C)OC 34a_200009873766_200000210301 [0,0,0,0,1,1|1,0,0]=3 5265 B11R1.279 COc1ccc(c(n1)C)O[13CH3] 34a_200009873766_200025704644 [0,0,0,0,1,1|1,0,0]=3 5266 B11R1.279 COc1ccc(c(n1)C)SC 62a_100000766551_200000210301 [0,0,0,0,1,1|1,1,0]=4 5267 B11R1.279 COc1ccc(c(n1)C)SC 62a_200000210301_100000766551 [0,0,0,0,1,1|1,1,0]=4 5268 B11R1.279 COc1ccc(c(n1)C)S[13CH3] 62a_100000766551_200025704644 [0,0,0,0,1,1|1,1,0]=4 5269 B11R1.279 COc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100000766551 [0,0,0,0,1,1|1,1,0]=4 5270 B11R1.279 COc1ccc(c(n1)F)SC 62a_100010067559_200000210301 [0,0,0,0,1,1|1,1,0]=4 5271 B11R1.279 COc1ccc(c(n1)F)SC 62a_200000210301_100010067559 [0,0,0,0,1,1|1,1,0]=4 5272 B11R1.279 COc1ccc(c(n1)F)S[13CH3] 62a_100010067559_200025704644 [0,0,0,0,1,1|1,1,0]=4 5273 B11R1.279 COc1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010067559 [0,0,0,0,1,1|1,1,0]=4 5274 B11R1.279 COc1ccc(c(n1)N)SC 62a_100010187629_200000210301 [0,0,0,0,1,1|1,1,0]=4 5275 B11R1.279 COc1ccc(c(n1)N)S[13CH3] 62a_100010187629_200025704644 [0,0,0,0,1,1|1,1,0]=4 5276 B11R1.279 COc1ccc(c(n1)O)C=O 271570a_203496583355_100012351648 [0,0,0,0,1,1|2,0,0]=4 5277 B11R1.279 COc1ccc(c(n1)O)CO 271570a_203496583355_100009885603 [0,0,0,0,1,1|2,0,0]=4 5278 B11R1.279 COc1ccc(cc1Br)N[13CH3] 34a_100000187427_200025704644 [0,0,0,0,1,1|2,0,0]=4 5279 B11R1.279 COc1ccc(cc1Br)O[13CH3] 34a_100010234764_200025704644 [0,0,0,0,1,1|1,0,0]=3 5280 B11R1.279 COc1ccc(cc1Br)O[13CH3] 7a_100010234764_200025704644 [0,0,0,0,1,1|1,0,0]=3 5281 B11R1.279 COc1ccc(cc1Br)SC 62a_100011249507_200000210301 [0,0,0,0,1,1|1,1,0]=4 5282 B11R1.279 COc1ccc(cc1Br)SC 62a_200000210301_100011249507 [0,0,0,0,1,1|1,1,0]=4 5283 B11R1.279 COc1ccc(cc1Br)S[13CH3] 62a_100011249507_200025704644 [0,0,0,0,1,1|1,1,0]=4 5284 B11R1.279 COc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011249507 [0,0,0,0,1,1|1,1,0]=4 5285 B11R1.279 COc1ccc(cc1C)N[13CH3] 2230a_100000743268_200025704644 [0,0,0,0,1,1|2,0,0]=4 5286 B11R1.279 COc1ccc(cc1C)N[13CH3] 34a_100000743268_200025704644 [0,0,0,0,1,1|2,0,0]=4 5287 B11R1.279 COc1ccc(cc1C)N[13CH3] 7a_100000743268_200025704644 [0,0,0,0,1,1|2,0,0]=4 5288 B11R1.279 COc1ccc(cc1C)O[13CH3] 34a_100000759738_200025704644 [0,0,0,0,1,1|1,0,0]=3 5289 B11R1.279 COc1ccc(cc1C)O[13CH3] 7a_100000759738_200025704644 [0,0,0,0,1,1|1,0,0]=3 5290 B11R1.279 COc1ccc(cc1C)SC 62a_100011219705_200000210301 [0,0,0,0,1,1|1,1,0]=4 5291 B11R1.279 COc1ccc(cc1C)SC 62a_200000210301_100011219705 [0,0,0,0,1,1|1,1,0]=4 5292 B11R1.279 COc1ccc(cc1C)S[13CH3] 62a_100011219705_200025704644 [0,0,0,0,1,1|1,1,0]=4 5293 B11R1.279 COc1ccc(cc1C)S[13CH3] 62a_200025704644_100011219705 [0,0,0,0,1,1|1,1,0]=4 5294 B11R1.279 COc1ccc(cc1Cl)N[13CH3] 2230a_100000211044_200025704644 [0,0,0,0,1,1|2,0,0]=4 5295 B11R1.279 COc1ccc(cc1Cl)N[13CH3] 34a_100000211044_200025704644 [0,0,0,0,1,1|2,0,0]=4 5296 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 34a_200009861682_200025704644 [0,0,0,0,1,1|1,0,0]=3 5297 B11R1.279 COc1ccc(cc1Cl)O[13CH3] 7a_200009861682_200025704644 [0,0,0,0,1,1|1,0,0]=3 5298 B11R1.279 COc1ccc(cc1Cl)SC 62a_100012355395_200000210301 [0,0,0,0,1,1|1,1,0]=4 5299 B11R1.279 COc1ccc(cc1Cl)SC 62a_200000210301_100012355395 [0,0,0,0,1,1|1,1,0]=4 5300 B11R1.279 COc1ccc(cc1Cl)S[13CH3] 62a_100012355395_200025704644 [0,0,0,0,1,1|1,1,0]=4 5301 B11R1.279 COc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100012355395 [0,0,0,0,1,1|1,1,0]=4 5302 B11R1.279 COc1ccc(cc1F)N[13CH3] 2230a_100000740183_200025704644 [0,0,0,0,1,1|2,0,0]=4 5303 B11R1.279 COc1ccc(cc1F)N[13CH3] 34a_100000740183_200025704644 [0,0,0,0,1,1|2,0,0]=4 5304 B11R1.279 COc1ccc(cc1F)O[13CH3] 34a_100000746305_200025704644 [0,0,0,0,1,1|1,0,0]=3 5305 B11R1.279 COc1ccc(cc1F)O[13CH3] 7a_100000746305_200025704644 [0,0,0,0,1,1|1,0,0]=3 5306 B11R1.279 COc1ccc(cc1F)SC 62a_100000171752_200000210301 [0,0,0,0,1,1|1,1,0]=4 5307 B11R1.279 COc1ccc(cc1F)SC 62a_200000210301_100000171752 [0,0,0,0,1,1|1,1,0]=4 5308 B11R1.279 COc1ccc(cc1F)S[13CH3] 62a_100000171752_200025704644 [0,0,0,0,1,1|1,1,0]=4 5309 B11R1.279 COc1ccc(cc1F)S[13CH3] 62a_200025704644_100000171752 [0,0,0,0,1,1|1,1,0]=4 5310 B11R1.279 COc1ccc(cc1I)N[13CH3] 34a_100011356947_200025704644 [0,0,0,0,1,1|2,0,0]=4 5311 B11R1.279 COc1ccc(cc1I)O[13CH3] 34a_100010084122_200025704644 [0,0,0,0,1,1|1,0,0]=3 5312 B11R1.279 COc1ccc(cc1I)O[13CH3] 7a_100010084122_200025704644 [0,0,0,0,1,1|1,0,0]=3 5313 B11R1.279 COc1ccc(cc1N)SC 62a_100011249504_200000210301 [0,0,0,0,1,1|1,1,0]=4 5314 B11R1.279 COc1ccc(cc1N)SC 62a_200000210301_100011249504 [0,0,0,0,1,1|1,1,0]=4 5315 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_100011249504_200025704644 [0,0,0,0,1,1|1,1,0]=4 5316 B11R1.279 COc1ccc(cc1N)S[13CH3] 62a_200025704644_100011249504 [0,0,0,0,1,1|1,1,0]=4 5317 B11R1.279 COc1ccc(cc1O)C#N 271570a_203496583355_100000188253 [0,0,0,0,1,1|2,0,0]=4 5318 B11R1.279 COc1ccc(cc1O)C=O 271570a_203496583355_100000173361 [0,0,0,0,1,1|2,0,0]=4 5319 B11R1.279 COc1ccc(cc1O)CN 271570a_203496583355_100159240714 [0,0,0,0,1,1|2,0,0]=4 5320 B11R1.279 COc1ccc(cc1O)CO 271570a_203496583355_100000246451 [0,0,0,0,1,1|2,0,0]=4 5321 B11R1.279 COc1ccc(cc1O)N[13CH3] 34a_100000211920_200025704644 [0,0,0,0,1,1|1,0,0]=3 5322 B11R1.279 COc1ccc(cc1O)SC 62a_200000210301_100009816560 [0,0,0,0,1,1|0,1,0]=3 5323 B11R1.279 COc1ccc(cc1O)S[13CH3] 62a_200025704644_100009816560 [0,0,0,0,1,1|0,1,0]=3 5324 B11R1.279 COc1ccc(nc1Br)SC 62a_100010214827_200000210301 [0,0,0,0,1,1|1,1,0]=4 5325 B11R1.279 COc1ccc(nc1Br)SC 62a_200000210301_100010214827 [0,0,0,0,1,1|1,1,0]=4 5326 B11R1.279 COc1ccc(nc1Br)S[13CH3] 62a_100010214827_200025704644 [0,0,0,0,1,1|1,1,0]=4 5327 B11R1.279 COc1ccc(nc1Br)S[13CH3] 62a_200025704644_100010214827 [0,0,0,0,1,1|1,1,0]=4 5328 B11R1.279 COc1ccc(nc1C)SC 62a_100010244750_200000210301 [0,0,0,0,1,1|1,1,0]=4 5329 B11R1.279 COc1ccc(nc1C)SC 62a_200000210301_100010244750 [0,0,0,0,1,1|1,1,0]=4 5330 B11R1.279 COc1ccc(nc1C)S[13CH3] 62a_100010244750_200025704644 [0,0,0,0,1,1|1,1,0]=4 5331 B11R1.279 COc1ccc(nc1C)S[13CH3] 62a_200025704644_100010244750 [0,0,0,0,1,1|1,1,0]=4 5332 B11R1.279 COc1ccc(nc1Cl)SC 62a_200000210301_100010233546 [0,0,0,0,1,1|1,1,0]=4 5333 B11R1.279 COc1ccc(nc1Cl)S[13CH3] 62a_200025704644_100010233546 [0,0,0,0,1,1|1,1,0]=4 5334 B11R1.279 COc1ccc(nc1F)SC 62a_100010138636_200000210301 [0,0,0,0,1,1|1,1,0]=4 5335 B11R1.279 COc1ccc(nc1F)SC 62a_200000210301_100010138636 [0,0,0,0,1,1|1,1,0]=4 5336 B11R1.279 COc1ccc(nc1F)S[13CH3] 62a_100010138636_200025704644 [0,0,0,0,1,1|1,1,0]=4 5337 B11R1.279 COc1ccc(nc1F)S[13CH3] 62a_200025704644_100010138636 [0,0,0,0,1,1|1,1,0]=4 5338 B11R1.279 COc1ccc(nc1N)SC 62a_100010192976_200000210301 [0,0,0,0,1,1|1,1,0]=4 5339 B11R1.279 COc1ccc(nc1N)S[13CH3] 62a_100010192976_200025704644 [0,0,0,0,1,1|1,1,0]=4 5340 B11R1.279 COc1ccc(nc1O)C=O 271570a_203496583355_100010174741 [0,0,0,0,1,1|2,0,0]=4 5341 B11R1.279 COc1ccc(nc1O)CO 271570a_203496583355_100009842956 [0,0,0,0,1,1|2,0,0]=4 5342 B11R1.279 COc1cnc(cc1O)SC 62a_200000210301_100010264082 [0,0,0,0,1,1|1,1,0]=4 5343 B11R1.279 COc1cnc(cc1O)S[13CH3] 62a_200025704644_100010264082 [0,0,0,0,1,1|1,1,0]=4 5344 B11R1.279 COc1cnc(nc1O)SC 271570a_203496583355_100000075546 [0,0,0,0,1,1|1,1,0]=4 5345 B11R1.279 COc1ncc(cc1O)SC 62a_200000210301_100010135713 [0,0,0,0,1,1|1,1,0]=4 5346 B11R1.279 COc1ncc(cc1O)S[13CH3] 62a_200025704644_100010135713 [0,0,0,0,1,1|1,1,0]=4 5347 B11R1.279 CSc1ccc(cc1C)O[13CH3] 34a_100000030144_200025704644 [0,0,0,0,1,1|1,1,0]=4