0 B12R1.58 C=Cc1cc(cc(c1)CC)CC 271570a_100011290941_100010187588 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.58 C=Cc1cc(cc(c1)OC)C#N 271570a_100011290941_100011934654 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.58 C=Cc1cc(cc(c1)OC)C=O 271570a_100011290941_100009816777 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.58 C=Cc1cc(cc(c1)OC)CO 271570a_100011290941_100009995317 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.58 C=Cc1cc(cc(c1)OC)OC 271570a_100011290941_100000685218 [0,0,0,0,0,0|1,0,1]=2 5 B12R1.58 C=Cc1cc(cc(c1)SC)OC 271570a_100011290941_200010709149 [0,0,0,0,0,0|1,1,1]=3 6 B12R1.58 C=Cc1cc(cc(n1)OC)OC 271570a_100011290941_100010008354 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.58 C=Cc1cc(nc(n1)OC)OC 271570a_100011290941_100000038909 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.58 C=Cc1nc(cc(n1)OC)OC 271570a_100011290941_100000758842 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.58 CCc1cc(cc(c1)SC)CC 62a_100010187588_200000210301 [0,0,0,0,0,0|2,1,0]=3 10 B12R1.58 CCc1cc(cc(c1)SC)CC 62a_200000210301_100010187588 [0,0,0,0,0,0|2,1,0]=3 11 B12R1.58 CCc1cc(cc(c1)S[13CH3])CC 62a_100010187588_200025704644 [0,0,0,0,0,0|2,1,0]=3 12 B12R1.58 CCc1cc(cc(c1)S[13CH3])CC 62a_200025704644_100010187588 [0,0,0,0,0,0|2,1,0]=3 13 B12R1.58 CCc1cc(cc(n1)CC)NC 27a_100102657272_100010074970 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.58 CCc1cc(cc(n1)CC)SC 62a_100010074970_200000210301 [0,0,0,0,0,0|3,1,0]=4 15 B12R1.58 CCc1cc(cc(n1)CC)SC 62a_200000210301_100010074970 [0,0,0,0,0,0|3,1,0]=4 16 B12R1.58 CCc1cc(cc(n1)CC)S[13CH3] 62a_100010074970_200025704644 [0,0,0,0,0,0|3,1,0]=4 17 B12R1.58 CCc1cc(cc(n1)CC)S[13CH3] 62a_200025704644_100010074970 [0,0,0,0,0,0|3,1,0]=4 18 B12R1.58 CNc1cc(cc(c1)OC)C#N 34a_100000125286_200000210301 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.58 CNc1cc(cc(c1)OC)C#N 7a_100000125286_200000210301 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.58 CNc1cc(cc(c1)OC)CO 2230a_100012182899_200000210301 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.58 CNc1cc(cc(c1)OC)CO 34a_100012182899_200000210301 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.58 CNc1cc(cc(c1)OC)OC 2230a_100000210928_200000210301 [0,0,0,0,0,0|1,0,0]=1 23 B12R1.58 CNc1cc(cc(c1)OC)OC 34a_100000210928_200000210301 [0,0,0,0,0,0|1,0,0]=1 24 B12R1.58 CNc1cc(nc(n1)OC)OC 27a_100102657272_100000038909 [0,0,0,0,0,0|3,0,0]=3 25 B12R1.58 CNc1cc(nc(n1)SC)OC 27a_100102657272_100012001593 [0,0,0,0,0,0|3,1,0]=4 26 B12R1.58 CNc1nc(cc(n1)OC)OC 27a_100102657272_100000758842 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.58 CNc1nc(nc(n1)OC)OC 27a_100102657272_100000188869 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.58 COc1cc(cc(c1)C#N)C#N 34a_100009840492_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.58 COc1cc(cc(c1)C#N)C#N 7a_100009840492_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.58 COc1cc(cc(c1)CO)CO 34a_200000081895_200000210301 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.58 COc1cc(cc(c1)CO)CO 7a_200000081895_200000210301 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.58 COc1cc(cc(c1)N[13CH3])C#N 34a_100000125286_200025704644 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.58 COc1cc(cc(c1)N[13CH3])C#N 7a_100000125286_200025704644 [0,0,0,0,0,0|3,0,0]=3 34 B12R1.58 COc1cc(cc(c1)N[13CH3])CO 2230a_100012182899_200025704644 [0,0,0,0,0,0|3,0,0]=3 35 B12R1.58 COc1cc(cc(c1)N[13CH3])CO 34a_100012182899_200025704644 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.58 COc1cc(cc(c1)OC)N[13CH3] 2230a_100000210928_200025704644 [0,0,0,0,0,0|1,0,0]=1 37 B12R1.58 COc1cc(cc(c1)OC)N[13CH3] 34a_100000210928_200025704644 [0,0,0,0,0,0|1,0,0]=1 38 B12R1.58 COc1cc(cc(c1)OC)OC 34a_100000181322_200000210301 [0,0,0,0,0,0|0,0,0]=0 39 B12R1.58 COc1cc(cc(c1)OC)OC 7a_100000181322_200000210301 [0,0,0,0,0,0|0,0,0]=0 40 B12R1.58 COc1cc(cc(c1)O[13CH3])OC 34a_100000181322_200025704644 [0,0,0,0,0,0|0,0,0]=0 41 B12R1.58 COc1cc(cc(c1)O[13CH3])OC 7a_100000181322_200025704644 [0,0,0,0,0,0|0,0,0]=0 42 B12R1.58 COc1cc(cc(c1)SC)C#N 62a_200000210301_100011934654 [0,0,0,0,0,0|2,1,0]=3 43 B12R1.58 COc1cc(cc(c1)SC)C=O 62a_100009816777_200000210301 [0,0,0,0,0,0|2,1,0]=3 44 B12R1.58 COc1cc(cc(c1)SC)C=O 62a_200000210301_100009816777 [0,0,0,0,0,0|2,1,0]=3 45 B12R1.58 COc1cc(cc(c1)SC)CO 62a_100009995317_200000210301 [0,0,0,0,0,0|2,1,0]=3 46 B12R1.58 COc1cc(cc(c1)SC)CO 62a_200000210301_100009995317 [0,0,0,0,0,0|2,1,0]=3 47 B12R1.58 COc1cc(cc(c1)SC)OC 62a_200000210301_100000685218 [0,0,0,0,0,0|0,1,0]=1 48 B12R1.58 COc1cc(cc(c1)SC)SC 62a_200000210301_200010709149 [0,0,0,0,0,0|0,2,0]=2 49 B12R1.58 COc1cc(cc(c1)SC)SC 62a_200010709149_200000210301 [0,0,0,0,0,0|0,2,0]=2 50 B12R1.58 COc1cc(cc(c1)S[13CH3])C#N 62a_200025704644_100011934654 [0,0,0,0,0,0|2,1,0]=3 51 B12R1.58 COc1cc(cc(c1)S[13CH3])C=O 62a_100009816777_200025704644 [0,0,0,0,0,0|2,1,0]=3 52 B12R1.58 COc1cc(cc(c1)S[13CH3])C=O 62a_200025704644_100009816777 [0,0,0,0,0,0|2,1,0]=3 53 B12R1.58 COc1cc(cc(c1)S[13CH3])CO 62a_100009995317_200025704644 [0,0,0,0,0,0|2,1,0]=3 54 B12R1.58 COc1cc(cc(c1)S[13CH3])CO 62a_200025704644_100009995317 [0,0,0,0,0,0|2,1,0]=3 55 B12R1.58 COc1cc(cc(c1)S[13CH3])OC 62a_200025704644_100000685218 [0,0,0,0,0,0|0,1,0]=1 56 B12R1.58 COc1cc(cc(c1)S[13CH3])SC 62a_200010709149_200025704644 [0,0,0,0,0,0|0,2,0]=2 57 B12R1.58 COc1cc(cc(c1)S[13CH3])SC 62a_200025704644_200010709149 [0,0,0,0,0,0|0,2,0]=2 58 B12R1.58 COc1cc(cc(n1)SC)CN 62a_100009841630_200000210301 [0,0,0,0,0,0|3,1,0]=4 59 B12R1.58 COc1cc(cc(n1)SC)CN 62a_200000210301_100009841630 [0,0,0,0,0,0|3,1,0]=4 60 B12R1.58 COc1cc(cc(n1)SC)CO 62a_200000090696_200000210301 [0,0,0,0,0,0|3,1,0]=4 61 B12R1.58 COc1cc(cc(n1)SC)CO 62a_200000210301_200000090696 [0,0,0,0,0,0|3,1,0]=4 62 B12R1.58 COc1cc(cc(n1)S[13CH3])CN 62a_100009841630_200025704644 [0,0,0,0,0,0|3,1,0]=4 63 B12R1.58 COc1cc(cc(n1)S[13CH3])CN 62a_200025704644_100009841630 [0,0,0,0,0,0|3,1,0]=4 64 B12R1.58 COc1cc(cc(n1)S[13CH3])CO 62a_200000090696_200025704644 [0,0,0,0,0,0|3,1,0]=4 65 B12R1.58 COc1cc(cc(n1)S[13CH3])CO 62a_200025704644_200000090696 [0,0,0,0,0,0|3,1,0]=4 66 B12R1.58 COc1cc(nc(c1)SC)C=O 62a_200000210301_200009844316 [0,0,0,0,0,0|3,1,0]=4 67 B12R1.58 COc1cc(nc(c1)SC)C=O 62a_200009844316_200000210301 [0,0,0,0,0,0|3,1,0]=4 68 B12R1.58 COc1cc(nc(c1)SC)OC 62a_100010008354_200000210301 [0,0,0,0,0,0|1,1,0]=2 69 B12R1.58 COc1cc(nc(c1)SC)OC 62a_200000210301_100010008354 [0,0,0,0,0,0|1,1,0]=2 70 B12R1.58 COc1cc(nc(c1)S[13CH3])C=O 62a_200009844316_200025704644 [0,0,0,0,0,0|3,1,0]=4 71 B12R1.58 COc1cc(nc(c1)S[13CH3])C=O 62a_200025704644_200009844316 [0,0,0,0,0,0|3,1,0]=4 72 B12R1.58 COc1cc(nc(c1)S[13CH3])OC 62a_100010008354_200025704644 [0,0,0,0,0,0|1,1,0]=2 73 B12R1.58 COc1cc(nc(c1)S[13CH3])OC 62a_200025704644_100010008354 [0,0,0,0,0,0|1,1,0]=2 74 B12R1.58 COc1cc(nc(n1)OC)SC 62a_100000038909_200000210301 [0,0,0,0,0,0|2,1,0]=3 75 B12R1.58 COc1cc(nc(n1)OC)SC 62a_200000210301_100000038909 [0,0,0,0,0,0|2,1,0]=3 76 B12R1.58 COc1cc(nc(n1)OC)S[13CH3] 62a_100000038909_200025704644 [0,0,0,0,0,0|2,1,0]=3 77 B12R1.58 COc1cc(nc(n1)OC)S[13CH3] 62a_200025704644_100000038909 [0,0,0,0,0,0|2,1,0]=3 78 B12R1.58 COc1cc(nc(n1)SC)OC 62a_100000758842_200000210301 [0,0,0,0,0,0|2,1,0]=3 79 B12R1.58 COc1cc(nc(n1)SC)OC 62a_200000210301_100000758842 [0,0,0,0,0,0|2,1,0]=3 80 B12R1.58 COc1cc(nc(n1)SC)SC 62a_100012001593_200000210301 [0,0,0,0,0,0|2,2,0]=4 81 B12R1.58 COc1cc(nc(n1)SC)SC 62a_200000210301_100012001593 [0,0,0,0,0,0|2,2,0]=4 82 B12R1.58 COc1cc(nc(n1)SC)S[13CH3] 62a_100012001593_200025704644 [0,0,0,0,0,0|2,2,0]=4 83 B12R1.58 COc1cc(nc(n1)SC)S[13CH3] 62a_200025704644_100012001593 [0,0,0,0,0,0|2,2,0]=4 84 B12R1.58 COc1cc(nc(n1)S[13CH3])OC 62a_100000758842_200025704644 [0,0,0,0,0,0|2,1,0]=3 85 B12R1.58 COc1cc(nc(n1)S[13CH3])OC 62a_200025704644_100000758842 [0,0,0,0,0,0|2,1,0]=3 86 B12R1.58 COc1nc(nc(n1)SC)OC 62a_100000188869_200000210301 [0,0,0,0,0,0|3,1,0]=4 87 B12R1.58 COc1nc(nc(n1)SC)OC 62a_200000210301_100000188869 [0,0,0,0,0,0|3,1,0]=4 88 B12R1.58 COc1nc(nc(n1)S[13CH3])OC 62a_100000188869_200025704644 [0,0,0,0,0,0|3,1,0]=4 89 B12R1.58 COc1nc(nc(n1)S[13CH3])OC 62a_200025704644_100000188869 [0,0,0,0,0,0|3,1,0]=4 90 B12R1.58 [13CH3]Oc1cc(cc(c1)C#N)C#N 34a_100009840492_200025704644 [0,0,0,0,0,0|4,0,0]=4 91 B12R1.58 [13CH3]Oc1cc(cc(c1)C#N)C#N 7a_100009840492_200025704644 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.58 [13CH3]Oc1cc(cc(c1)CO)CO 34a_200000081895_200025704644 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.58 [13CH3]Oc1cc(cc(c1)CO)CO 7a_200000081895_200025704644 [0,0,0,0,0,0|4,0,0]=4 94 B11R1.9 C=Cc1cc(cc(c1)OC)Br 271570a_100011290941_100010141301 [1,0,0,0,0,0|2,0,1]=4 95 B11R1.9 C=Cc1cc(cc(c1)OC)C 271570a_100011290941_100010187550 [1,0,0,0,0,0|1,0,1]=3 96 B11R1.9 C=Cc1cc(cc(c1)OC)Cl 271570a_100011290941_100010147680 [1,0,0,0,0,0|2,0,1]=4 97 B11R1.9 C=Cc1cc(cc(c1)OC)F 271570a_100011290941_100011934182 [1,0,0,0,0,0|2,0,1]=4 98 B11R1.9 C=Cc1cc(cc(c1)OC)N 271570a_100011290941_100000750983 [1,0,0,0,0,0|2,0,1]=4 99 B11R1.9 C=Cc1cc(cc(c1)OC)O 271570a_100011290941_100010068927 [1,0,0,0,0,0|1,0,1]=3 100 B11R1.9 C=Cc1cc(cc(c1)SC)C 271570a_100011290941_200010709730 [1,0,0,0,0,0|1,1,1]=4 101 B11R1.9 C=Cc1cc(cc(n1)C)OC 271570a_100011290941_200009849800 [1,0,0,0,0,0|2,0,1]=4 102 B11R1.9 C=Cc1cc(cc(n1)OC)C 271570a_100011290941_100009856763 [1,0,0,0,0,0|2,0,1]=4 103 B11R1.9 C=Cc1cc(nc(c1)OC)C 271570a_100011290941_100010067692 [1,0,0,0,0,0|2,0,1]=4 104 B11R1.9 CCc1cc(cc(c1)CC)O 271570a_203496583355_100010187588 [1,0,0,0,0,0|2,0,0]=3 105 B11R1.9 CCc1cc(cc(c1)NC)Br 2230a_100010074814_200000210301 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.9 CCc1cc(cc(c1)NC)Br 34a_100010074814_200000210301 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.9 CCc1cc(cc(c1)NC)Br 7a_100010074814_200000210301 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.9 CCc1cc(cc(c1)NC)C 2230a_100012022893_200000210301 [1,0,0,0,0,0|2,0,0]=3 109 B11R1.9 CCc1cc(cc(c1)NC)C 34a_100012022893_200000210301 [1,0,0,0,0,0|2,0,0]=3 110 B11R1.9 CCc1cc(cc(c1)NC)C 7a_100012022893_200000210301 [1,0,0,0,0,0|2,0,0]=3 111 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 2230a_100010074814_200025704644 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 34a_100010074814_200025704644 [1,0,0,0,0,0|3,0,0]=4 113 B11R1.9 CCc1cc(cc(c1)N[13CH3])Br 7a_100010074814_200025704644 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 2230a_100012022893_200025704644 [1,0,0,0,0,0|2,0,0]=3 115 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 34a_100012022893_200025704644 [1,0,0,0,0,0|2,0,0]=3 116 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 7a_100012022893_200025704644 [1,0,0,0,0,0|2,0,0]=3 117 B11R1.9 CCc1cc(cc(c1)SC)N 62a_100010074814_200000210301 [1,0,0,0,0,0|2,1,0]=4 118 B11R1.9 CCc1cc(cc(c1)SC)N 62a_200000210301_100010074814 [1,0,0,0,0,0|2,1,0]=4 119 B11R1.9 CCc1cc(cc(c1)S[13CH3])N 62a_100010074814_200025704644 [1,0,0,0,0,0|2,1,0]=4 120 B11R1.9 CCc1cc(cc(c1)S[13CH3])N 62a_200025704644_100010074814 [1,0,0,0,0,0|2,1,0]=4 121 B11R1.9 CCc1cc(cc(n1)CC)O 271570a_203496583355_100010074970 [1,0,0,0,0,0|3,0,0]=4 122 B11R1.9 CNc1cc(cc(c1)C#N)C 34a_100012017395_200000210301 [1,0,0,0,0,0|3,0,0]=4 123 B11R1.9 CNc1cc(cc(c1)C#N)C 7a_100012017395_200000210301 [1,0,0,0,0,0|3,0,0]=4 124 B11R1.9 CNc1cc(cc(c1)CO)O 2230a_200000124675_200000210301 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.9 CNc1cc(cc(c1)CO)O 34a_200000124675_200000210301 [1,0,0,0,0,0|3,0,0]=4 126 B11R1.9 CNc1cc(cc(c1)OC)Br 34a_100000750983_200000210301 [1,0,0,0,0,0|2,0,0]=3 127 B11R1.9 CNc1cc(cc(c1)OC)Br 7a_100000750983_200000210301 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.9 CNc1cc(cc(c1)OC)C 2230a_100012001870_200000210301 [1,0,0,0,0,0|1,0,0]=2 129 B11R1.9 CNc1cc(cc(c1)OC)C 34a_100012001870_200000210301 [1,0,0,0,0,0|1,0,0]=2 130 B11R1.9 CNc1cc(cc(c1)OC)C 7a_100012001870_200000210301 [1,0,0,0,0,0|1,0,0]=2 131 B11R1.9 CNc1cc(cc(c1)OC)Cl 2230a_100000051436_200000210301 [1,0,0,0,0,0|2,0,0]=3 132 B11R1.9 CNc1cc(cc(c1)OC)Cl 34a_100000051436_200000210301 [1,0,0,0,0,0|2,0,0]=3 133 B11R1.9 CNc1cc(cc(c1)OC)Cl 7a_100000051436_200000210301 [1,0,0,0,0,0|2,0,0]=3 134 B11R1.9 CNc1cc(cc(c1)OC)F 2230a_100000687699_200000210301 [1,0,0,0,0,0|2,0,0]=3 135 B11R1.9 CNc1cc(cc(c1)OC)F 34a_100000687699_200000210301 [1,0,0,0,0,0|2,0,0]=3 136 B11R1.9 CNc1cc(cc(c1)OC)F 7a_100000687699_200000210301 [1,0,0,0,0,0|2,0,0]=3 137 B11R1.9 CNc1cc(cc(c1)OC)O 34a_200000692186_200000210301 [1,0,0,0,0,0|1,0,0]=2 138 B11R1.9 CNc1cc(cc(c1)SC)F 62a_106741647397_200000210301 [1,0,0,0,0,0|2,1,0]=4 139 B11R1.9 CNc1cc(cc(c1)SC)F 62a_200000210301_106741647397 [1,0,0,0,0,0|2,1,0]=4 140 B11R1.9 CNc1cc(cc(c1)S[13CH3])F 62a_106741647397_200025704644 [1,0,0,0,0,0|2,1,0]=4 141 B11R1.9 CNc1cc(cc(c1)S[13CH3])F 62a_200025704644_106741647397 [1,0,0,0,0,0|2,1,0]=4 142 B11R1.9 CNc1cc(nc(n1)C)OC 27a_100102657272_100011686313 [1,0,0,0,0,0|3,0,0]=4 143 B11R1.9 CNc1nc(cc(n1)OC)C 27a_100102657272_100000755725 [1,0,0,0,0,0|3,0,0]=4 144 B11R1.9 COc1cc(cc(c1)C#N)Br 34a_100012180112_200000210301 [1,0,0,0,0,0|3,0,0]=4 145 B11R1.9 COc1cc(cc(c1)C#N)Br 7a_100012180112_200000210301 [1,0,0,0,0,0|3,0,0]=4 146 B11R1.9 COc1cc(cc(c1)C#N)C 34a_100009849966_200000210301 [1,0,0,0,0,0|2,0,0]=3 147 B11R1.9 COc1cc(cc(c1)C#N)C 7a_100009849966_200000210301 [1,0,0,0,0,0|2,0,0]=3 148 B11R1.9 COc1cc(cc(c1)C#N)Cl 34a_100000724442_200000210301 [1,0,0,0,0,0|3,0,0]=4 149 B11R1.9 COc1cc(cc(c1)C#N)Cl 7a_100000724442_200000210301 [1,0,0,0,0,0|3,0,0]=4 150 B11R1.9 COc1cc(cc(c1)C#N)F 34a_100000732150_200000210301 [1,0,0,0,0,0|3,0,0]=4 151 B11R1.9 COc1cc(cc(c1)C#N)F 7a_100000732150_200000210301 [1,0,0,0,0,0|3,0,0]=4 152 B11R1.9 COc1cc(cc(c1)C#N)O 271570a_203496583355_100011934654 [1,0,0,0,0,0|2,0,0]=3 153 B11R1.9 COc1cc(cc(c1)C=O)O 271570a_203496583355_100009816777 [1,0,0,0,0,0|2,0,0]=3 154 B11R1.9 COc1cc(cc(c1)CN)Cl 34a_107254831445_200000210301 [1,0,0,0,0,0|3,0,0]=4 155 B11R1.9 COc1cc(cc(c1)CN)F 34a_100160469513_200000210301 [1,0,0,0,0,0|3,0,0]=4 156 B11R1.9 COc1cc(cc(c1)CO)N 34a_200000124675_200000210301 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.9 COc1cc(cc(c1)CO)O 271570a_203496583355_100009995317 [1,0,0,0,0,0|2,0,0]=3 158 B11R1.9 COc1cc(cc(c1)N[13CH3])Br 34a_100000750983_200025704644 [1,0,0,0,0,0|2,0,0]=3 159 B11R1.9 COc1cc(cc(c1)N[13CH3])Br 7a_100000750983_200025704644 [1,0,0,0,0,0|2,0,0]=3 160 B11R1.9 COc1cc(cc(c1)N[13CH3])C 2230a_100012001870_200025704644 [1,0,0,0,0,0|1,0,0]=2 161 B11R1.9 COc1cc(cc(c1)N[13CH3])C 34a_100012001870_200025704644 [1,0,0,0,0,0|1,0,0]=2 162 B11R1.9 COc1cc(cc(c1)N[13CH3])C 7a_100012001870_200025704644 [1,0,0,0,0,0|1,0,0]=2 163 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 2230a_100000051436_200025704644 [1,0,0,0,0,0|2,0,0]=3 164 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 34a_100000051436_200025704644 [1,0,0,0,0,0|2,0,0]=3 165 B11R1.9 COc1cc(cc(c1)N[13CH3])Cl 7a_100000051436_200025704644 [1,0,0,0,0,0|2,0,0]=3 166 B11R1.9 COc1cc(cc(c1)N[13CH3])F 2230a_100000687699_200025704644 [1,0,0,0,0,0|2,0,0]=3 167 B11R1.9 COc1cc(cc(c1)N[13CH3])F 34a_100000687699_200025704644 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.9 COc1cc(cc(c1)N[13CH3])F 7a_100000687699_200025704644 [1,0,0,0,0,0|2,0,0]=3 169 B11R1.9 COc1cc(cc(c1)N[13CH3])O 34a_200000692186_200025704644 [1,0,0,0,0,0|1,0,0]=2 170 B11R1.9 COc1cc(cc(c1)OC)Br 34a_100010068927_200000210301 [1,0,0,0,0,0|1,0,0]=2 171 B11R1.9 COc1cc(cc(c1)OC)Br 7a_100010068927_200000210301 [1,0,0,0,0,0|1,0,0]=2 172 B11R1.9 COc1cc(cc(c1)OC)C 34a_100011216608_200000210301 [1,0,0,0,0,0|0,0,0]=1 173 B11R1.9 COc1cc(cc(c1)OC)C 7a_100011216608_200000210301 [1,0,0,0,0,0|0,0,0]=1 174 B11R1.9 COc1cc(cc(c1)OC)Cl 34a_100000051430_200000210301 [1,0,0,0,0,0|1,0,0]=2 175 B11R1.9 COc1cc(cc(c1)OC)Cl 7a_100000051430_200000210301 [1,0,0,0,0,0|1,0,0]=2 176 B11R1.9 COc1cc(cc(c1)OC)F 34a_100011369910_200000210301 [1,0,0,0,0,0|1,0,0]=2 177 B11R1.9 COc1cc(cc(c1)OC)F 7a_100011369910_200000210301 [1,0,0,0,0,0|1,0,0]=2 178 B11R1.9 COc1cc(cc(c1)OC)N 34a_200000692186_200000210301 [1,0,0,0,0,0|1,0,0]=2 179 B11R1.9 COc1cc(cc(c1)OC)N 7a_200000692186_200000210301 [1,0,0,0,0,0|1,0,0]=2 180 B11R1.9 COc1cc(cc(c1)OC)O 271570a_203496583355_100000685218 [1,0,0,0,0,0|0,0,0]=1 181 B11R1.9 COc1cc(cc(c1)O[13CH3])Br 34a_100010068927_200025704644 [1,0,0,0,0,0|1,0,0]=2 182 B11R1.9 COc1cc(cc(c1)O[13CH3])Br 7a_100010068927_200025704644 [1,0,0,0,0,0|1,0,0]=2 183 B11R1.9 COc1cc(cc(c1)O[13CH3])C 34a_100011216608_200025704644 [1,0,0,0,0,0|0,0,0]=1 184 B11R1.9 COc1cc(cc(c1)O[13CH3])C 7a_100011216608_200025704644 [1,0,0,0,0,0|0,0,0]=1 185 B11R1.9 COc1cc(cc(c1)O[13CH3])Cl 34a_100000051430_200025704644 [1,0,0,0,0,0|1,0,0]=2 186 B11R1.9 COc1cc(cc(c1)O[13CH3])Cl 7a_100000051430_200025704644 [1,0,0,0,0,0|1,0,0]=2 187 B11R1.9 COc1cc(cc(c1)O[13CH3])F 34a_100011369910_200025704644 [1,0,0,0,0,0|1,0,0]=2 188 B11R1.9 COc1cc(cc(c1)O[13CH3])F 7a_100011369910_200025704644 [1,0,0,0,0,0|1,0,0]=2 189 B11R1.9 COc1cc(cc(c1)O[13CH3])N 34a_200000692186_200025704644 [1,0,0,0,0,0|1,0,0]=2 190 B11R1.9 COc1cc(cc(c1)O[13CH3])N 7a_200000692186_200025704644 [1,0,0,0,0,0|1,0,0]=2 191 B11R1.9 COc1cc(cc(c1)SC)Br 62a_100010141301_200000210301 [1,0,0,0,0,0|1,1,0]=3 192 B11R1.9 COc1cc(cc(c1)SC)Br 62a_200000210301_100010141301 [1,0,0,0,0,0|1,1,0]=3 193 B11R1.9 COc1cc(cc(c1)SC)C 62a_200000210301_100010187550 [1,0,0,0,0,0|0,1,0]=2 194 B11R1.9 COc1cc(cc(c1)SC)Cl 62a_100010147680_200000210301 [1,0,0,0,0,0|1,1,0]=3 195 B11R1.9 COc1cc(cc(c1)SC)Cl 62a_200000210301_100010147680 [1,0,0,0,0,0|1,1,0]=3 196 B11R1.9 COc1cc(cc(c1)SC)F 62a_100011934182_200000210301 [1,0,0,0,0,0|1,1,0]=3 197 B11R1.9 COc1cc(cc(c1)SC)F 62a_200000210301_100011934182 [1,0,0,0,0,0|1,1,0]=3 198 B11R1.9 COc1cc(cc(c1)SC)N 62a_100000750983_200000210301 [1,0,0,0,0,0|1,1,0]=3 199 B11R1.9 COc1cc(cc(c1)SC)N 62a_200000210301_100000750983 [1,0,0,0,0,0|1,1,0]=3 200 B11R1.9 COc1cc(cc(c1)SC)O 271570a_203496583355_200010709149 [1,0,0,0,0,0|0,1,0]=2 201 B11R1.9 COc1cc(cc(c1)SC)O 62a_200000210301_100010068927 [1,0,0,0,0,0|0,1,0]=2 202 B11R1.9 COc1cc(cc(c1)S[13CH3])Br 62a_100010141301_200025704644 [1,0,0,0,0,0|1,1,0]=3 203 B11R1.9 COc1cc(cc(c1)S[13CH3])Br 62a_200025704644_100010141301 [1,0,0,0,0,0|1,1,0]=3 204 B11R1.9 COc1cc(cc(c1)S[13CH3])C 62a_200025704644_100010187550 [1,0,0,0,0,0|0,1,0]=2 205 B11R1.9 COc1cc(cc(c1)S[13CH3])Cl 62a_100010147680_200025704644 [1,0,0,0,0,0|1,1,0]=3 206 B11R1.9 COc1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100010147680 [1,0,0,0,0,0|1,1,0]=3 207 B11R1.9 COc1cc(cc(c1)S[13CH3])F 62a_100011934182_200025704644 [1,0,0,0,0,0|1,1,0]=3 208 B11R1.9 COc1cc(cc(c1)S[13CH3])F 62a_200025704644_100011934182 [1,0,0,0,0,0|1,1,0]=3 209 B11R1.9 COc1cc(cc(c1)S[13CH3])N 62a_100000750983_200025704644 [1,0,0,0,0,0|1,1,0]=3 210 B11R1.9 COc1cc(cc(c1)S[13CH3])N 62a_200025704644_100000750983 [1,0,0,0,0,0|1,1,0]=3 211 B11R1.9 COc1cc(cc(c1)S[13CH3])O 62a_200025704644_100010068927 [1,0,0,0,0,0|0,1,0]=2 212 B11R1.9 COc1cc(cc(n1)C)SC 62a_100010067692_200000210301 [1,0,0,0,0,0|1,1,0]=3 213 B11R1.9 COc1cc(cc(n1)C)SC 62a_200000210301_100010067692 [1,0,0,0,0,0|1,1,0]=3 214 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_100010067692_200025704644 [1,0,0,0,0,0|1,1,0]=3 215 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100010067692 [1,0,0,0,0,0|1,1,0]=3 216 B11R1.9 COc1cc(cc(n1)N)SC 62a_100010136845_200000210301 [1,0,0,0,0,0|2,1,0]=4 217 B11R1.9 COc1cc(cc(n1)N)SC 62a_200000210301_100010136845 [1,0,0,0,0,0|2,1,0]=4 218 B11R1.9 COc1cc(cc(n1)N)S[13CH3] 62a_100010136845_200025704644 [1,0,0,0,0,0|2,1,0]=4 219 B11R1.9 COc1cc(cc(n1)N)S[13CH3] 62a_200025704644_100010136845 [1,0,0,0,0,0|2,1,0]=4 220 B11R1.9 COc1cc(cc(n1)O)CN 271570a_203496583355_100009841630 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.9 COc1cc(cc(n1)O)CO 271570a_203496583355_200000090696 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.9 COc1cc(cc(n1)SC)C 62a_100009856763_200000210301 [1,0,0,0,0,0|1,1,0]=3 223 B11R1.9 COc1cc(cc(n1)SC)C 62a_200000210301_100009856763 [1,0,0,0,0,0|1,1,0]=3 224 B11R1.9 COc1cc(cc(n1)SC)N 62a_100012187057_200000210301 [1,0,0,0,0,0|2,1,0]=4 225 B11R1.9 COc1cc(cc(n1)SC)N 62a_200000210301_100012187057 [1,0,0,0,0,0|2,1,0]=4 226 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_100009856763_200025704644 [1,0,0,0,0,0|1,1,0]=3 227 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_200025704644_100009856763 [1,0,0,0,0,0|1,1,0]=3 228 B11R1.9 COc1cc(cc(n1)S[13CH3])N 62a_100012187057_200025704644 [1,0,0,0,0,0|2,1,0]=4 229 B11R1.9 COc1cc(cc(n1)S[13CH3])N 62a_200025704644_100012187057 [1,0,0,0,0,0|2,1,0]=4 230 B11R1.9 COc1cc(nc(c1)C=O)O 271570a_203496583355_200009844316 [1,0,0,0,0,0|3,0,0]=4 231 B11R1.9 COc1cc(nc(c1)OC)O 271570a_203496583355_100010008354 [1,0,0,0,0,0|1,0,0]=2 232 B11R1.9 COc1cc(nc(c1)SC)C 62a_200000210301_200009849800 [1,0,0,0,0,0|1,1,0]=3 233 B11R1.9 COc1cc(nc(c1)SC)C 62a_200009849800_200000210301 [1,0,0,0,0,0|1,1,0]=3 234 B11R1.9 COc1cc(nc(c1)SC)N 62a_100010257270_200000210301 [1,0,0,0,0,0|2,1,0]=4 235 B11R1.9 COc1cc(nc(c1)SC)N 62a_200000210301_100010257270 [1,0,0,0,0,0|2,1,0]=4 236 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200009849800_200025704644 [1,0,0,0,0,0|1,1,0]=3 237 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200025704644_200009849800 [1,0,0,0,0,0|1,1,0]=3 238 B11R1.9 COc1cc(nc(c1)S[13CH3])N 62a_100010257270_200025704644 [1,0,0,0,0,0|2,1,0]=4 239 B11R1.9 COc1cc(nc(c1)S[13CH3])N 62a_200025704644_100010257270 [1,0,0,0,0,0|2,1,0]=4 240 B11R1.9 COc1cc(nc(n1)C)SC 62a_100011686313_200000210301 [1,0,0,0,0,0|2,1,0]=4 241 B11R1.9 COc1cc(nc(n1)C)SC 62a_200000210301_100011686313 [1,0,0,0,0,0|2,1,0]=4 242 B11R1.9 COc1cc(nc(n1)C)S[13CH3] 62a_100011686313_200025704644 [1,0,0,0,0,0|2,1,0]=4 243 B11R1.9 COc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100011686313 [1,0,0,0,0,0|2,1,0]=4 244 B11R1.9 COc1cc(nc(n1)O)OC 271570a_203496583355_100000758842 [1,0,0,0,0,0|2,0,0]=3 245 B11R1.9 COc1cc(nc(n1)OC)O 271570a_203496583355_100000038909 [1,0,0,0,0,0|2,0,0]=3 246 B11R1.9 COc1cc(nc(n1)SC)C 62a_100000755725_200000210301 [1,0,0,0,0,0|2,1,0]=4 247 B11R1.9 COc1cc(nc(n1)SC)C 62a_200000210301_100000755725 [1,0,0,0,0,0|2,1,0]=4 248 B11R1.9 COc1cc(nc(n1)SC)O 271570a_203496583355_100012001593 [1,0,0,0,0,0|2,1,0]=4 249 B11R1.9 COc1cc(nc(n1)S[13CH3])C 62a_100000755725_200025704644 [1,0,0,0,0,0|2,1,0]=4 250 B11R1.9 COc1cc(nc(n1)S[13CH3])C 62a_200025704644_100000755725 [1,0,0,0,0,0|2,1,0]=4 251 B11R1.9 COc1nc(nc(n1)OC)O 271570a_203496583355_100000188869 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.9 CSc1cc(cc(c1)C#N)C 62a_200000210301_100011998626 [1,0,0,0,0,0|2,1,0]=4 253 B11R1.9 CSc1cc(cc(c1)C#N)O 62a_200000210301_100012180112 [1,0,0,0,0,0|2,1,0]=4 254 B11R1.9 CSc1cc(cc(c1)C=O)C 62a_100000686105_200000210301 [1,0,0,0,0,0|2,1,0]=4 255 B11R1.9 CSc1cc(cc(c1)C=O)C 62a_200000210301_100000686105 [1,0,0,0,0,0|2,1,0]=4 256 B11R1.9 CSc1cc(cc(c1)C=O)O 62a_100010176088_200000210301 [1,0,0,0,0,0|2,1,0]=4 257 B11R1.9 CSc1cc(cc(c1)C=O)O 62a_200000210301_100010176088 [1,0,0,0,0,0|2,1,0]=4 258 B11R1.9 CSc1cc(cc(c1)CO)C 62a_100000720511_200000210301 [1,0,0,0,0,0|2,1,0]=4 259 B11R1.9 CSc1cc(cc(c1)CO)C 62a_200000210301_100000720511 [1,0,0,0,0,0|2,1,0]=4 260 B11R1.9 CSc1cc(cc(c1)SC)C 62a_200000210301_200010709730 [1,0,0,0,0,0|0,2,0]=3 261 B11R1.9 CSc1cc(cc(c1)SC)C 62a_200010709730_200000210301 [1,0,0,0,0,0|0,2,0]=3 262 B11R1.9 CSc1cc(cc(c1)SC)F 62a_200000210301_200010245467 [1,0,0,0,0,0|1,2,0]=4 263 B11R1.9 CSc1cc(cc(c1)SC)F 62a_200010245467_200000210301 [1,0,0,0,0,0|1,2,0]=4 264 B11R1.9 CSc1cc(cc(c1)S[13CH3])C 62a_200010709730_200025704644 [1,0,0,0,0,0|0,2,0]=3 265 B11R1.9 CSc1cc(cc(c1)S[13CH3])C 62a_200025704644_200010709730 [1,0,0,0,0,0|0,2,0]=3 266 B11R1.9 CSc1cc(cc(c1)S[13CH3])F 62a_200010245467_200025704644 [1,0,0,0,0,0|1,2,0]=4 267 B11R1.9 CSc1cc(cc(c1)S[13CH3])F 62a_200025704644_200010245467 [1,0,0,0,0,0|1,2,0]=4 268 B11R1.9 Cc1cc(cc(c1)N[13CH3])C#N 34a_100012017395_200025704644 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.9 Cc1cc(cc(c1)N[13CH3])C#N 7a_100012017395_200025704644 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.9 Cc1cc(cc(c1)O[13CH3])C#N 34a_100009849966_200025704644 [1,0,0,0,0,0|2,0,0]=3 271 B11R1.9 Cc1cc(cc(c1)O[13CH3])C#N 7a_100009849966_200025704644 [1,0,0,0,0,0|2,0,0]=3 272 B11R1.9 Cc1cc(cc(c1)S[13CH3])C#N 62a_200025704644_100011998626 [1,0,0,0,0,0|2,1,0]=4 273 B11R1.9 Cc1cc(cc(c1)S[13CH3])C=O 62a_100000686105_200025704644 [1,0,0,0,0,0|2,1,0]=4 274 B11R1.9 Cc1cc(cc(c1)S[13CH3])C=O 62a_200025704644_100000686105 [1,0,0,0,0,0|2,1,0]=4 275 B11R1.9 Cc1cc(cc(c1)S[13CH3])CO 62a_100000720511_200025704644 [1,0,0,0,0,0|2,1,0]=4 276 B11R1.9 Cc1cc(cc(c1)S[13CH3])CO 62a_200025704644_100000720511 [1,0,0,0,0,0|2,1,0]=4 277 B11R1.9 [13CH3]Nc1cc(cc(c1)CO)O 2230a_200000124675_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.9 [13CH3]Nc1cc(cc(c1)CO)O 34a_200000124675_200025704644 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Br 34a_100012180112_200025704644 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Br 7a_100012180112_200025704644 [1,0,0,0,0,0|3,0,0]=4 281 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Cl 34a_100000724442_200025704644 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)Cl 7a_100000724442_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)F 34a_100000732150_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.9 [13CH3]Oc1cc(cc(c1)C#N)F 7a_100000732150_200025704644 [1,0,0,0,0,0|3,0,0]=4 285 B11R1.9 [13CH3]Oc1cc(cc(c1)CN)Cl 34a_107254831445_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.9 [13CH3]Oc1cc(cc(c1)CN)F 34a_100160469513_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.9 [13CH3]Oc1cc(cc(c1)CO)N 34a_200000124675_200025704644 [1,0,0,0,0,0|3,0,0]=4 288 B11R1.9 [13CH3]Sc1cc(cc(c1)C#N)O 62a_200025704644_100012180112 [1,0,0,0,0,0|2,1,0]=4 289 B11R1.9 [13CH3]Sc1cc(cc(c1)C=O)O 62a_100010176088_200025704644 [1,0,0,0,0,0|2,1,0]=4 290 B11R1.9 [13CH3]Sc1cc(cc(c1)C=O)O 62a_200025704644_100010176088 [1,0,0,0,0,0|2,1,0]=4 291 B13R1.313 C=C(C)c1cc(cc(c1)CC)CC 271570a_100000694244_100010187588 [0,1,0,0,0,0|3,0,0]=4 292 B13R1.313 C=C(C)c1cc(cc(c1)OC)C#N 271570a_100000694244_100011934654 [0,1,0,0,0,0|3,0,0]=4 293 B13R1.313 C=C(C)c1cc(cc(c1)OC)C=O 271570a_100000694244_100009816777 [0,1,0,0,0,0|3,0,0]=4 294 B13R1.313 C=C(C)c1cc(cc(c1)OC)CO 271570a_100000694244_100009995317 [0,1,0,0,0,0|3,0,0]=4 295 B13R1.313 C=C(C)c1cc(cc(c1)OC)OC 271570a_100000694244_100000685218 [0,1,0,0,0,0|1,0,0]=2 296 B13R1.313 C=C(C)c1cc(cc(c1)SC)OC 271570a_100000694244_200010709149 [0,1,0,0,0,0|1,1,0]=3 297 B13R1.313 C=C(C)c1cc(cc(n1)OC)OC 271570a_100000694244_100010008354 [0,1,0,0,0,0|2,0,0]=3 298 B13R1.313 C=C(C)c1cc(nc(n1)OC)OC 271570a_100000694244_100000038909 [0,1,0,0,0,0|3,0,0]=4 299 B13R1.313 C=C(C)c1nc(cc(n1)OC)OC 271570a_100000694244_100000758842 [0,1,0,0,0,0|3,0,0]=4 300 B13R1.313 C=Cc1cc(cc(c1)C(=O)C)OC 271570a_100011290941_100010713257 [0,1,0,0,0,0|2,0,1]=4 301 B13R1.313 CCc1cc(cc(c1)C(=O)C)CC 1458a_100000092841_200000210301 [0,1,0,0,0,0|3,0,0]=4 302 B13R1.313 CCc1cc(cc(c1)C(=O)[13CH3])CC 1458a_100000092841_200025704644 [0,1,0,0,0,0|3,0,0]=4 303 B13R1.313 CNc1cc(cc(c1)C(=O)N)OC 34a_200012187661_200000210301 [0,1,0,0,0,0|3,0,0]=4 304 B13R1.313 CNc1cc(cc(c1)C(=O)N)OC 7a_200012187661_200000210301 [0,1,0,0,0,0|3,0,0]=4 305 B13R1.313 CNc1cc(cc(c1)[N+](=O)[O-])OC 34a_100011203528_200000210301 [0,1,0,0,0,0|3,0,0]=4 306 B13R1.313 COc1cc(cc(c1)B(O)O)SC 62a_100009814751_200000210301 [0,1,0,0,0,0|2,1,0]=4 307 B13R1.313 COc1cc(cc(c1)B(O)O)SC 62a_200000210301_100009814751 [0,1,0,0,0,0|2,1,0]=4 308 B13R1.313 COc1cc(cc(c1)B(O)O)S[13CH3] 62a_100009814751_200025704644 [0,1,0,0,0,0|2,1,0]=4 309 B13R1.313 COc1cc(cc(c1)B(O)O)S[13CH3] 62a_200025704644_100009814751 [0,1,0,0,0,0|2,1,0]=4 310 B13R1.313 COc1cc(cc(c1)C(=O)C)OC 1458a_100000210870_200000210301 [0,1,0,0,0,0|1,0,0]=2 311 B13R1.313 COc1cc(cc(c1)C(=O)C)SC 62a_100010713257_200000210301 [0,1,0,0,0,0|1,1,0]=3 312 B13R1.313 COc1cc(cc(c1)C(=O)C)SC 62a_200000210301_100010713257 [0,1,0,0,0,0|1,1,0]=3 313 B13R1.313 COc1cc(cc(c1)C(=O)C)S[13CH3] 62a_100010713257_200025704644 [0,1,0,0,0,0|1,1,0]=3 314 B13R1.313 COc1cc(cc(c1)C(=O)C)S[13CH3] 62a_200025704644_100010713257 [0,1,0,0,0,0|1,1,0]=3 315 B13R1.313 COc1cc(cc(c1)C(=O)N)N[13CH3] 34a_200012187661_200025704644 [0,1,0,0,0,0|3,0,0]=4 316 B13R1.313 COc1cc(cc(c1)C(=O)N)N[13CH3] 7a_200012187661_200025704644 [0,1,0,0,0,0|3,0,0]=4 317 B13R1.313 COc1cc(cc(c1)C(=O)N)SC 62a_100010146780_200000210301 [0,1,0,0,0,0|2,1,0]=4 318 B13R1.313 COc1cc(cc(c1)C(=O)N)SC 62a_200000210301_100010146780 [0,1,0,0,0,0|2,1,0]=4 319 B13R1.313 COc1cc(cc(c1)C(=O)N)S[13CH3] 62a_100010146780_200025704644 [0,1,0,0,0,0|2,1,0]=4 320 B13R1.313 COc1cc(cc(c1)C(=O)N)S[13CH3] 62a_200025704644_100010146780 [0,1,0,0,0,0|2,1,0]=4 321 B13R1.313 COc1cc(cc(c1)C(=O)[13CH3])OC 1458a_100000210870_200025704644 [0,1,0,0,0,0|1,0,0]=2 322 B13R1.313 COc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 34a_100011203528_200025704644 [0,1,0,0,0,0|3,0,0]=4 323 B13R1.313 COc1cc(nc(n1)N(C)C)OC 27a_100102631434_100000758842 [0,1,0,0,0,0|3,0,0]=4 324 B13R1.313 COc1cc(nc(n1)OC)N(C)C 27a_100102631434_100000038909 [0,1,0,0,0,0|3,0,0]=4 325 B13R1.358 C=C=Cc1cc(cc(c1)OC)OC 271570a_100015277604_100000685218 [0,1,0,0,0,0|1,0,1]=3 326 B13R1.358 C=C=Cc1cc(cc(c1)SC)OC 271570a_100015277604_200010709149 [0,1,0,0,0,0|1,1,1]=4 327 B13R1.358 C=C=Cc1cc(cc(n1)OC)OC 271570a_100015277604_100010008354 [0,1,0,0,0,0|2,0,1]=4 328 B13R1.358 CC=Cc1cc(cc(c1)CC)CC 271570a_100016259895_100010187588 [0,1,0,0,0,0|3,0,0]=4 329 B13R1.358 CC=Cc1cc(cc(c1)OC)C#N 271570a_100016259895_100011934654 [0,1,0,0,0,0|3,0,0]=4 330 B13R1.358 CC=Cc1cc(cc(c1)OC)C=O 271570a_100016259895_100009816777 [0,1,0,0,0,0|3,0,0]=4 331 B13R1.358 CC=Cc1cc(cc(c1)OC)CO 271570a_100016259895_100009995317 [0,1,0,0,0,0|3,0,0]=4 332 B13R1.358 CC=Cc1cc(cc(c1)OC)OC 271570a_100016259895_100000685218 [0,1,0,0,0,0|1,0,0]=2 333 B13R1.358 CC=Cc1cc(cc(c1)SC)OC 271570a_100016259895_200010709149 [0,1,0,0,0,0|1,1,0]=3 334 B13R1.358 CC=Cc1cc(cc(n1)OC)OC 271570a_100016259895_100010008354 [0,1,0,0,0,0|2,0,0]=3 335 B13R1.358 CC=Cc1cc(nc(n1)OC)OC 271570a_100016259895_100000038909 [0,1,0,0,0,0|3,0,0]=4 336 B13R1.358 CC=Cc1nc(cc(n1)OC)OC 271570a_100016259895_100000758842 [0,1,0,0,0,0|3,0,0]=4 337 B13R1.358 CCNc1cc(cc(c1)OC)C#N 34a_100000125286_100000210202 [0,1,0,0,0,0|3,0,0]=4 338 B13R1.358 CCNc1cc(cc(c1)OC)C#N 7a_100000125286_100000210202 [0,1,0,0,0,0|3,0,0]=4 339 B13R1.358 CCNc1cc(cc(c1)OC)CO 2230a_100012182899_100000210202 [0,1,0,0,0,0|3,0,0]=4 340 B13R1.358 CCNc1cc(cc(c1)OC)CO 34a_100012182899_100000210202 [0,1,0,0,0,0|3,0,0]=4 341 B13R1.358 CCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000210202 [0,1,0,0,0,0|1,0,0]=2 342 B13R1.358 CCNc1cc(cc(c1)OC)OC 34a_100000210928_100000210202 [0,1,0,0,0,0|1,0,0]=2 343 B13R1.358 CCNc1cc(nc(n1)OC)OC 27a_100015525214_100000038909 [0,1,0,0,0,0|3,0,0]=4 344 B13R1.358 CCNc1nc(cc(n1)OC)OC 27a_100015525214_100000758842 [0,1,0,0,0,0|3,0,0]=4 345 B13R1.358 CCOc1cc(cc(c1)OC)OC 34a_100000181322_100000210202 [0,1,0,0,0,0|0,0,0]=1 346 B13R1.358 CCOc1cc(cc(c1)OC)OC 7a_100000181322_100000210202 [0,1,0,0,0,0|0,0,0]=1 347 B13R1.358 CCSc1cc(cc(c1)CC)CC 62a_100000210202_100010187588 [0,1,0,0,0,0|2,1,0]=4 348 B13R1.358 CCSc1cc(cc(c1)CC)CC 62a_100010187588_100000210202 [0,1,0,0,0,0|2,1,0]=4 349 B13R1.358 CCSc1cc(cc(c1)OC)C#N 62a_100000210202_100011934654 [0,1,0,0,0,0|2,1,0]=4 350 B13R1.358 CCSc1cc(cc(c1)OC)C=O 62a_100000210202_100009816777 [0,1,0,0,0,0|2,1,0]=4 351 B13R1.358 CCSc1cc(cc(c1)OC)C=O 62a_100009816777_100000210202 [0,1,0,0,0,0|2,1,0]=4 352 B13R1.358 CCSc1cc(cc(c1)OC)CO 62a_100000210202_100009995317 [0,1,0,0,0,0|2,1,0]=4 353 B13R1.358 CCSc1cc(cc(c1)OC)CO 62a_100009995317_100000210202 [0,1,0,0,0,0|2,1,0]=4 354 B13R1.358 CCSc1cc(cc(c1)OC)OC 62a_100000210202_100000685218 [0,1,0,0,0,0|0,1,0]=2 355 B13R1.358 CCSc1cc(cc(c1)SC)OC 62a_100000210202_200010709149 [0,1,0,0,0,0|0,2,0]=3 356 B13R1.358 CCSc1cc(cc(c1)SC)OC 62a_200010709149_100000210202 [0,1,0,0,0,0|0,2,0]=3 357 B13R1.358 CCSc1cc(cc(n1)OC)OC 62a_100000210202_100010008354 [0,1,0,0,0,0|1,1,0]=3 358 B13R1.358 CCSc1cc(cc(n1)OC)OC 62a_100010008354_100000210202 [0,1,0,0,0,0|1,1,0]=3 359 B13R1.358 CCSc1cc(nc(n1)OC)OC 62a_100000038909_100000210202 [0,1,0,0,0,0|2,1,0]=4 360 B13R1.358 CCSc1cc(nc(n1)OC)OC 62a_100000210202_100000038909 [0,1,0,0,0,0|2,1,0]=4 361 B13R1.358 CCSc1nc(cc(n1)OC)OC 62a_100000210202_100000758842 [0,1,0,0,0,0|2,1,0]=4 362 B13R1.358 CCSc1nc(cc(n1)OC)OC 62a_100000758842_100000210202 [0,1,0,0,0,0|2,1,0]=4 363 B13R1.358 CCc1cc(cc(c1)SCF)CC 62a_100010187588_100015361967 [0,1,0,0,0,0|2,1,0]=4 364 B13R1.358 CCc1cc(cc(c1)SCF)CC 62a_100015361967_100010187588 [0,1,0,0,0,0|2,1,0]=4 365 B13R1.358 CNCc1cc(cc(c1)OC)OC 207a_100102657272_100000211681 [0,1,0,0,0,0|1,0,0]=2 366 B13R1.358 CNCc1cc(cc(c1)OC)OC 2230a_100000737887_200000210301 [0,1,0,0,0,0|1,0,0]=2 367 B13R1.358 CNCc1cc(cc(c1)OC)OC 2230a_106832991635_100011215721 [0,1,0,0,0,0|1,0,0]=2 368 B13R1.358 CNCc1cc(cc(c1)OC)OC 26a_100102657272_100000181322 [0,1,0,0,0,0|1,0,0]=2 369 B13R1.358 CNCc1cc(cc(c1)OC)OC 270004a_106832991635_100000211681 [0,1,0,0,0,0|1,0,0]=2 370 B13R1.358 CNCc1cc(cc(c1)OC)OC 34a_100000737887_200000210301 [0,1,0,0,0,0|1,0,0]=2 371 B13R1.358 CNCc1cc(cc(c1)OC)OC 34a_100102657272_100011215721 [0,1,0,0,0,0|1,0,0]=2 372 B13R1.358 CNCc1cc(cc(c1)OC)OC 7a_106832991635_100011215721 [0,1,0,0,0,0|1,0,0]=2 373 B13R1.358 CNCc1nc(cc(n1)OC)OC 2230a_106832991635_100000042204 [0,1,0,0,0,0|3,0,0]=4 374 B13R1.358 CNCc1nc(cc(n1)OC)OC 34a_100102657272_100000042204 [0,1,0,0,0,0|3,0,0]=4 375 B13R1.358 CNCc1nc(cc(n1)OC)OC 7a_106832991635_100000042204 [0,1,0,0,0,0|3,0,0]=4 376 B13R1.358 COCc1cc(cc(c1)OC)OC 34a_100000700211_200000210301 [0,1,0,0,0,0|0,0,0]=1 377 B13R1.358 COCc1cc(cc(c1)OC)OC 34a_100138415774_100011215721 [0,1,0,0,0,0|0,0,0]=1 378 B13R1.358 COCc1cc(cc(c1)OC)OC 7a_100000700211_200000210301 [0,1,0,0,0,0|0,0,0]=1 379 B13R1.358 COCc1nc(cc(n1)OC)OC 34a_100138415774_100000042204 [0,1,0,0,0,0|2,0,0]=3 380 B13R1.358 COc1cc(cc(c1)NCF)C#N 34a_100000125286_100015361967 [0,1,0,0,0,0|3,0,0]=4 381 B13R1.358 COc1cc(cc(c1)NCF)C#N 7a_100000125286_100015361967 [0,1,0,0,0,0|3,0,0]=4 382 B13R1.358 COc1cc(cc(c1)NCF)CO 34a_100012182899_100015361967 [0,1,0,0,0,0|3,0,0]=4 383 B13R1.358 COc1cc(cc(c1)OC)CN[13CH3] 2230a_100000737887_200025704644 [0,1,0,0,0,0|1,0,0]=2 384 B13R1.358 COc1cc(cc(c1)OC)CN[13CH3] 34a_100000737887_200025704644 [0,1,0,0,0,0|1,0,0]=2 385 B13R1.358 COc1cc(cc(c1)OC)CO[13CH3] 34a_100000700211_200025704644 [0,1,0,0,0,0|0,0,0]=1 386 B13R1.358 COc1cc(cc(c1)OC)CO[13CH3] 7a_100000700211_200025704644 [0,1,0,0,0,0|0,0,0]=1 387 B13R1.358 COc1cc(cc(c1)OC)CSC 62a_100011215721_200000210301 [0,1,0,0,0,0|0,1,0]=2 388 B13R1.358 COc1cc(cc(c1)OC)CSC 62a_200000210301_100011215721 [0,1,0,0,0,0|0,1,0]=2 389 B13R1.358 COc1cc(cc(c1)OC)CS[13CH3] 62a_100011215721_200025704644 [0,1,0,0,0,0|0,1,0]=2 390 B13R1.358 COc1cc(cc(c1)OC)CS[13CH3] 62a_200025704644_100011215721 [0,1,0,0,0,0|0,1,0]=2 391 B13R1.358 COc1cc(cc(c1)OC)NCF 34a_100000210928_100015361967 [0,1,0,0,0,0|1,0,0]=2 392 B13R1.358 COc1cc(cc(c1)OCF)OC 34a_100000181322_100015361967 [0,1,0,0,0,0|0,0,0]=1 393 B13R1.358 COc1cc(cc(c1)OCF)OC 7a_100000181322_100015361967 [0,1,0,0,0,0|0,0,0]=1 394 B13R1.358 COc1cc(cc(c1)SC)CC#N 62a_100010146821_200000210301 [0,1,0,0,0,0|1,1,1]=4 395 B13R1.358 COc1cc(cc(c1)SC)CC#N 62a_200000210301_100010146821 [0,1,0,0,0,0|1,1,1]=4 396 B13R1.358 COc1cc(cc(c1)SCF)C#N 62a_100015361967_100011934654 [0,1,0,0,0,0|2,1,0]=4 397 B13R1.358 COc1cc(cc(c1)SCF)C=O 62a_100009816777_100015361967 [0,1,0,0,0,0|2,1,0]=4 398 B13R1.358 COc1cc(cc(c1)SCF)C=O 62a_100015361967_100009816777 [0,1,0,0,0,0|2,1,0]=4 399 B13R1.358 COc1cc(cc(c1)SCF)CO 62a_100009995317_100015361967 [0,1,0,0,0,0|2,1,0]=4 400 B13R1.358 COc1cc(cc(c1)SCF)CO 62a_100015361967_100009995317 [0,1,0,0,0,0|2,1,0]=4 401 B13R1.358 COc1cc(cc(c1)SCF)OC 62a_100015361967_100000685218 [0,1,0,0,0,0|0,1,0]=2 402 B13R1.358 COc1cc(cc(c1)SCF)SC 62a_100015361967_200010709149 [0,1,0,0,0,0|0,2,0]=3 403 B13R1.358 COc1cc(cc(c1)SCF)SC 62a_200010709149_100015361967 [0,1,0,0,0,0|0,2,0]=3 404 B13R1.358 COc1cc(cc(c1)S[13CH3])CC#N 62a_100010146821_200025704644 [0,1,0,0,0,0|1,1,1]=4 405 B13R1.358 COc1cc(cc(c1)S[13CH3])CC#N 62a_200025704644_100010146821 [0,1,0,0,0,0|1,1,1]=4 406 B13R1.358 COc1cc(nc(c1)SCF)OC 62a_100010008354_100015361967 [0,1,0,0,0,0|1,1,0]=3 407 B13R1.358 COc1cc(nc(c1)SCF)OC 62a_100015361967_100010008354 [0,1,0,0,0,0|1,1,0]=3 408 B13R1.358 COc1cc(nc(n1)CSC)OC 62a_100000042204_200000210301 [0,1,0,0,0,0|2,1,0]=4 409 B13R1.358 COc1cc(nc(n1)CSC)OC 62a_200000210301_100000042204 [0,1,0,0,0,0|2,1,0]=4 410 B13R1.358 COc1cc(nc(n1)CS[13CH3])OC 62a_100000042204_200025704644 [0,1,0,0,0,0|2,1,0]=4 411 B13R1.358 COc1cc(nc(n1)CS[13CH3])OC 62a_200025704644_100000042204 [0,1,0,0,0,0|2,1,0]=4 412 B13R1.358 COc1cc(nc(n1)OC)SCF 62a_100000038909_100015361967 [0,1,0,0,0,0|2,1,0]=4 413 B13R1.358 COc1cc(nc(n1)OC)SCF 62a_100015361967_100000038909 [0,1,0,0,0,0|2,1,0]=4 414 B13R1.358 COc1cc(nc(n1)SCF)OC 62a_100000758842_100015361967 [0,1,0,0,0,0|2,1,0]=4 415 B13R1.358 COc1cc(nc(n1)SCF)OC 62a_100015361967_100000758842 [0,1,0,0,0,0|2,1,0]=4 416 B13R1.433 C=Cc1cc(c(c(c1)OC)F)OC 271570a_100011290941_100015304952 [0,1,0,0,0,0|1,0,1]=3 417 B13R1.433 C=Cc1cc(c(c(c1)OC)O)OC 271570a_100011290941_100000691893 [0,1,0,0,0,0|1,0,1]=3 418 B13R1.433 CCc1cc(cc(c1N)CC)SC 62a_100011216614_200000210301 [0,1,0,0,0,0|2,1,0]=4 419 B13R1.433 CCc1cc(cc(c1N)CC)SC 62a_200000210301_100011216614 [0,1,0,0,0,0|2,1,0]=4 420 B13R1.433 CCc1cc(cc(c1N)CC)S[13CH3] 62a_100011216614_200025704644 [0,1,0,0,0,0|2,1,0]=4 421 B13R1.433 CCc1cc(cc(c1N)CC)S[13CH3] 62a_200025704644_100011216614 [0,1,0,0,0,0|2,1,0]=4 422 B13R1.433 CNc1cc(c(c(c1)OC)Cl)OC 34a_100009986809_200000210301 [0,1,0,0,0,0|1,0,0]=2 423 B13R1.433 CNc1cc(cc(c1Cl)OC)OC 34a_100009955059_200000210301 [0,1,0,0,0,0|1,0,0]=2 424 B13R1.433 COc1cc(c(c(c1)OC)Cl)N[13CH3] 34a_100009955059_200025704644 [0,1,0,0,0,0|1,0,0]=2 425 B13R1.433 COc1cc(c(c(c1)OC)Cl)OC 34a_100010658696_200000210301 [0,1,0,0,0,0|0,0,0]=1 426 B13R1.433 COc1cc(c(c(c1)OC)Cl)OC 7a_100010658696_200000210301 [0,1,0,0,0,0|0,0,0]=1 427 B13R1.433 COc1cc(c(c(c1)OC)O)OC 271570a_203496583355_100000186544 [0,1,0,0,0,0|0,0,0]=1 428 B13R1.433 COc1cc(c(c(c1)O[13CH3])Cl)OC 34a_100010658696_200025704644 [0,1,0,0,0,0|0,0,0]=1 429 B13R1.433 COc1cc(c(c(c1)O[13CH3])Cl)OC 7a_100010658696_200025704644 [0,1,0,0,0,0|0,0,0]=1 430 B13R1.433 COc1cc(c(c(c1)SC)O)C=O 62a_200000210301_100000751510 [0,1,0,0,0,0|2,1,0]=4 431 B13R1.433 COc1cc(c(c(c1)S[13CH3])O)C=O 62a_200025704644_100000751510 [0,1,0,0,0,0|2,1,0]=4 432 B13R1.433 COc1cc(cc(c1Cl)OC)N[13CH3] 34a_100009986809_200025704644 [0,1,0,0,0,0|1,0,0]=2 433 B13R1.433 COc1cc(cc(c1F)OC)SC 62a_100015304952_200000210301 [0,1,0,0,0,0|0,1,0]=2 434 B13R1.433 COc1cc(cc(c1F)OC)SC 62a_200000210301_100015304952 [0,1,0,0,0,0|0,1,0]=2 435 B13R1.433 COc1cc(cc(c1F)OC)S[13CH3] 62a_100015304952_200025704644 [0,1,0,0,0,0|0,1,0]=2 436 B13R1.433 COc1cc(cc(c1F)OC)S[13CH3] 62a_200025704644_100015304952 [0,1,0,0,0,0|0,1,0]=2 437 B13R1.433 COc1cc(cc(c1N)C#N)SC 62a_200000210301_200010734157 [0,1,0,0,0,0|2,1,0]=4 438 B13R1.433 COc1cc(cc(c1N)C#N)S[13CH3] 62a_200025704644_200010734157 [0,1,0,0,0,0|2,1,0]=4 439 B13R1.433 COc1cc(cc(c1N)CO)SC 62a_100010235085_200000210301 [0,1,0,0,0,0|2,1,0]=4 440 B13R1.433 COc1cc(cc(c1N)CO)SC 62a_200000210301_100010235085 [0,1,0,0,0,0|2,1,0]=4 441 B13R1.433 COc1cc(cc(c1N)CO)S[13CH3] 62a_100010235085_200025704644 [0,1,0,0,0,0|2,1,0]=4 442 B13R1.433 COc1cc(cc(c1N)CO)S[13CH3] 62a_200025704644_100010235085 [0,1,0,0,0,0|2,1,0]=4 443 B13R1.433 COc1cc(cc(c1O)C=O)SC 62a_200000210301_100000047136 [0,1,0,0,0,0|2,1,0]=4 444 B13R1.433 COc1cc(cc(c1O)C=O)S[13CH3] 62a_200025704644_100000047136 [0,1,0,0,0,0|2,1,0]=4 445 B13R1.433 COc1cc(cc(c1O)CO)SC 62a_200000210301_100000185604 [0,1,0,0,0,0|2,1,0]=4 446 B13R1.433 COc1cc(cc(c1O)CO)S[13CH3] 62a_200025704644_100000185604 [0,1,0,0,0,0|2,1,0]=4 447 B13R1.433 COc1cc(cc(c1O)OC)CO 271570a_203496583355_100010169844 [0,1,0,0,0,0|2,0,0]=3 448 B13R1.433 COc1cc(cc(c1O)SC)C#N 62a_200000210301_100000188612 [0,1,0,0,0,0|2,1,0]=4 449 B13R1.433 COc1cc(cc(c1O)SC)C=O 62a_200000210301_100000184534 [0,1,0,0,0,0|2,1,0]=4 450 B13R1.433 COc1cc(cc(c1O)SC)CO 62a_200000210301_200000022573 [0,1,0,0,0,0|2,1,0]=4 451 B13R1.433 COc1cc(cc(c1O)S[13CH3])C#N 62a_200025704644_100000188612 [0,1,0,0,0,0|2,1,0]=4 452 B13R1.433 COc1cc(cc(c1O)S[13CH3])C=O 62a_200025704644_100000184534 [0,1,0,0,0,0|2,1,0]=4 453 B13R1.433 COc1cc(cc(c1O)S[13CH3])CO 62a_200025704644_200000022573 [0,1,0,0,0,0|2,1,0]=4 454 B13R1.433 COc1nc(nc(c1N)OC)SC 62a_100000095612_200000210301 [0,1,0,0,0,0|2,1,0]=4 455 B13R1.433 COc1nc(nc(c1N)OC)SC 62a_200000210301_100000095612 [0,1,0,0,0,0|2,1,0]=4 456 B13R1.433 COc1nc(nc(c1N)OC)S[13CH3] 62a_100000095612_200025704644 [0,1,0,0,0,0|2,1,0]=4 457 B13R1.433 COc1nc(nc(c1N)OC)S[13CH3] 62a_200025704644_100000095612 [0,1,0,0,0,0|2,1,0]=4 458 B10R0.29 COC/C(=C\C(=O)OC)/OC 34a_100138415774_100016998490 [1,0,1,0,0,0|1,0,1]=4 459 B10R1.8 C=Cc1cc(cc(c1)C)C 271570a_100011290941_100011215608 [2,0,0,0,0,0|1,0,1]=4 460 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [2,0,0,0,0,0|1,0,1]=4 461 B10R1.8 C=Cc1cc(cc(c1)O)O 271570a_100011290941_100009868816 [2,0,0,0,0,0|1,0,1]=4 462 B10R1.8 CCc1cc(cc(c1)O)N 271570a_203496583355_100010074814 [2,0,0,0,0,0|2,0,0]=4 463 B10R1.8 CNc1cc(cc(c1)Br)C 34a_100000695972_200000210301 [2,0,0,0,0,0|2,0,0]=4 464 B10R1.8 CNc1cc(cc(c1)Br)C 7a_100000695972_200000210301 [2,0,0,0,0,0|2,0,0]=4 465 B10R1.8 CNc1cc(cc(c1)C)C 2230a_100000210930_200000210301 [2,0,0,0,0,0|1,0,0]=3 466 B10R1.8 CNc1cc(cc(c1)C)C 34a_100000210930_200000210301 [2,0,0,0,0,0|1,0,0]=3 467 B10R1.8 CNc1cc(cc(c1)C)C 7a_100000210930_200000210301 [2,0,0,0,0,0|1,0,0]=3 468 B10R1.8 CNc1cc(cc(c1)Cl)C 2230a_100012022512_200000210301 [2,0,0,0,0,0|2,0,0]=4 469 B10R1.8 CNc1cc(cc(c1)Cl)C 34a_100012022512_200000210301 [2,0,0,0,0,0|2,0,0]=4 470 B10R1.8 CNc1cc(cc(c1)Cl)C 7a_100012022512_200000210301 [2,0,0,0,0,0|2,0,0]=4 471 B10R1.8 CNc1cc(cc(c1)Cl)O 34a_100000123917_200000210301 [2,0,0,0,0,0|2,0,0]=4 472 B10R1.8 CNc1cc(cc(c1)Cl)O 7a_100000123917_200000210301 [2,0,0,0,0,0|2,0,0]=4 473 B10R1.8 CNc1cc(cc(c1)F)C 2230a_100000742734_200000210301 [2,0,0,0,0,0|2,0,0]=4 474 B10R1.8 CNc1cc(cc(c1)F)C 34a_100000742734_200000210301 [2,0,0,0,0,0|2,0,0]=4 475 B10R1.8 CNc1cc(cc(c1)F)C 7a_100000742734_200000210301 [2,0,0,0,0,0|2,0,0]=4 476 B10R1.8 CNc1cc(cc(c1)F)O 271570a_203496583355_106741647397 [2,0,0,0,0,0|2,0,0]=4 477 B10R1.8 CNc1cc(cc(c1)O)C 34a_100011995906_200000210301 [2,0,0,0,0,0|1,0,0]=3 478 B10R1.8 CNc1cc(cc(c1)O)C 7a_100011995906_200000210301 [2,0,0,0,0,0|1,0,0]=3 479 B10R1.8 CNc1cc(cc(c1)O)O 34a_100000043371_200000210301 [2,0,0,0,0,0|1,0,0]=3 480 B10R1.8 CNc1cc(cc(n1)C)C 27a_100102657272_100000069240 [2,0,0,0,0,0|2,0,0]=4 481 B10R1.8 CNc1cc(nc(c1)C)C 27a_100102657272_100000066820 [2,0,0,0,0,0|2,0,0]=4 482 B10R1.8 COc1cc(=O)cc(o1)C 34a_100016989201_200000210301 [2,0,0,0,0,0|1,0,1]=4 483 B10R1.8 COc1cc([nH]c(=O)c1)C 34a_100000039070_200000210301 [2,0,0,0,0,0|1,0,1]=4 484 B10R1.8 COc1cc(cc(c1)Br)Br 34a_100010167048_200000210301 [2,0,0,0,0,0|2,0,0]=4 485 B10R1.8 COc1cc(cc(c1)Br)Br 7a_100010167048_200000210301 [2,0,0,0,0,0|2,0,0]=4 486 B10R1.8 COc1cc(cc(c1)Br)C 34a_100011999630_200000210301 [2,0,0,0,0,0|1,0,0]=3 487 B10R1.8 COc1cc(cc(c1)Br)C 7a_100011999630_200000210301 [2,0,0,0,0,0|1,0,0]=3 488 B10R1.8 COc1cc(cc(c1)Br)Cl 34a_100010185897_200000210301 [2,0,0,0,0,0|2,0,0]=4 489 B10R1.8 COc1cc(cc(c1)Br)Cl 7a_100010185897_200000210301 [2,0,0,0,0,0|2,0,0]=4 490 B10R1.8 COc1cc(cc(c1)Br)F 34a_100000688818_200000210301 [2,0,0,0,0,0|2,0,0]=4 491 B10R1.8 COc1cc(cc(c1)Br)F 7a_100000688818_200000210301 [2,0,0,0,0,0|2,0,0]=4 492 B10R1.8 COc1cc(cc(c1)Br)O 271570a_203496583355_100010141301 [2,0,0,0,0,0|1,0,0]=3 493 B10R1.8 COc1cc(cc(c1)C)C 34a_100000210933_200000210301 [2,0,0,0,0,0|0,0,0]=2 494 B10R1.8 COc1cc(cc(c1)C)C 7a_100000210933_200000210301 [2,0,0,0,0,0|0,0,0]=2 495 B10R1.8 COc1cc(cc(c1)Cl)C 34a_100000087485_200000210301 [2,0,0,0,0,0|1,0,0]=3 496 B10R1.8 COc1cc(cc(c1)Cl)C 7a_100000087485_200000210301 [2,0,0,0,0,0|1,0,0]=3 497 B10R1.8 COc1cc(cc(c1)Cl)Cl 34a_100000181315_200000210301 [2,0,0,0,0,0|2,0,0]=4 498 B10R1.8 COc1cc(cc(c1)Cl)Cl 7a_100000181315_200000210301 [2,0,0,0,0,0|2,0,0]=4 499 B10R1.8 COc1cc(cc(c1)Cl)F 34a_100011219751_200000210301 [2,0,0,0,0,0|2,0,0]=4 500 B10R1.8 COc1cc(cc(c1)Cl)F 7a_100011219751_200000210301 [2,0,0,0,0,0|2,0,0]=4 501 B10R1.8 COc1cc(cc(c1)Cl)N 34a_100000123917_200000210301 [2,0,0,0,0,0|2,0,0]=4 502 B10R1.8 COc1cc(cc(c1)Cl)N 7a_100000123917_200000210301 [2,0,0,0,0,0|2,0,0]=4 503 B10R1.8 COc1cc(cc(c1)Cl)O 271570a_203496583355_100010147680 [2,0,0,0,0,0|1,0,0]=3 504 B10R1.8 COc1cc(cc(c1)F)C 34a_100011830401_200000210301 [2,0,0,0,0,0|1,0,0]=3 505 B10R1.8 COc1cc(cc(c1)F)C 7a_100011830401_200000210301 [2,0,0,0,0,0|1,0,0]=3 506 B10R1.8 COc1cc(cc(c1)F)F 34a_100000747503_200000210301 [2,0,0,0,0,0|2,0,0]=4 507 B10R1.8 COc1cc(cc(c1)F)F 7a_100000747503_200000210301 [2,0,0,0,0,0|2,0,0]=4 508 B10R1.8 COc1cc(cc(c1)F)O 271570a_203496583355_100011934182 [2,0,0,0,0,0|1,0,0]=3 509 B10R1.8 COc1cc(cc(c1)I)Br 34a_100010068917_200000210301 [2,0,0,0,0,0|2,0,0]=4 510 B10R1.8 COc1cc(cc(c1)I)Br 7a_100010068917_200000210301 [2,0,0,0,0,0|2,0,0]=4 511 B10R1.8 COc1cc(cc(c1)I)Cl 34a_100010068924_200000210301 [2,0,0,0,0,0|2,0,0]=4 512 B10R1.8 COc1cc(cc(c1)I)Cl 7a_100010068924_200000210301 [2,0,0,0,0,0|2,0,0]=4 513 B10R1.8 COc1cc(cc(c1)I)F 34a_100000717995_200000210301 [2,0,0,0,0,0|2,0,0]=4 514 B10R1.8 COc1cc(cc(c1)I)F 7a_100000717995_200000210301 [2,0,0,0,0,0|2,0,0]=4 515 B10R1.8 COc1cc(cc(c1)N)C 34a_100011995906_200000210301 [2,0,0,0,0,0|1,0,0]=3 516 B10R1.8 COc1cc(cc(c1)N)C 7a_100011995906_200000210301 [2,0,0,0,0,0|1,0,0]=3 517 B10R1.8 COc1cc(cc(c1)O)C 271570a_203496583355_100010187550 [2,0,0,0,0,0|0,0,0]=2 518 B10R1.8 COc1cc(cc(c1)O)N 271570a_203496583355_100000750983 [2,0,0,0,0,0|1,0,0]=3 519 B10R1.8 COc1cc(cc(c1)O)O 271570a_203496583355_100010068927 [2,0,0,0,0,0|0,0,0]=2 520 B10R1.8 COc1cc(cc(n1)C)O 271570a_203496583355_100010067692 [2,0,0,0,0,0|1,0,0]=3 521 B10R1.8 COc1cc(cc(n1)N)O 271570a_203496583355_100010136845 [2,0,0,0,0,0|2,0,0]=4 522 B10R1.8 COc1cc(cc(n1)O)C 271570a_203496583355_100009856763 [2,0,0,0,0,0|1,0,0]=3 523 B10R1.8 COc1cc(cc(n1)O)N 271570a_203496583355_100012187057 [2,0,0,0,0,0|2,0,0]=4 524 B10R1.8 COc1cc(nc(c1)O)C 271570a_203496583355_200009849800 [2,0,0,0,0,0|1,0,0]=3 525 B10R1.8 COc1cc(nc(c1)O)N 271570a_203496583355_100010257270 [2,0,0,0,0,0|2,0,0]=4 526 B10R1.8 COc1cc(nc(n1)C)O 271570a_203496583355_100011686313 [2,0,0,0,0,0|2,0,0]=4 527 B10R1.8 COc1cc(nc(n1)O)C 271570a_203496583355_100000755725 [2,0,0,0,0,0|2,0,0]=4 528 B10R1.8 COc1cc(oc(=O)c1)C 34a_100000210952_200000210301 [2,0,0,0,0,0|1,0,1]=4 529 B10R1.8 COc1cc(oc(=O)c1)C 7a_100000210952_200000210301 [2,0,0,0,0,0|1,0,1]=4 530 B10R1.8 CSc1cc(cc(c1)Br)O 62a_100010068917_200000210301 [2,0,0,0,0,0|1,1,0]=4 531 B10R1.8 CSc1cc(cc(c1)Br)O 62a_200000210301_100010068917 [2,0,0,0,0,0|1,1,0]=4 532 B10R1.8 CSc1cc(cc(c1)C)C 62a_100011215608_200000210301 [2,0,0,0,0,0|0,1,0]=3 533 B10R1.8 CSc1cc(cc(c1)C)C 62a_200000210301_100011215608 [2,0,0,0,0,0|0,1,0]=3 534 B10R1.8 CSc1cc(cc(c1)Cl)C 62a_100010172791_200000210301 [2,0,0,0,0,0|1,1,0]=4 535 B10R1.8 CSc1cc(cc(c1)Cl)C 62a_200000210301_100010172791 [2,0,0,0,0,0|1,1,0]=4 536 B10R1.8 CSc1cc(cc(c1)Cl)O 62a_100010068924_200000210301 [2,0,0,0,0,0|1,1,0]=4 537 B10R1.8 CSc1cc(cc(c1)Cl)O 62a_200000210301_100010068924 [2,0,0,0,0,0|1,1,0]=4 538 B10R1.8 CSc1cc(cc(c1)F)C 62a_100011356977_200000210301 [2,0,0,0,0,0|1,1,0]=4 539 B10R1.8 CSc1cc(cc(c1)F)C 62a_200000210301_100011356977 [2,0,0,0,0,0|1,1,0]=4 540 B10R1.8 CSc1cc(cc(c1)F)O 271570a_203496583355_200010245467 [2,0,0,0,0,0|1,1,0]=4 541 B10R1.8 CSc1cc(cc(c1)F)O 62a_100000688818_200000210301 [2,0,0,0,0,0|1,1,0]=4 542 B10R1.8 CSc1cc(cc(c1)F)O 62a_200000210301_100000688818 [2,0,0,0,0,0|1,1,0]=4 543 B10R1.8 CSc1cc(cc(c1)N)C 62a_100000695972_200000210301 [2,0,0,0,0,0|1,1,0]=4 544 B10R1.8 CSc1cc(cc(c1)N)C 62a_200000210301_100000695972 [2,0,0,0,0,0|1,1,0]=4 545 B10R1.8 CSc1cc(cc(c1)O)C 271570a_203496583355_200010709730 [2,0,0,0,0,0|0,1,0]=3 546 B10R1.8 CSc1cc(cc(c1)O)C 62a_200000210301_100011999630 [2,0,0,0,0,0|0,1,0]=3 547 B10R1.8 CSc1cc(cc(c1)O)O 62a_200000210301_100009868816 [2,0,0,0,0,0|0,1,0]=3 548 B10R1.8 CSc1cc(cc(n1)C)C 62a_100000069240_200000210301 [2,0,0,0,0,0|1,1,0]=4 549 B10R1.8 CSc1cc(cc(n1)C)C 62a_200000210301_100000069240 [2,0,0,0,0,0|1,1,0]=4 550 B10R1.8 CSc1cc(nc(c1)C)C 62a_100000066820_200000210301 [2,0,0,0,0,0|1,1,0]=4 551 B10R1.8 CSc1cc(nc(c1)C)C 62a_200000210301_100000066820 [2,0,0,0,0,0|1,1,0]=4 552 B10R1.8 Cc1cc(=O)cc(o1)O[13CH3] 34a_100016989201_200025704644 [2,0,0,0,0,0|1,0,1]=4 553 B10R1.8 Cc1cc(cc(=O)[nH]1)O[13CH3] 34a_100000039070_200025704644 [2,0,0,0,0,0|1,0,1]=4 554 B10R1.8 Cc1cc(cc(=O)o1)O[13CH3] 34a_100000210952_200025704644 [2,0,0,0,0,0|1,0,1]=4 555 B10R1.8 Cc1cc(cc(=O)o1)O[13CH3] 7a_100000210952_200025704644 [2,0,0,0,0,0|1,0,1]=4 556 B10R1.8 Cc1cc(cc(c1)C#N)O 271570a_203496583355_100011998626 [2,0,0,0,0,0|2,0,0]=4 557 B10R1.8 Cc1cc(cc(c1)C=O)O 271570a_203496583355_100000686105 [2,0,0,0,0,0|2,0,0]=4 558 B10R1.8 Cc1cc(cc(c1)CO)O 271570a_203496583355_100000720511 [2,0,0,0,0,0|2,0,0]=4 559 B10R1.8 Cc1cc(cc(c1)N[13CH3])Br 34a_100000695972_200025704644 [2,0,0,0,0,0|2,0,0]=4 560 B10R1.8 Cc1cc(cc(c1)N[13CH3])Br 7a_100000695972_200025704644 [2,0,0,0,0,0|2,0,0]=4 561 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 2230a_100000210930_200025704644 [2,0,0,0,0,0|1,0,0]=3 562 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 34a_100000210930_200025704644 [2,0,0,0,0,0|1,0,0]=3 563 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 7a_100000210930_200025704644 [2,0,0,0,0,0|1,0,0]=3 564 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 2230a_100012022512_200025704644 [2,0,0,0,0,0|2,0,0]=4 565 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 34a_100012022512_200025704644 [2,0,0,0,0,0|2,0,0]=4 566 B10R1.8 Cc1cc(cc(c1)N[13CH3])Cl 7a_100012022512_200025704644 [2,0,0,0,0,0|2,0,0]=4 567 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 2230a_100000742734_200025704644 [2,0,0,0,0,0|2,0,0]=4 568 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 34a_100000742734_200025704644 [2,0,0,0,0,0|2,0,0]=4 569 B10R1.8 Cc1cc(cc(c1)N[13CH3])F 7a_100000742734_200025704644 [2,0,0,0,0,0|2,0,0]=4 570 B10R1.8 Cc1cc(cc(c1)N[13CH3])O 34a_100011995906_200025704644 [2,0,0,0,0,0|1,0,0]=3 571 B10R1.8 Cc1cc(cc(c1)N[13CH3])O 7a_100011995906_200025704644 [2,0,0,0,0,0|1,0,0]=3 572 B10R1.8 Cc1cc(cc(c1)O[13CH3])Br 34a_100011999630_200025704644 [2,0,0,0,0,0|1,0,0]=3 573 B10R1.8 Cc1cc(cc(c1)O[13CH3])Br 7a_100011999630_200025704644 [2,0,0,0,0,0|1,0,0]=3 574 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 34a_100000210933_200025704644 [2,0,0,0,0,0|0,0,0]=2 575 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 7a_100000210933_200025704644 [2,0,0,0,0,0|0,0,0]=2 576 B10R1.8 Cc1cc(cc(c1)O[13CH3])Cl 34a_100000087485_200025704644 [2,0,0,0,0,0|1,0,0]=3 577 B10R1.8 Cc1cc(cc(c1)O[13CH3])Cl 7a_100000087485_200025704644 [2,0,0,0,0,0|1,0,0]=3 578 B10R1.8 Cc1cc(cc(c1)O[13CH3])F 34a_100011830401_200025704644 [2,0,0,0,0,0|1,0,0]=3 579 B10R1.8 Cc1cc(cc(c1)O[13CH3])F 7a_100011830401_200025704644 [2,0,0,0,0,0|1,0,0]=3 580 B10R1.8 Cc1cc(cc(c1)O[13CH3])N 34a_100011995906_200025704644 [2,0,0,0,0,0|1,0,0]=3 581 B10R1.8 Cc1cc(cc(c1)O[13CH3])N 7a_100011995906_200025704644 [2,0,0,0,0,0|1,0,0]=3 582 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_100011215608_200025704644 [2,0,0,0,0,0|0,1,0]=3 583 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_200025704644_100011215608 [2,0,0,0,0,0|0,1,0]=3 584 B10R1.8 Cc1cc(cc(c1)S[13CH3])Cl 62a_100010172791_200025704644 [2,0,0,0,0,0|1,1,0]=4 585 B10R1.8 Cc1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100010172791 [2,0,0,0,0,0|1,1,0]=4 586 B10R1.8 Cc1cc(cc(c1)S[13CH3])F 62a_100011356977_200025704644 [2,0,0,0,0,0|1,1,0]=4 587 B10R1.8 Cc1cc(cc(c1)S[13CH3])F 62a_200025704644_100011356977 [2,0,0,0,0,0|1,1,0]=4 588 B10R1.8 Cc1cc(cc(c1)S[13CH3])N 62a_100000695972_200025704644 [2,0,0,0,0,0|1,1,0]=4 589 B10R1.8 Cc1cc(cc(c1)S[13CH3])N 62a_200025704644_100000695972 [2,0,0,0,0,0|1,1,0]=4 590 B10R1.8 Cc1cc(cc(c1)S[13CH3])O 62a_200025704644_100011999630 [2,0,0,0,0,0|0,1,0]=3 591 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_100000066820_200025704644 [2,0,0,0,0,0|1,1,0]=4 592 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100000066820 [2,0,0,0,0,0|1,1,0]=4 593 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_100000069240_200025704644 [2,0,0,0,0,0|1,1,0]=4 594 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_200025704644_100000069240 [2,0,0,0,0,0|1,1,0]=4 595 B10R1.8 N#Cc1cc(cc(c1)O)O 271570a_203496583355_100012180112 [2,0,0,0,0,0|2,0,0]=4 596 B10R1.8 O=Cc1cc(cc(c1)O)O 271570a_203496583355_100010176088 [2,0,0,0,0,0|2,0,0]=4 597 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)O 34a_100000123917_200025704644 [2,0,0,0,0,0|2,0,0]=4 598 B10R1.8 [13CH3]Nc1cc(cc(c1)Cl)O 7a_100000123917_200025704644 [2,0,0,0,0,0|2,0,0]=4 599 B10R1.8 [13CH3]Nc1cc(cc(c1)O)O 34a_100000043371_200025704644 [2,0,0,0,0,0|1,0,0]=3 600 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Br 34a_100010167048_200025704644 [2,0,0,0,0,0|2,0,0]=4 601 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Br 7a_100010167048_200025704644 [2,0,0,0,0,0|2,0,0]=4 602 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Cl 34a_100010185897_200025704644 [2,0,0,0,0,0|2,0,0]=4 603 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)Cl 7a_100010185897_200025704644 [2,0,0,0,0,0|2,0,0]=4 604 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)F 34a_100000688818_200025704644 [2,0,0,0,0,0|2,0,0]=4 605 B10R1.8 [13CH3]Oc1cc(cc(c1)Br)F 7a_100000688818_200025704644 [2,0,0,0,0,0|2,0,0]=4 606 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)Cl 34a_100000181315_200025704644 [2,0,0,0,0,0|2,0,0]=4 607 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)Cl 7a_100000181315_200025704644 [2,0,0,0,0,0|2,0,0]=4 608 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)F 34a_100011219751_200025704644 [2,0,0,0,0,0|2,0,0]=4 609 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)F 7a_100011219751_200025704644 [2,0,0,0,0,0|2,0,0]=4 610 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)N 34a_100000123917_200025704644 [2,0,0,0,0,0|2,0,0]=4 611 B10R1.8 [13CH3]Oc1cc(cc(c1)Cl)N 7a_100000123917_200025704644 [2,0,0,0,0,0|2,0,0]=4 612 B10R1.8 [13CH3]Oc1cc(cc(c1)F)F 34a_100000747503_200025704644 [2,0,0,0,0,0|2,0,0]=4 613 B10R1.8 [13CH3]Oc1cc(cc(c1)F)F 7a_100000747503_200025704644 [2,0,0,0,0,0|2,0,0]=4 614 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Br 34a_100010068917_200025704644 [2,0,0,0,0,0|2,0,0]=4 615 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Br 7a_100010068917_200025704644 [2,0,0,0,0,0|2,0,0]=4 616 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Cl 34a_100010068924_200025704644 [2,0,0,0,0,0|2,0,0]=4 617 B10R1.8 [13CH3]Oc1cc(cc(c1)I)Cl 7a_100010068924_200025704644 [2,0,0,0,0,0|2,0,0]=4 618 B10R1.8 [13CH3]Oc1cc(cc(c1)I)F 34a_100000717995_200025704644 [2,0,0,0,0,0|2,0,0]=4 619 B10R1.8 [13CH3]Oc1cc(cc(c1)I)F 7a_100000717995_200025704644 [2,0,0,0,0,0|2,0,0]=4 620 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)O 62a_100010068917_200025704644 [2,0,0,0,0,0|1,1,0]=4 621 B10R1.8 [13CH3]Sc1cc(cc(c1)Br)O 62a_200025704644_100010068917 [2,0,0,0,0,0|1,1,0]=4 622 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)O 62a_100010068924_200025704644 [2,0,0,0,0,0|1,1,0]=4 623 B10R1.8 [13CH3]Sc1cc(cc(c1)Cl)O 62a_200025704644_100010068924 [2,0,0,0,0,0|1,1,0]=4 624 B10R1.8 [13CH3]Sc1cc(cc(c1)F)O 62a_100000688818_200025704644 [2,0,0,0,0,0|1,1,0]=4 625 B10R1.8 [13CH3]Sc1cc(cc(c1)F)O 62a_200025704644_100000688818 [2,0,0,0,0,0|1,1,0]=4 626 B10R1.8 [13CH3]Sc1cc(cc(c1)O)O 62a_200025704644_100009868816 [2,0,0,0,0,0|0,1,0]=3 627 B10R1.172 C#Cc1cccc(c1)OC 34a_100011216014_200000210301 [2,0,0,0,0,0|1,0,1]=4 628 B10R1.172 C#Cc1cccc(c1)OC 7a_100011216014_200000210301 [2,0,0,0,0,0|1,0,1]=4 629 B10R1.172 C#Cc1cccc(c1)O[13CH3] 34a_100011216014_200025704644 [2,0,0,0,0,0|1,0,1]=4 630 B10R1.172 C#Cc1cccc(c1)O[13CH3] 7a_100011216014_200025704644 [2,0,0,0,0,0|1,0,1]=4 631 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [2,0,0,0,0,0|1,0,1]=4 632 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [2,0,0,0,0,0|1,0,1]=4 633 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [2,0,0,0,0,0|1,0,1]=4 634 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [2,0,0,0,0,0|1,0,1]=4 635 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [2,0,0,0,0,0|1,0,1]=4 636 B10R1.172 CC[n+]1cccc(c1)OC 34a_100000731997_200000210301 [2,0,0,0,0,0|2,0,0]=4 637 B10R1.172 CC[n+]1cccc(c1)OC 7a_100000731997_200000210301 [2,0,0,0,0,0|2,0,0]=4 638 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 34a_100000731997_200025704644 [2,0,0,0,0,0|2,0,0]=4 639 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 7a_100000731997_200025704644 [2,0,0,0,0,0|2,0,0]=4 640 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [2,0,0,0,0,0|2,0,0]=4 641 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [2,0,0,0,0,0|2,0,0]=4 642 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [2,0,0,0,0,0|2,0,0]=4 643 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [2,0,0,0,0,0|2,0,0]=4 644 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [2,0,0,0,0,0|2,0,0]=4 645 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [2,0,0,0,0,0|2,0,0]=4 646 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [2,0,0,0,0,0|1,0,0]=3 647 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [2,0,0,0,0,0|1,0,0]=3 648 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [2,0,0,0,0,0|1,0,0]=3 649 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [2,0,0,0,0,0|1,0,0]=3 650 B10R1.172 CCc1cccc(c1)SC 62a_100011263222_200000210301 [2,0,0,0,0,0|1,1,0]=4 651 B10R1.172 CCc1cccc(c1)SC 62a_200000210301_100011263222 [2,0,0,0,0,0|1,1,0]=4 652 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_100011263222_200025704644 [2,0,0,0,0,0|1,1,0]=4 653 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_200025704644_100011263222 [2,0,0,0,0,0|1,1,0]=4 654 B10R1.172 CCc1cncc(c1)OC 34a_200009861530_200000210301 [2,0,0,0,0,0|2,0,0]=4 655 B10R1.172 CCc1cncc(c1)OC 7a_200009861530_200000210301 [2,0,0,0,0,0|2,0,0]=4 656 B10R1.172 CCc1cncc(c1)O[13CH3] 34a_200009861530_200025704644 [2,0,0,0,0,0|2,0,0]=4 657 B10R1.172 CCc1cncc(c1)O[13CH3] 7a_200009861530_200025704644 [2,0,0,0,0,0|2,0,0]=4 658 B10R1.172 CNc1cccc(c1)OC 34a_100000210024_200000210301 [2,0,0,0,0,0|1,0,0]=3 659 B10R1.172 CNc1cccc(c1)OC 34a_100000756613_200000210301 [2,0,0,0,0,0|1,0,0]=3 660 B10R1.172 CNc1cccc(c1)OC 7a_100000756613_200000210301 [2,0,0,0,0,0|1,0,0]=3 661 B10R1.172 CNc1cccc(c1)O[13CH3] 34a_100000756613_200025704644 [2,0,0,0,0,0|1,0,0]=3 662 B10R1.172 CNc1cccc(c1)O[13CH3] 7a_100000756613_200025704644 [2,0,0,0,0,0|1,0,0]=3 663 B10R1.172 CNc1cccc(c1)SC 2230a_100000210049_200000210301 [2,0,0,0,0,0|1,1,0]=4 664 B10R1.172 CNc1cccc(c1)SC 34a_100000210049_200000210301 [2,0,0,0,0,0|1,1,0]=4 665 B10R1.172 CNc1cccc(c1)SC 62a_100000219648_200000210301 [2,0,0,0,0,0|1,1,0]=4 666 B10R1.172 CNc1cccc(c1)SC 62a_200000210301_100000219648 [2,0,0,0,0,0|1,1,0]=4 667 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_100000219648_200025704644 [2,0,0,0,0,0|1,1,0]=4 668 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_200025704644_100000219648 [2,0,0,0,0,0|1,1,0]=4 669 B10R1.172 COc1cc(ccn1)O[13CH3] 34a_100012181050_200025704644 [2,0,0,0,0,0|1,0,0]=3 670 B10R1.172 COc1cc(ccn1)SC 62a_100000117307_200000210301 [2,0,0,0,0,0|1,1,0]=4 671 B10R1.172 COc1cc(ccn1)SC 62a_200000210301_100000117307 [2,0,0,0,0,0|1,1,0]=4 672 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_100000117307_200025704644 [2,0,0,0,0,0|1,1,0]=4 673 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_200025704644_100000117307 [2,0,0,0,0,0|1,1,0]=4 674 B10R1.172 COc1cccc(c1)C#N 34a_100000184713_200000210301 [2,0,0,0,0,0|2,0,0]=4 675 B10R1.172 COc1cccc(c1)C#N 7a_100000184713_200000210301 [2,0,0,0,0,0|2,0,0]=4 676 B10R1.172 COc1cccc(c1)CBr 34a_100011660834_200000210301 [2,0,0,0,0,0|2,0,0]=4 677 B10R1.172 COc1cccc(c1)CBr 7a_100011660834_200000210301 [2,0,0,0,0,0|2,0,0]=4 678 B10R1.172 COc1cccc(c1)CCl 34a_100000084143_200000210301 [2,0,0,0,0,0|2,0,0]=4 679 B10R1.172 COc1cccc(c1)CCl 7a_100000084143_200000210301 [2,0,0,0,0,0|2,0,0]=4 680 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [2,0,0,0,0,0|2,0,0]=4 681 B10R1.172 COc1cccc(c1)CO 34a_100011214949_200000210301 [2,0,0,0,0,0|2,0,0]=4 682 B10R1.172 COc1cccc(c1)CO 7a_100011214949_200000210301 [2,0,0,0,0,0|2,0,0]=4 683 B10R1.172 COc1cccc(c1)N[13CH3] 34a_100000210024_200025704644 [2,0,0,0,0,0|1,0,0]=3 684 B10R1.172 COc1cccc(c1)OC 34a_100000211255_200000210301 [2,0,0,0,0,0|0,0,0]=2 685 B10R1.172 COc1cccc(c1)OC 7a_100000211255_200000210301 [2,0,0,0,0,0|0,0,0]=2 686 B10R1.172 COc1cccc(c1)O[13CH3] 34a_100000211255_200025704644 [2,0,0,0,0,0|0,0,0]=2 687 B10R1.172 COc1cccc(c1)O[13CH3] 7a_100000211255_200025704644 [2,0,0,0,0,0|0,0,0]=2 688 B10R1.172 COc1cccc(c1)SC 34a_100011265683_200000210301 [2,0,0,0,0,0|0,1,0]=3 689 B10R1.172 COc1cccc(c1)SC 62a_200000210301_100000170001 [2,0,0,0,0,0|0,1,0]=3 690 B10R1.172 COc1cccc(c1)SC 7a_100011265683_200000210301 [2,0,0,0,0,0|0,1,0]=3 691 B10R1.172 COc1cccc(c1)S[13CH3] 62a_200025704644_100000170001 [2,0,0,0,0,0|0,1,0]=3 692 B10R1.172 COc1cccc(n1)SC 62a_100000760917_200000210301 [2,0,0,0,0,0|1,1,0]=4 693 B10R1.172 COc1cccc(n1)SC 62a_200000210301_100000760917 [2,0,0,0,0,0|1,1,0]=4 694 B10R1.172 COc1cccc(n1)S[13CH3] 62a_100000760917_200025704644 [2,0,0,0,0,0|1,1,0]=4 695 B10R1.172 COc1cccc(n1)S[13CH3] 62a_200025704644_100000760917 [2,0,0,0,0,0|1,1,0]=4 696 B10R1.172 COc1ccnc(c1)OC 34a_100012181050_200000210301 [2,0,0,0,0,0|1,0,0]=3 697 B10R1.172 COc1ccnc(c1)SC 62a_100009817693_200000210301 [2,0,0,0,0,0|1,1,0]=4 698 B10R1.172 COc1ccnc(c1)SC 62a_200000210301_100011216251 [2,0,0,0,0,0|1,1,0]=4 699 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_100009817693_200025704644 [2,0,0,0,0,0|1,1,0]=4 700 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_200025704644_100011216251 [2,0,0,0,0,0|1,1,0]=4 701 B10R1.172 COc1cncc(c1)OC 34a_100000084572_200000210301 [2,0,0,0,0,0|1,0,0]=3 702 B10R1.172 COc1cncc(c1)OC 7a_100000084572_200000210301 [2,0,0,0,0,0|1,0,0]=3 703 B10R1.172 COc1cncc(c1)O[13CH3] 34a_100000084572_200025704644 [2,0,0,0,0,0|1,0,0]=3 704 B10R1.172 COc1cncc(c1)O[13CH3] 7a_100000084572_200025704644 [2,0,0,0,0,0|1,0,0]=3 705 B10R1.172 COc1cncc(c1)SC 62a_100000050176_200000210301 [2,0,0,0,0,0|1,1,0]=4 706 B10R1.172 COc1cncc(c1)SC 62a_200000210301_100000050176 [2,0,0,0,0,0|1,1,0]=4 707 B10R1.172 COc1cncc(c1)S[13CH3] 62a_100000050176_200025704644 [2,0,0,0,0,0|1,1,0]=4 708 B10R1.172 COc1cncc(c1)S[13CH3] 62a_200025704644_100000050176 [2,0,0,0,0,0|1,1,0]=4 709 B10R1.172 CSc1cccc(c1)N[13CH3] 2230a_100000210049_200025704644 [2,0,0,0,0,0|1,1,0]=4 710 B10R1.172 CSc1cccc(c1)N[13CH3] 34a_100000210049_200025704644 [2,0,0,0,0,0|1,1,0]=4 711 B10R1.172 CSc1cccc(c1)O[13CH3] 34a_100011265683_200025704644 [2,0,0,0,0,0|0,1,0]=3 712 B10R1.172 CSc1cccc(c1)O[13CH3] 7a_100011265683_200025704644 [2,0,0,0,0,0|0,1,0]=3 713 B10R1.172 CSc1cccc(c1)SC 62a_100011215954_200000210301 [2,0,0,0,0,0|0,2,0]=4 714 B10R1.172 CSc1cccc(c1)SC 62a_200000210301_100011215954 [2,0,0,0,0,0|0,2,0]=4 715 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_100011215954_200025704644 [2,0,0,0,0,0|0,2,0]=4 716 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_200025704644_100011215954 [2,0,0,0,0,0|0,2,0]=4 717 B10R1.172 [13CH3]Oc1cccc(c1)C#N 34a_100000184713_200025704644 [2,0,0,0,0,0|2,0,0]=4 718 B10R1.172 [13CH3]Oc1cccc(c1)C#N 7a_100000184713_200025704644 [2,0,0,0,0,0|2,0,0]=4 719 B10R1.172 [13CH3]Oc1cccc(c1)CBr 34a_100011660834_200025704644 [2,0,0,0,0,0|2,0,0]=4 720 B10R1.172 [13CH3]Oc1cccc(c1)CBr 7a_100011660834_200025704644 [2,0,0,0,0,0|2,0,0]=4 721 B10R1.172 [13CH3]Oc1cccc(c1)CCl 34a_100000084143_200025704644 [2,0,0,0,0,0|2,0,0]=4 722 B10R1.172 [13CH3]Oc1cccc(c1)CCl 7a_100000084143_200025704644 [2,0,0,0,0,0|2,0,0]=4 723 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [2,0,0,0,0,0|2,0,0]=4 724 B10R1.172 [13CH3]Oc1cccc(c1)CO 34a_100011214949_200025704644 [2,0,0,0,0,0|2,0,0]=4 725 B10R1.172 [13CH3]Oc1cccc(c1)CO 7a_100011214949_200025704644 [2,0,0,0,0,0|2,0,0]=4 726 B12R1.11 C=C(C)c1cc(cc(c1)OC)Br 271570a_100000694244_100010141301 [1,1,0,0,0,0|2,0,0]=4 727 B12R1.11 C=C(C)c1cc(cc(c1)OC)C 271570a_100000694244_100010187550 [1,1,0,0,0,0|1,0,0]=3 728 B12R1.11 C=C(C)c1cc(cc(c1)OC)Cl 271570a_100000694244_100010147680 [1,1,0,0,0,0|2,0,0]=4 729 B12R1.11 C=C(C)c1cc(cc(c1)OC)F 271570a_100000694244_100011934182 [1,1,0,0,0,0|2,0,0]=4 730 B12R1.11 C=C(C)c1cc(cc(c1)OC)N 271570a_100000694244_100000750983 [1,1,0,0,0,0|2,0,0]=4 731 B12R1.11 C=C(C)c1cc(cc(c1)OC)O 271570a_100000694244_100010068927 [1,1,0,0,0,0|1,0,0]=3 732 B12R1.11 C=C(C)c1cc(cc(c1)SC)C 271570a_100000694244_200010709730 [1,1,0,0,0,0|1,1,0]=4 733 B12R1.11 C=C(C)c1cc(cc(n1)C)OC 271570a_100000694244_200009849800 [1,1,0,0,0,0|2,0,0]=4 734 B12R1.11 C=C(C)c1cc(cc(n1)OC)C 271570a_100000694244_100009856763 [1,1,0,0,0,0|2,0,0]=4 735 B12R1.11 C=C(C)c1cc(nc(c1)OC)C 271570a_100000694244_100010067692 [1,1,0,0,0,0|2,0,0]=4 736 B12R1.11 CC(=O)c1cc(cc(c1)O[13CH3])C 34a_100009855872_200025704644 [1,1,0,0,0,0|1,0,0]=3 737 B12R1.11 CC(=O)c1cc(cc(c1)O[13CH3])C 7a_100009855872_200025704644 [1,1,0,0,0,0|1,0,0]=3 738 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])C 62a_100000694479_200025704644 [1,1,0,0,0,0|1,1,0]=4 739 B12R1.11 CC(=O)c1cc(cc(c1)S[13CH3])C 62a_200025704644_100000694479 [1,1,0,0,0,0|1,1,0]=4 740 B12R1.11 COc1cc(cc(c1)B(O)O)O 271570a_203496583355_100009814751 [1,1,0,0,0,0|2,0,0]=4 741 B12R1.11 COc1cc(cc(c1)C(=O)C)Br 1458a_100011934030_200000210301 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.11 COc1cc(cc(c1)C(=O)C)C 1458a_100000117910_200000210301 [1,1,0,0,0,0|1,0,0]=3 743 B12R1.11 COc1cc(cc(c1)C(=O)C)C 34a_100009855872_200000210301 [1,1,0,0,0,0|1,0,0]=3 744 B12R1.11 COc1cc(cc(c1)C(=O)C)C 7a_100009855872_200000210301 [1,1,0,0,0,0|1,0,0]=3 745 B12R1.11 COc1cc(cc(c1)C(=O)C)Cl 1458a_100000066651_200000210301 [1,1,0,0,0,0|2,0,0]=4 746 B12R1.11 COc1cc(cc(c1)C(=O)C)F 1458a_100011934639_200000210301 [1,1,0,0,0,0|2,0,0]=4 747 B12R1.11 COc1cc(cc(c1)C(=O)C)I 1458a_200010292657_200000210301 [1,1,0,0,0,0|2,0,0]=4 748 B12R1.11 COc1cc(cc(c1)C(=O)C)O 1458a_100000083963_200000210301 [1,1,0,0,0,0|1,0,0]=3 749 B12R1.11 COc1cc(cc(c1)C(=O)C)O 271570a_203496583355_100010713257 [1,1,0,0,0,0|1,0,0]=3 750 B12R1.11 COc1cc(cc(c1)C(=O)N)O 271570a_203496583355_100010146780 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100011934030_200025704644 [1,1,0,0,0,0|2,0,0]=4 752 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000117910_200025704644 [1,1,0,0,0,0|1,0,0]=3 753 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000066651_200025704644 [1,1,0,0,0,0|2,0,0]=4 754 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])F 1458a_100011934639_200025704644 [1,1,0,0,0,0|2,0,0]=4 755 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])I 1458a_200010292657_200025704644 [1,1,0,0,0,0|2,0,0]=4 756 B12R1.11 COc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000083963_200025704644 [1,1,0,0,0,0|1,0,0]=3 757 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 34a_200000091708_200000210301 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 7a_200000091708_200000210301 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.11 COc1cc(nc(c1)N(C)C)C 34a_200009824162_200000210301 [1,1,0,0,0,0|2,0,0]=4 760 B12R1.11 CSc1cc(cc(c1)C(=O)C)C 62a_100000694479_200000210301 [1,1,0,0,0,0|1,1,0]=4 761 B12R1.11 CSc1cc(cc(c1)C(=O)C)C 62a_200000210301_100000694479 [1,1,0,0,0,0|1,1,0]=4 762 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 34a_200000091708_200025704644 [1,1,0,0,0,0|2,0,0]=4 763 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 7a_200000091708_200025704644 [1,1,0,0,0,0|2,0,0]=4 764 B12R1.11 Cc1cc(cc(n1)N(C)C)O[13CH3] 34a_200009824162_200025704644 [1,1,0,0,0,0|2,0,0]=4 765 B12R1.41 C=C=Cc1cc(cc(c1)OC)C 271570a_100015277604_100010187550 [1,1,0,0,0,0|1,0,1]=4 766 B12R1.41 C=C=Cc1cc(cc(c1)OC)O 271570a_100015277604_100010068927 [1,1,0,0,0,0|1,0,1]=4 767 B12R1.41 CC=Cc1cc(cc(c1)OC)Br 271570a_100016259895_100010141301 [1,1,0,0,0,0|2,0,0]=4 768 B12R1.41 CC=Cc1cc(cc(c1)OC)C 271570a_100016259895_100010187550 [1,1,0,0,0,0|1,0,0]=3 769 B12R1.41 CC=Cc1cc(cc(c1)OC)Cl 271570a_100016259895_100010147680 [1,1,0,0,0,0|2,0,0]=4 770 B12R1.41 CC=Cc1cc(cc(c1)OC)F 271570a_100016259895_100011934182 [1,1,0,0,0,0|2,0,0]=4 771 B12R1.41 CC=Cc1cc(cc(c1)OC)N 271570a_100016259895_100000750983 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.41 CC=Cc1cc(cc(c1)OC)O 271570a_100016259895_100010068927 [1,1,0,0,0,0|1,0,0]=3 773 B12R1.41 CC=Cc1cc(cc(c1)SC)C 271570a_100016259895_200010709730 [1,1,0,0,0,0|1,1,0]=4 774 B12R1.41 CC=Cc1cc(cc(n1)C)OC 271570a_100016259895_200009849800 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.41 CC=Cc1cc(cc(n1)OC)C 271570a_100016259895_100009856763 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.41 CC=Cc1cc(nc(c1)OC)C 271570a_100016259895_100010067692 [1,1,0,0,0,0|2,0,0]=4 777 B12R1.41 CCNc1cc(cc(c1)CC)C 2230a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 778 B12R1.41 CCNc1cc(cc(c1)CC)C 34a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 779 B12R1.41 CCNc1cc(cc(c1)CC)C 7a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 780 B12R1.41 CCNc1cc(cc(c1)OC)Br 34a_100000750983_100000210202 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.41 CCNc1cc(cc(c1)OC)Br 7a_100000750983_100000210202 [1,1,0,0,0,0|2,0,0]=4 782 B12R1.41 CCNc1cc(cc(c1)OC)C 2230a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 783 B12R1.41 CCNc1cc(cc(c1)OC)C 34a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 784 B12R1.41 CCNc1cc(cc(c1)OC)C 7a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 785 B12R1.41 CCNc1cc(cc(c1)OC)Cl 2230a_100000051436_100000210202 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.41 CCNc1cc(cc(c1)OC)Cl 34a_100000051436_100000210202 [1,1,0,0,0,0|2,0,0]=4 787 B12R1.41 CCNc1cc(cc(c1)OC)Cl 7a_100000051436_100000210202 [1,1,0,0,0,0|2,0,0]=4 788 B12R1.41 CCNc1cc(cc(c1)OC)F 2230a_100000687699_100000210202 [1,1,0,0,0,0|2,0,0]=4 789 B12R1.41 CCNc1cc(cc(c1)OC)F 34a_100000687699_100000210202 [1,1,0,0,0,0|2,0,0]=4 790 B12R1.41 CCNc1cc(cc(c1)OC)F 7a_100000687699_100000210202 [1,1,0,0,0,0|2,0,0]=4 791 B12R1.41 CCNc1cc(cc(c1)OC)O 34a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 792 B12R1.41 CCOc1cc(cc(c1)C#N)C 34a_100009849966_100000210202 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.41 CCOc1cc(cc(c1)C#N)C 7a_100009849966_100000210202 [1,1,0,0,0,0|2,0,0]=4 794 B12R1.41 CCOc1cc(cc(c1)OC)Br 34a_100010068927_100000210202 [1,1,0,0,0,0|1,0,0]=3 795 B12R1.41 CCOc1cc(cc(c1)OC)Br 7a_100010068927_100000210202 [1,1,0,0,0,0|1,0,0]=3 796 B12R1.41 CCOc1cc(cc(c1)OC)C 34a_100011216608_100000210202 [1,1,0,0,0,0|0,0,0]=2 797 B12R1.41 CCOc1cc(cc(c1)OC)C 7a_100011216608_100000210202 [1,1,0,0,0,0|0,0,0]=2 798 B12R1.41 CCOc1cc(cc(c1)OC)Cl 34a_100000051430_100000210202 [1,1,0,0,0,0|1,0,0]=3 799 B12R1.41 CCOc1cc(cc(c1)OC)Cl 7a_100000051430_100000210202 [1,1,0,0,0,0|1,0,0]=3 800 B12R1.41 CCOc1cc(cc(c1)OC)F 34a_100011369910_100000210202 [1,1,0,0,0,0|1,0,0]=3 801 B12R1.41 CCOc1cc(cc(c1)OC)F 7a_100011369910_100000210202 [1,1,0,0,0,0|1,0,0]=3 802 B12R1.41 CCOc1cc(cc(c1)OC)N 34a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 803 B12R1.41 CCOc1cc(cc(c1)OC)N 7a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 804 B12R1.41 CCOc1cc(cc(c1)SC)F 62a_100012343907_200000210301 [1,1,0,0,0,0|1,1,0]=4 805 B12R1.41 CCOc1cc(cc(c1)SC)F 62a_200000210301_100012343907 [1,1,0,0,0,0|1,1,0]=4 806 B12R1.41 CCOc1cc(cc(c1)S[13CH3])F 62a_100012343907_200025704644 [1,1,0,0,0,0|1,1,0]=4 807 B12R1.41 CCOc1cc(cc(c1)S[13CH3])F 62a_200025704644_100012343907 [1,1,0,0,0,0|1,1,0]=4 808 B12R1.41 CCSc1cc(cc(c1)OC)Br 62a_100000210202_100010141301 [1,1,0,0,0,0|1,1,0]=4 809 B12R1.41 CCSc1cc(cc(c1)OC)Br 62a_100010141301_100000210202 [1,1,0,0,0,0|1,1,0]=4 810 B12R1.41 CCSc1cc(cc(c1)OC)C 62a_100000210202_100010187550 [1,1,0,0,0,0|0,1,0]=3 811 B12R1.41 CCSc1cc(cc(c1)OC)Cl 62a_100000210202_100010147680 [1,1,0,0,0,0|1,1,0]=4 812 B12R1.41 CCSc1cc(cc(c1)OC)Cl 62a_100010147680_100000210202 [1,1,0,0,0,0|1,1,0]=4 813 B12R1.41 CCSc1cc(cc(c1)OC)F 62a_100000210202_100011934182 [1,1,0,0,0,0|1,1,0]=4 814 B12R1.41 CCSc1cc(cc(c1)OC)F 62a_100011934182_100000210202 [1,1,0,0,0,0|1,1,0]=4 815 B12R1.41 CCSc1cc(cc(c1)OC)N 62a_100000210202_100000750983 [1,1,0,0,0,0|1,1,0]=4 816 B12R1.41 CCSc1cc(cc(c1)OC)N 62a_100000750983_100000210202 [1,1,0,0,0,0|1,1,0]=4 817 B12R1.41 CCSc1cc(cc(c1)OC)O 62a_100000210202_100010068927 [1,1,0,0,0,0|0,1,0]=3 818 B12R1.41 CCSc1cc(cc(c1)SC)C 62a_100000210202_200010709730 [1,1,0,0,0,0|0,2,0]=4 819 B12R1.41 CCSc1cc(cc(c1)SC)C 62a_200010709730_100000210202 [1,1,0,0,0,0|0,2,0]=4 820 B12R1.41 CCSc1cc(cc(n1)C)OC 62a_100000210202_200009849800 [1,1,0,0,0,0|1,1,0]=4 821 B12R1.41 CCSc1cc(cc(n1)C)OC 62a_200009849800_100000210202 [1,1,0,0,0,0|1,1,0]=4 822 B12R1.41 CCSc1cc(cc(n1)OC)C 62a_100000210202_100009856763 [1,1,0,0,0,0|1,1,0]=4 823 B12R1.41 CCSc1cc(cc(n1)OC)C 62a_100009856763_100000210202 [1,1,0,0,0,0|1,1,0]=4 824 B12R1.41 CCSc1cc(nc(c1)OC)C 62a_100000210202_100010067692 [1,1,0,0,0,0|1,1,0]=4 825 B12R1.41 CCSc1cc(nc(c1)OC)C 62a_100010067692_100000210202 [1,1,0,0,0,0|1,1,0]=4 826 B12R1.41 CCc1cc(cc(c1)NCF)C 34a_100012022893_100015361967 [1,1,0,0,0,0|2,0,0]=4 827 B12R1.41 CCc1cc(cc(c1)NCF)C 7a_100012022893_100015361967 [1,1,0,0,0,0|2,0,0]=4 828 B12R1.41 CNCc1cc(cc(c1)OC)Br 207a_100102657272_100009816777 [1,1,0,0,0,0|2,0,0]=4 829 B12R1.41 CNCc1cc(cc(c1)OC)Br 2230a_106832991635_100010162483 [1,1,0,0,0,0|2,0,0]=4 830 B12R1.41 CNCc1cc(cc(c1)OC)Br 269862a_106832991636_100009816777 [1,1,0,0,0,0|2,0,0]=4 831 B12R1.41 CNCc1cc(cc(c1)OC)Br 26a_100102657272_100010068927 [1,1,0,0,0,0|2,0,0]=4 832 B12R1.41 CNCc1cc(cc(c1)OC)Br 270004a_106832991635_100009816777 [1,1,0,0,0,0|2,0,0]=4 833 B12R1.41 CNCc1cc(cc(c1)OC)Br 34a_100102657272_100010162483 [1,1,0,0,0,0|2,0,0]=4 834 B12R1.41 CNCc1cc(cc(c1)OC)Br 7a_106832991635_100010162483 [1,1,0,0,0,0|2,0,0]=4 835 B12R1.41 CNCc1cc(cc(c1)OC)C 207a_100102657272_100000101404 [1,1,0,0,0,0|1,0,0]=3 836 B12R1.41 CNCc1cc(cc(c1)OC)C 270004a_106832991635_100000101404 [1,1,0,0,0,0|1,0,0]=3 837 B12R1.41 CNCc1cc(cc(c1)OC)Cl 207a_100102657272_100000087488 [1,1,0,0,0,0|2,0,0]=4 838 B12R1.41 CNCc1cc(cc(c1)OC)Cl 2230a_106744500063_200000210301 [1,1,0,0,0,0|2,0,0]=4 839 B12R1.41 CNCc1cc(cc(c1)OC)Cl 2230a_106832991635_100010188059 [1,1,0,0,0,0|2,0,0]=4 840 B12R1.41 CNCc1cc(cc(c1)OC)Cl 26a_100102657272_100000051430 [1,1,0,0,0,0|2,0,0]=4 841 B12R1.41 CNCc1cc(cc(c1)OC)Cl 270004a_106832991635_100000087488 [1,1,0,0,0,0|2,0,0]=4 842 B12R1.41 CNCc1cc(cc(c1)OC)Cl 34a_100102657272_100010188059 [1,1,0,0,0,0|2,0,0]=4 843 B12R1.41 CNCc1cc(cc(c1)OC)Cl 34a_106744500063_200000210301 [1,1,0,0,0,0|2,0,0]=4 844 B12R1.41 CNCc1cc(cc(c1)OC)Cl 7a_106832991635_100010188059 [1,1,0,0,0,0|2,0,0]=4 845 B12R1.41 CNCc1cc(cc(c1)OC)F 207a_100102657272_100011934815 [1,1,0,0,0,0|2,0,0]=4 846 B12R1.41 CNCc1cc(cc(c1)OC)F 2230a_100000696013_200000210301 [1,1,0,0,0,0|2,0,0]=4 847 B12R1.41 CNCc1cc(cc(c1)OC)F 2230a_106832991635_100011934817 [1,1,0,0,0,0|2,0,0]=4 848 B12R1.41 CNCc1cc(cc(c1)OC)F 270004a_106832991635_100011934815 [1,1,0,0,0,0|2,0,0]=4 849 B12R1.41 CNCc1cc(cc(c1)OC)F 34a_100000696013_200000210301 [1,1,0,0,0,0|2,0,0]=4 850 B12R1.41 CNCc1cc(cc(c1)OC)F 34a_100102657272_100011934817 [1,1,0,0,0,0|2,0,0]=4 851 B12R1.41 CNCc1cc(cc(c1)OC)F 7a_106832991635_100011934817 [1,1,0,0,0,0|2,0,0]=4 852 B12R1.41 CNCc1cc(cc(c1)OC)O 207a_100102657272_100009856911 [1,1,0,0,0,0|1,0,0]=3 853 B12R1.41 CNCc1cc(cc(c1)OC)O 270004a_106832991635_100009856911 [1,1,0,0,0,0|1,0,0]=3 854 B12R1.41 CNCc1cc(cc(c1)SC)C 207a_100102657272_200010986840 [1,1,0,0,0,0|1,1,0]=4 855 B12R1.41 CNCc1cc(cc(c1)SC)C 269862a_106832991636_200010986840 [1,1,0,0,0,0|1,1,0]=4 856 B12R1.41 CNCc1cc(cc(c1)SC)C 270004a_106832991635_200010986840 [1,1,0,0,0,0|1,1,0]=4 857 B12R1.41 CNCc1cc(nc(c1)OC)C 2230a_106832991635_200012183585 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.41 CNCc1cc(nc(c1)OC)C 34a_100102657272_200012183585 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.41 CNCc1cc(nc(c1)OC)C 7a_106832991635_200012183585 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.41 COCc1cc(cc(c1)OC)Br 34a_100009995317_200000210301 [1,1,0,0,0,0|1,0,0]=3 861 B12R1.41 COCc1cc(cc(c1)OC)Br 34a_100138415774_100010162483 [1,1,0,0,0,0|1,0,0]=3 862 B12R1.41 COCc1cc(cc(c1)OC)Br 7a_100009995317_200000210301 [1,1,0,0,0,0|1,0,0]=3 863 B12R1.41 COCc1cc(cc(c1)OC)C 34a_100009863105_200000210301 [1,1,0,0,0,0|0,0,0]=2 864 B12R1.41 COCc1cc(cc(c1)OC)C 7a_100009863105_200000210301 [1,1,0,0,0,0|0,0,0]=2 865 B12R1.41 COCc1cc(cc(c1)OC)Cl 34a_100000087487_200000210301 [1,1,0,0,0,0|1,0,0]=3 866 B12R1.41 COCc1cc(cc(c1)OC)Cl 34a_100138415774_100010188059 [1,1,0,0,0,0|1,0,0]=3 867 B12R1.41 COCc1cc(cc(c1)OC)Cl 7a_100000087487_200000210301 [1,1,0,0,0,0|1,0,0]=3 868 B12R1.41 COCc1cc(cc(c1)OC)F 34a_100011934816_200000210301 [1,1,0,0,0,0|1,0,0]=3 869 B12R1.41 COCc1cc(cc(c1)OC)F 34a_100138415774_100011934817 [1,1,0,0,0,0|1,0,0]=3 870 B12R1.41 COCc1cc(cc(c1)OC)F 7a_100011934816_200000210301 [1,1,0,0,0,0|1,0,0]=3 871 B12R1.41 COCc1cc(cc(c1)OC)N 34a_100012182899_200000210301 [1,1,0,0,0,0|1,0,0]=3 872 B12R1.41 COCc1cc(cc(c1)SC)F 62a_100012630430_200000210301 [1,1,0,0,0,0|1,1,0]=4 873 B12R1.41 COCc1cc(cc(c1)SC)F 62a_200000210301_100012630430 [1,1,0,0,0,0|1,1,0]=4 874 B12R1.41 COCc1cc(cc(c1)S[13CH3])F 62a_100012630430_200025704644 [1,1,0,0,0,0|1,1,0]=4 875 B12R1.41 COCc1cc(cc(c1)S[13CH3])F 62a_200025704644_100012630430 [1,1,0,0,0,0|1,1,0]=4 876 B12R1.41 COCc1cc(nc(c1)OC)C 34a_100138415774_200012183585 [1,1,0,0,0,0|1,0,0]=3 877 B12R1.41 COc1cc(cc(c1)CC#N)O 271570a_203496583355_100010146821 [1,1,0,0,0,0|1,0,1]=4 878 B12R1.41 COc1cc(cc(c1)CN[13CH3])Cl 2230a_106744500063_200025704644 [1,1,0,0,0,0|2,0,0]=4 879 B12R1.41 COc1cc(cc(c1)CN[13CH3])Cl 34a_106744500063_200025704644 [1,1,0,0,0,0|2,0,0]=4 880 B12R1.41 COc1cc(cc(c1)CN[13CH3])F 2230a_100000696013_200025704644 [1,1,0,0,0,0|2,0,0]=4 881 B12R1.41 COc1cc(cc(c1)CN[13CH3])F 34a_100000696013_200025704644 [1,1,0,0,0,0|2,0,0]=4 882 B12R1.41 COc1cc(cc(c1)CO[13CH3])Br 34a_100009995317_200025704644 [1,1,0,0,0,0|1,0,0]=3 883 B12R1.41 COc1cc(cc(c1)CO[13CH3])Br 7a_100009995317_200025704644 [1,1,0,0,0,0|1,0,0]=3 884 B12R1.41 COc1cc(cc(c1)CO[13CH3])C 34a_100009863105_200025704644 [1,1,0,0,0,0|0,0,0]=2 885 B12R1.41 COc1cc(cc(c1)CO[13CH3])C 7a_100009863105_200025704644 [1,1,0,0,0,0|0,0,0]=2 886 B12R1.41 COc1cc(cc(c1)CO[13CH3])Cl 34a_100000087487_200025704644 [1,1,0,0,0,0|1,0,0]=3 887 B12R1.41 COc1cc(cc(c1)CO[13CH3])Cl 7a_100000087487_200025704644 [1,1,0,0,0,0|1,0,0]=3 888 B12R1.41 COc1cc(cc(c1)CO[13CH3])F 34a_100011934816_200025704644 [1,1,0,0,0,0|1,0,0]=3 889 B12R1.41 COc1cc(cc(c1)CO[13CH3])F 7a_100011934816_200025704644 [1,1,0,0,0,0|1,0,0]=3 890 B12R1.41 COc1cc(cc(c1)CO[13CH3])N 34a_100012182899_200025704644 [1,1,0,0,0,0|1,0,0]=3 891 B12R1.41 COc1cc(cc(c1)CSC)Br 62a_100010162483_200000210301 [1,1,0,0,0,0|1,1,0]=4 892 B12R1.41 COc1cc(cc(c1)CSC)Br 62a_200000210301_100010162483 [1,1,0,0,0,0|1,1,0]=4 893 B12R1.41 COc1cc(cc(c1)CSC)Cl 62a_100010188059_200000210301 [1,1,0,0,0,0|1,1,0]=4 894 B12R1.41 COc1cc(cc(c1)CSC)Cl 62a_200000210301_100010188059 [1,1,0,0,0,0|1,1,0]=4 895 B12R1.41 COc1cc(cc(c1)CSC)F 62a_100011934817_200000210301 [1,1,0,0,0,0|1,1,0]=4 896 B12R1.41 COc1cc(cc(c1)CSC)F 62a_200000210301_100011934817 [1,1,0,0,0,0|1,1,0]=4 897 B12R1.41 COc1cc(cc(c1)CS[13CH3])Br 62a_100010162483_200025704644 [1,1,0,0,0,0|1,1,0]=4 898 B12R1.41 COc1cc(cc(c1)CS[13CH3])Br 62a_200025704644_100010162483 [1,1,0,0,0,0|1,1,0]=4 899 B12R1.41 COc1cc(cc(c1)CS[13CH3])Cl 62a_100010188059_200025704644 [1,1,0,0,0,0|1,1,0]=4 900 B12R1.41 COc1cc(cc(c1)CS[13CH3])Cl 62a_200025704644_100010188059 [1,1,0,0,0,0|1,1,0]=4 901 B12R1.41 COc1cc(cc(c1)CS[13CH3])F 62a_100011934817_200025704644 [1,1,0,0,0,0|1,1,0]=4 902 B12R1.41 COc1cc(cc(c1)CS[13CH3])F 62a_200025704644_100011934817 [1,1,0,0,0,0|1,1,0]=4 903 B12R1.41 COc1cc(cc(c1)NCF)Br 34a_100000750983_100015361967 [1,1,0,0,0,0|2,0,0]=4 904 B12R1.41 COc1cc(cc(c1)NCF)Br 7a_100000750983_100015361967 [1,1,0,0,0,0|2,0,0]=4 905 B12R1.41 COc1cc(cc(c1)NCF)C 34a_100012001870_100015361967 [1,1,0,0,0,0|1,0,0]=3 906 B12R1.41 COc1cc(cc(c1)NCF)C 7a_100012001870_100015361967 [1,1,0,0,0,0|1,0,0]=3 907 B12R1.41 COc1cc(cc(c1)NCF)Cl 34a_100000051436_100015361967 [1,1,0,0,0,0|2,0,0]=4 908 B12R1.41 COc1cc(cc(c1)NCF)Cl 7a_100000051436_100015361967 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.41 COc1cc(cc(c1)NCF)F 34a_100000687699_100015361967 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.41 COc1cc(cc(c1)NCF)F 7a_100000687699_100015361967 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.41 COc1cc(cc(c1)NCF)O 34a_200000692186_100015361967 [1,1,0,0,0,0|1,0,0]=3 912 B12R1.41 COc1cc(cc(c1)OCF)Br 34a_100010068927_100015361967 [1,1,0,0,0,0|1,0,0]=3 913 B12R1.41 COc1cc(cc(c1)OCF)Br 7a_100010068927_100015361967 [1,1,0,0,0,0|1,0,0]=3 914 B12R1.41 COc1cc(cc(c1)OCF)C 34a_100011216608_100015361967 [1,1,0,0,0,0|0,0,0]=2 915 B12R1.41 COc1cc(cc(c1)OCF)C 7a_100011216608_100015361967 [1,1,0,0,0,0|0,0,0]=2 916 B12R1.41 COc1cc(cc(c1)OCF)Cl 34a_100000051430_100015361967 [1,1,0,0,0,0|1,0,0]=3 917 B12R1.41 COc1cc(cc(c1)OCF)Cl 7a_100000051430_100015361967 [1,1,0,0,0,0|1,0,0]=3 918 B12R1.41 COc1cc(cc(c1)OCF)F 34a_100011369910_100015361967 [1,1,0,0,0,0|1,0,0]=3 919 B12R1.41 COc1cc(cc(c1)OCF)F 7a_100011369910_100015361967 [1,1,0,0,0,0|1,0,0]=3 920 B12R1.41 COc1cc(cc(c1)OCF)N 34a_200000692186_100015361967 [1,1,0,0,0,0|1,0,0]=3 921 B12R1.41 COc1cc(cc(c1)OCF)N 7a_200000692186_100015361967 [1,1,0,0,0,0|1,0,0]=3 922 B12R1.41 COc1cc(cc(c1)SCF)Br 62a_100010141301_100015361967 [1,1,0,0,0,0|1,1,0]=4 923 B12R1.41 COc1cc(cc(c1)SCF)Br 62a_100015361967_100010141301 [1,1,0,0,0,0|1,1,0]=4 924 B12R1.41 COc1cc(cc(c1)SCF)C 62a_100015361967_100010187550 [1,1,0,0,0,0|0,1,0]=3 925 B12R1.41 COc1cc(cc(c1)SCF)Cl 62a_100010147680_100015361967 [1,1,0,0,0,0|1,1,0]=4 926 B12R1.41 COc1cc(cc(c1)SCF)Cl 62a_100015361967_100010147680 [1,1,0,0,0,0|1,1,0]=4 927 B12R1.41 COc1cc(cc(c1)SCF)F 62a_100011934182_100015361967 [1,1,0,0,0,0|1,1,0]=4 928 B12R1.41 COc1cc(cc(c1)SCF)F 62a_100015361967_100011934182 [1,1,0,0,0,0|1,1,0]=4 929 B12R1.41 COc1cc(cc(c1)SCF)N 62a_100000750983_100015361967 [1,1,0,0,0,0|1,1,0]=4 930 B12R1.41 COc1cc(cc(c1)SCF)N 62a_100015361967_100000750983 [1,1,0,0,0,0|1,1,0]=4 931 B12R1.41 COc1cc(cc(c1)SCF)O 62a_100015361967_100010068927 [1,1,0,0,0,0|0,1,0]=3 932 B12R1.41 COc1cc(cc(n1)C)CSC 62a_200000210301_200012183585 [1,1,0,0,0,0|1,1,0]=4 933 B12R1.41 COc1cc(cc(n1)C)CSC 62a_200012183585_200000210301 [1,1,0,0,0,0|1,1,0]=4 934 B12R1.41 COc1cc(cc(n1)C)CS[13CH3] 62a_200012183585_200025704644 [1,1,0,0,0,0|1,1,0]=4 935 B12R1.41 COc1cc(cc(n1)C)CS[13CH3] 62a_200025704644_200012183585 [1,1,0,0,0,0|1,1,0]=4 936 B12R1.41 COc1cc(cc(n1)C)SCF 62a_100010067692_100015361967 [1,1,0,0,0,0|1,1,0]=4 937 B12R1.41 COc1cc(cc(n1)C)SCF 62a_100015361967_100010067692 [1,1,0,0,0,0|1,1,0]=4 938 B12R1.41 COc1cc(cc(n1)SCF)C 62a_100009856763_100015361967 [1,1,0,0,0,0|1,1,0]=4 939 B12R1.41 COc1cc(cc(n1)SCF)C 62a_100015361967_100009856763 [1,1,0,0,0,0|1,1,0]=4 940 B12R1.41 COc1cc(nc(c1)SCF)C 62a_100015361967_200009849800 [1,1,0,0,0,0|1,1,0]=4 941 B12R1.41 COc1cc(nc(c1)SCF)C 62a_200009849800_100015361967 [1,1,0,0,0,0|1,1,0]=4 942 B12R1.41 CSc1cc(cc(c1)SCF)C 62a_100015361967_200010709730 [1,1,0,0,0,0|0,2,0]=4 943 B12R1.41 CSc1cc(cc(c1)SCF)C 62a_200010709730_100015361967 [1,1,0,0,0,0|0,2,0]=4 944 B12R1.41 Cc1cc(cc(c1)OCF)C#N 34a_100009849966_100015361967 [1,1,0,0,0,0|2,0,0]=4 945 B12R1.41 Cc1cc(cc(c1)OCF)C#N 7a_100009849966_100015361967 [1,1,0,0,0,0|2,0,0]=4 946 B12R1.235 CCc1cc(cc(c1N)CC)O 271570a_203496583355_100011216614 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.235 CCc1cc(cc(c1O)CC)C 271570a_203496583355_100010203090 [1,1,0,0,0,0|2,0,0]=4 948 B12R1.235 COc1cc(cc(c1F)OC)Br 34a_200015524394_200000210301 [1,1,0,0,0,0|1,0,0]=3 949 B12R1.235 COc1cc(cc(c1F)OC)Br 7a_200015524394_200000210301 [1,1,0,0,0,0|1,0,0]=3 950 B12R1.235 COc1cc(cc(c1F)OC)O 271570a_203496583355_100015304952 [1,1,0,0,0,0|0,0,0]=2 951 B12R1.235 COc1cc(cc(c1F)O[13CH3])Br 34a_200015524394_200025704644 [1,1,0,0,0,0|1,0,0]=3 952 B12R1.235 COc1cc(cc(c1F)O[13CH3])Br 7a_200015524394_200025704644 [1,1,0,0,0,0|1,0,0]=3 953 B12R1.235 COc1cc(cc(c1N)C#N)O 271570a_203496583355_200010734157 [1,1,0,0,0,0|2,0,0]=4 954 B12R1.235 COc1cc(cc(c1N)CO)O 271570a_203496583355_100010235085 [1,1,0,0,0,0|2,0,0]=4 955 B12R1.235 COc1cc(cc(c1N)SC)F 62a_100011004115_200000210301 [1,1,0,0,0,0|1,1,0]=4 956 B12R1.235 COc1cc(cc(c1N)SC)F 62a_200000210301_100011004115 [1,1,0,0,0,0|1,1,0]=4 957 B12R1.235 COc1cc(cc(c1N)S[13CH3])F 62a_100011004115_200025704644 [1,1,0,0,0,0|1,1,0]=4 958 B12R1.235 COc1cc(cc(c1N)S[13CH3])F 62a_200025704644_100011004115 [1,1,0,0,0,0|1,1,0]=4 959 B12R1.235 COc1cc(cc(c1O)CO)O 271570a_203496583355_100000185604 [1,1,0,0,0,0|2,0,0]=4 960 B12R1.235 COc1cc(cc(c1O)OC)O 271570a_203496583355_100000691893 [1,1,0,0,0,0|0,0,0]=2 961 B12R1.235 COc1cc(cc(c1O)SC)F 62a_200000210301_200010391102 [1,1,0,0,0,0|1,1,0]=4 962 B12R1.235 COc1cc(cc(c1O)S[13CH3])F 62a_200025704644_200010391102 [1,1,0,0,0,0|1,1,0]=4 963 B12R1.235 COc1nc(nc(c1N)OC)O 271570a_203496583355_100000095612 [1,1,0,0,0,0|2,0,0]=4 964 B12R1.235 COc1nc(nc(c1O)OC)C 271570a_203496583355_100010893122 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.300 C=Cc1cc(c(c(c1)OC)F)C 271570a_100011290941_100010271686 [1,1,0,0,0,0|1,0,1]=4 966 B12R1.300 C=Cc1cc(c(c(c1)OC)F)O 271570a_100011290941_200015524394 [1,1,0,0,0,0|1,0,1]=4 967 B12R1.300 C=Cc1cc(c(c(c1)OC)N)C 271570a_100011290941_100000741850 [1,1,0,0,0,0|1,0,1]=4 968 B12R1.300 C=Cc1cc(cc(c1N)C)OC 271570a_100011290941_200011010636 [1,1,0,0,0,0|1,0,1]=4 969 B12R1.300 CCc1cc(cc(c1N)C)SC 62a_200000186424_200000210301 [1,1,0,0,0,0|1,1,0]=4 970 B12R1.300 CCc1cc(cc(c1N)C)SC 62a_200000210301_200000186424 [1,1,0,0,0,0|1,1,0]=4 971 B12R1.300 CCc1cc(cc(c1N)C)S[13CH3] 62a_200000186424_200025704644 [1,1,0,0,0,0|1,1,0]=4 972 B12R1.300 CCc1cc(cc(c1N)C)S[13CH3] 62a_200025704644_200000186424 [1,1,0,0,0,0|1,1,0]=4 973 B12R1.300 CCc1cc(cc(c1O)C)SC 62a_200000210301_100010659108 [1,1,0,0,0,0|1,1,0]=4 974 B12R1.300 CCc1cc(cc(c1O)C)S[13CH3] 62a_200025704644_100010659108 [1,1,0,0,0,0|1,1,0]=4 975 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 976 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 977 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 978 B12R1.300 CNc1cc(cc(c1O)Br)OC 34a_200010008348_200000210301 [1,1,0,0,0,0|2,0,0]=4 979 B12R1.300 COc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000751510 [1,1,0,0,0,0|2,0,0]=4 980 B12R1.300 COc1cc(c(c(c1)N[13CH3])O)Br 34a_200010008348_200025704644 [1,1,0,0,0,0|2,0,0]=4 981 B12R1.300 COc1cc(c(c(c1)OC)O)F 271570a_203496583355_200009812871 [1,1,0,0,0,0|1,0,0]=3 982 B12R1.300 COc1cc(c(c(c1)SC)N)C 62a_200000210301_200011010636 [1,1,0,0,0,0|0,1,0]=3 983 B12R1.300 COc1cc(c(c(c1)SC)N)C 62a_200011010636_200000210301 [1,1,0,0,0,0|0,1,0]=3 984 B12R1.300 COc1cc(c(c(c1)SC)N)N 62a_100010194281_200000210301 [1,1,0,0,0,0|1,1,0]=4 985 B12R1.300 COc1cc(c(c(c1)SC)O)N 62a_200000210301_200010008348 [1,1,0,0,0,0|1,1,0]=4 986 B12R1.300 COc1cc(c(c(c1)S[13CH3])N)C 62a_200011010636_200025704644 [1,1,0,0,0,0|0,1,0]=3 987 B12R1.300 COc1cc(c(c(c1)S[13CH3])N)C 62a_200025704644_200011010636 [1,1,0,0,0,0|0,1,0]=3 988 B12R1.300 COc1cc(c(c(c1)S[13CH3])N)N 62a_100010194281_200025704644 [1,1,0,0,0,0|1,1,0]=4 989 B12R1.300 COc1cc(c(c(c1)S[13CH3])O)N 62a_200025704644_200010008348 [1,1,0,0,0,0|1,1,0]=4 990 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 2230a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 991 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 34a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 992 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 7a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 993 B12R1.300 COc1cc(cc(c1F)C)SC 62a_100010271686_200000210301 [1,1,0,0,0,0|0,1,0]=3 994 B12R1.300 COc1cc(cc(c1F)C)SC 62a_200000210301_100010271686 [1,1,0,0,0,0|0,1,0]=3 995 B12R1.300 COc1cc(cc(c1F)C)S[13CH3] 62a_100010271686_200025704644 [1,1,0,0,0,0|0,1,0]=3 996 B12R1.300 COc1cc(cc(c1F)C)S[13CH3] 62a_200025704644_100010271686 [1,1,0,0,0,0|0,1,0]=3 997 B12R1.300 COc1cc(cc(c1F)F)SC 62a_100011218012_200000210301 [1,1,0,0,0,0|1,1,0]=4 998 B12R1.300 COc1cc(cc(c1F)F)SC 62a_200000210301_100011218012 [1,1,0,0,0,0|1,1,0]=4 999 B12R1.300 COc1cc(cc(c1F)F)S[13CH3] 62a_100011218012_200025704644 [1,1,0,0,0,0|1,1,0]=4 1000 B12R1.300 COc1cc(cc(c1F)F)S[13CH3] 62a_200025704644_100011218012 [1,1,0,0,0,0|1,1,0]=4 1001 B12R1.300 COc1cc(cc(c1F)O)SC 62a_200000210301_200015524394 [1,1,0,0,0,0|0,1,0]=3 1002 B12R1.300 COc1cc(cc(c1F)O)SC 62a_200015524394_200000210301 [1,1,0,0,0,0|0,1,0]=3 1003 B12R1.300 COc1cc(cc(c1F)O)S[13CH3] 62a_200015524394_200025704644 [1,1,0,0,0,0|0,1,0]=3 1004 B12R1.300 COc1cc(cc(c1F)O)S[13CH3] 62a_200025704644_200015524394 [1,1,0,0,0,0|0,1,0]=3 1005 B12R1.300 COc1cc(cc(c1N)C)SC 62a_100000741850_200000210301 [1,1,0,0,0,0|0,1,0]=3 1006 B12R1.300 COc1cc(cc(c1N)C)SC 62a_200000210301_100000741850 [1,1,0,0,0,0|0,1,0]=3 1007 B12R1.300 COc1cc(cc(c1N)C)S[13CH3] 62a_100000741850_200025704644 [1,1,0,0,0,0|0,1,0]=3 1008 B12R1.300 COc1cc(cc(c1N)C)S[13CH3] 62a_200025704644_100000741850 [1,1,0,0,0,0|0,1,0]=3 1009 B12R1.300 COc1cc(cc(c1O)O)C#N 271570a_203496583355_100000188612 [1,1,0,0,0,0|2,0,0]=4 1010 B12R1.300 COc1cc(cc(c1O)O)C=O 271570a_203496583355_100000184534 [1,1,0,0,0,0|2,0,0]=4 1011 B12R1.300 COc1cc(cc(c1O)O)CO 271570a_203496583355_200000022573 [1,1,0,0,0,0|2,0,0]=4 1012 B12R1.300 COc1cc(cc(c1O)O)SC 62a_200000210301_200159242197 [1,1,0,0,0,0|0,1,0]=3 1013 B12R1.300 COc1cc(cc(c1O)O)S[13CH3] 62a_200025704644_200159242197 [1,1,0,0,0,0|0,1,0]=3 1014 B14R1.345 C=C(C)c1cc(cc(c1)C(=O)C)OC 271570a_100000694244_100010713257 [0,2,0,0,0,0|2,0,0]=4 1015 B14R1.345 CC(C)c1cc(cc(c1)C(C)C)O[13CH3] 34a_100000080679_200025704644 [0,2,0,0,0,0|2,0,0]=4 1016 B14R1.345 CC(C)c1cc(cc(c1)C(C)C)O[13CH3] 7a_100000080679_200025704644 [0,2,0,0,0,0|2,0,0]=4 1017 B14R1.345 COc1cc(cc(c1)C(C)C)C(C)C 34a_100000080679_200000210301 [0,2,0,0,0,0|2,0,0]=4 1018 B14R1.345 COc1cc(cc(c1)C(C)C)C(C)C 7a_100000080679_200000210301 [0,2,0,0,0,0|2,0,0]=4 1019 B14R1.357 C=Cc1cc(cc(c1)C(=O)OC)OC 271570a_100011290941_200010233337 [0,2,0,0,0,0|1,0,1]=4 1020 B14R1.357 CCC(=O)c1cc(cc(c1)OC)OC 1458a_100000210870_100000210202 [0,2,0,0,0,0|1,0,0]=3 1021 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 11a_106832991635_100000210870 [0,2,0,0,0,0|1,0,0]=3 1022 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 1626a_100102657272_100000210870 [0,2,0,0,0,0|1,0,0]=3 1023 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 240690a_100102657272_100000210870 [0,2,0,0,0,0|1,0,0]=3 1024 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 527a_100102657272_100000210870 [0,2,0,0,0,0|1,0,0]=3 1025 B14R1.357 CNC(C)c1cc(cc(c1)OC)OC 2230a_100159265467_200000210301 [0,2,0,0,0,0|1,0,0]=3 1026 B14R1.357 CNC(C)c1cc(cc(c1)OC)OC 269862a_106832991636_100011215295 [0,2,0,0,0,0|1,0,0]=3 1027 B14R1.357 CNc1cc(nc(c1)C(=O)OC)OC 27a_100102657272_100010136341 [0,2,0,0,0,0|2,0,0]=4 1028 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 34a_100000076322_200000210301 [0,2,0,0,0,0|0,0,0]=2 1029 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 7a_100000076322_200000210301 [0,2,0,0,0,0|0,0,0]=2 1030 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 34a_100000076322_200025704644 [0,2,0,0,0,0|0,0,0]=2 1031 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 7a_100000076322_200025704644 [0,2,0,0,0,0|0,0,0]=2 1032 B14R1.357 COC(=O)c1cc(cc(c1)SC)OC 62a_200000210301_200010233337 [0,2,0,0,0,0|0,1,0]=3 1033 B14R1.357 COC(=O)c1cc(cc(c1)SC)OC 62a_200010233337_200000210301 [0,2,0,0,0,0|0,1,0]=3 1034 B14R1.357 COC(=O)c1cc(cc(c1)S[13CH3])OC 62a_200010233337_200025704644 [0,2,0,0,0,0|0,1,0]=3 1035 B14R1.357 COC(=O)c1cc(cc(c1)S[13CH3])OC 62a_200025704644_200010233337 [0,2,0,0,0,0|0,1,0]=3 1036 B14R1.357 COC(=O)c1cc(cc(n1)OC)SC 62a_100010136341_200000210301 [0,2,0,0,0,0|1,1,0]=4 1037 B14R1.357 COC(=O)c1cc(cc(n1)OC)SC 62a_200000210301_100010136341 [0,2,0,0,0,0|1,1,0]=4 1038 B14R1.357 COC(=O)c1cc(cc(n1)OC)S[13CH3] 62a_100010136341_200025704644 [0,2,0,0,0,0|1,1,0]=4 1039 B14R1.357 COC(=O)c1cc(cc(n1)OC)S[13CH3] 62a_200025704644_100010136341 [0,2,0,0,0,0|1,1,0]=4 1040 B14R1.357 COC(=O)c1cc(cc(n1)SC)OC 62a_100010161163_200000210301 [0,2,0,0,0,0|1,1,0]=4 1041 B14R1.357 COC(=O)c1cc(cc(n1)SC)OC 62a_200000210301_100010161163 [0,2,0,0,0,0|1,1,0]=4 1042 B14R1.357 COC(=O)c1cc(cc(n1)S[13CH3])OC 62a_100010161163_200025704644 [0,2,0,0,0,0|1,1,0]=4 1043 B14R1.357 COC(=O)c1cc(cc(n1)S[13CH3])OC 62a_200025704644_100010161163 [0,2,0,0,0,0|1,1,0]=4 1044 B14R1.357 COC(=O)c1cc(nc(c1)SC)OC 62a_100009994165_200000210301 [0,2,0,0,0,0|1,1,0]=4 1045 B14R1.357 COC(=O)c1cc(nc(c1)SC)OC 62a_200000210301_100009994165 [0,2,0,0,0,0|1,1,0]=4 1046 B14R1.357 COC(=O)c1cc(nc(c1)S[13CH3])OC 62a_100009994165_200025704644 [0,2,0,0,0,0|1,1,0]=4 1047 B14R1.357 COC(=O)c1cc(nc(c1)S[13CH3])OC 62a_200025704644_100009994165 [0,2,0,0,0,0|1,1,0]=4 1048 B14R1.357 COc1cc(cc(c1)C(=O)CF)OC 1458a_100000210870_100015361967 [0,2,0,0,0,0|1,0,0]=3 1049 B14R1.357 COc1cc(cc(c1)C(C)N[13CH3])OC 2230a_100159265467_200025704644 [0,2,0,0,0,0|1,0,0]=3 1050 B14R1.362 C=C(C)c1cc(c(c(c1)OC)F)OC 271570a_100000694244_100015304952 [0,2,0,0,0,0|1,0,0]=3 1051 B14R1.362 C=C(C)c1cc(c(c(c1)OC)O)OC 271570a_100000694244_100000691893 [0,2,0,0,0,0|1,0,0]=3 1052 B14R1.362 COc1cc(cc(c1Br)OC)C(=O)C 1458a_100000212323_200000210301 [0,2,0,0,0,0|1,0,0]=3 1053 B14R1.362 COc1cc(cc(c1Br)OC)C(=O)[13CH3] 1458a_100000212323_200025704644 [0,2,0,0,0,0|1,0,0]=3 1054 B14R1.362 COc1cc(cc(c1C)OC)C(=O)C 1458a_100000211643_200000210301 [0,2,0,0,0,0|1,0,0]=3 1055 B14R1.362 COc1cc(cc(c1C)OC)C(=O)[13CH3] 1458a_100000211643_200025704644 [0,2,0,0,0,0|1,0,0]=3 1056 B14R1.362 COc1cc(cc(c1O)OC)C(=O)C 1458a_100000692901_200000210301 [0,2,0,0,0,0|1,0,0]=3 1057 B14R1.362 COc1cc(cc(c1O)OC)C(=O)[13CH3] 1458a_100000692901_200025704644 [0,2,0,0,0,0|1,0,0]=3 1058 B14R1.372 CNc1cc(cc(c1)S(=O)(=O)C)OC 34a_100000729793_200000210301 [0,2,0,0,0,0|1,1,0]=4 1059 B14R1.372 CNc1cc(cc(c1)S(=O)(=O)C)OC 7a_100000729793_200000210301 [0,2,0,0,0,0|1,1,0]=4 1060 B14R1.372 COc1cc(cc(c1)C(F)(F)F)OC 34a_100000061645_200000210301 [0,2,0,0,0,0|2,0,0]=4 1061 B14R1.372 COc1cc(cc(c1)C(F)(F)F)OC 7a_100000061645_200000210301 [0,2,0,0,0,0|2,0,0]=4 1062 B14R1.372 COc1cc(cc(c1)C(F)(F)F)O[13CH3] 34a_100000061645_200025704644 [0,2,0,0,0,0|2,0,0]=4 1063 B14R1.372 COc1cc(cc(c1)C(F)(F)F)O[13CH3] 7a_100000061645_200025704644 [0,2,0,0,0,0|2,0,0]=4 1064 B14R1.372 COc1cc(cc(c1)S(=O)(=O)C)N[13CH3] 34a_100000729793_200025704644 [0,2,0,0,0,0|1,1,0]=4 1065 B14R1.372 COc1cc(cc(c1)S(=O)(=O)C)N[13CH3] 7a_100000729793_200025704644 [0,2,0,0,0,0|1,1,0]=4 1066 B14R1.3212 CC=Cc1cc(cc(c1)C(=O)C)OC 271570a_100016259895_100010713257 [0,2,0,0,0,0|2,0,0]=4 1067 B14R1.3212 CCSc1cc(cc(c1)C(=O)C)OC 62a_100000210202_100010713257 [0,2,0,0,0,0|1,1,0]=4 1068 B14R1.3212 CCSc1cc(cc(c1)C(=O)C)OC 62a_100010713257_100000210202 [0,2,0,0,0,0|1,1,0]=4 1069 B14R1.3212 COc1cc(cc(c1)C(=O)C)SCF 62a_100010713257_100015361967 [0,2,0,0,0,0|1,1,0]=4 1070 B14R1.3212 COc1cc(cc(c1)C(=O)C)SCF 62a_100015361967_100010713257 [0,2,0,0,0,0|1,1,0]=4 1071 B14R1.379 COc1cc(cc(c1)OC(C)C)OC 34a_100000181322_100000210206 [0,2,0,0,0,0|0,0,0]=2 1072 B14R1.379 COc1cc(cc(c1)OC(C)C)OC 7a_100000181322_100000210206 [0,2,0,0,0,0|0,0,0]=2 1073 B14R1.379 COc1cc(cc(c1)OC)C=C(C)C 271570a_100102525489_100000685218 [0,2,0,0,0,0|1,0,0]=3 1074 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100000070787_100011215721 [0,2,0,0,0,0|1,0,0]=3 1075 B14R1.379 COc1cc(cc(c1)OC)CC(=O)C 1458a_100011214962_200000210301 [0,2,0,0,0,0|1,0,0]=3 1076 B14R1.379 COc1cc(cc(c1)OC)CC(=O)[13CH3] 1458a_100011214962_200025704644 [0,2,0,0,0,0|1,0,0]=3 1077 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 2230a_100000207622_200000210301 [0,2,0,0,0,0|1,0,0]=3 1078 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 2230a_100102631434_100011215721 [0,2,0,0,0,0|1,0,0]=3 1079 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 269982a_100000207622_200000210301 [0,2,0,0,0,0|1,0,0]=3 1080 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 269982a_100102631434_100011215721 [0,2,0,0,0,0|1,0,0]=3 1081 B14R1.379 COc1cc(cc(c1)OC)CN(C)C 270004a_100102631434_100000211681 [0,2,0,0,0,0|1,0,0]=3 1082 B14R1.379 COc1cc(cc(c1)OC)CN(C)[13CH3] 2230a_100000207622_200025704644 [0,2,0,0,0,0|1,0,0]=3 1083 B14R1.379 COc1cc(cc(c1)OC)CN(C)[13CH3] 269982a_100000207622_200025704644 [0,2,0,0,0,0|1,0,0]=3 1084 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 11a_100000210928_100015343762 [0,2,0,0,0,0|1,0,0]=3 1085 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 1626a_100000210928_100015343762 [0,2,0,0,0,0|1,0,0]=3 1086 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 22a_100000210928_100000070787 [0,2,0,0,0,0|1,0,0]=3 1087 B14R1.379 COc1cc(cc(c1)OC)NC(=O)C 527a_100000210928_100103153847 [0,2,0,0,0,0|1,0,0]=3 1088 B14R1.379 COc1cc(cc(c1)OC)NC(C)C 2230a_100000210928_100000210206 [0,2,0,0,0,0|1,0,0]=3 1089 B14R1.379 COc1cc(cc(c1)OC)NC(C)C 34a_100000210928_100000210206 [0,2,0,0,0,0|1,0,0]=3 1090 B14R1.379 COc1cc(cc(c1)SC(C)C)OC 62a_100000210206_100000685218 [0,2,0,0,0,0|0,1,0]=3 1091 B14R1.379 COc1cc(cc(c1)SC(C)C)SC 62a_100000210206_200010709149 [0,2,0,0,0,0|0,2,0]=4 1092 B14R1.379 COc1cc(cc(c1)SC(C)C)SC 62a_200010709149_100000210206 [0,2,0,0,0,0|0,2,0]=4 1093 B14R1.379 COc1cc(cc(c1)SC)C=C(C)C 271570a_100102525489_200010709149 [0,2,0,0,0,0|1,1,0]=4 1094 B14R1.379 COc1cc(nc(c1)OC)C=C(C)C 271570a_100102525489_100010008354 [0,2,0,0,0,0|2,0,0]=4 1095 B14R1.379 COc1cc(nc(c1)SC(C)C)OC 62a_100000210206_100010008354 [0,2,0,0,0,0|1,1,0]=4 1096 B14R1.379 COc1cc(nc(c1)SC(C)C)OC 62a_100010008354_100000210206 [0,2,0,0,0,0|1,1,0]=4 1097 B14R1.763 C#CCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000038162 [0,2,0,0,0,0|1,0,0]=3 1098 B14R1.763 C#CCNc1cc(cc(c1)OC)OC 34a_100000210928_100000184674 [0,2,0,0,0,0|1,0,0]=3 1099 B14R1.763 C#CCOc1cc(cc(c1)OC)OC 34a_100000181322_100000184674 [0,2,0,0,0,0|0,0,0]=2 1100 B14R1.763 C#CCOc1cc(cc(c1)OC)OC 7a_100000181322_100000038162 [0,2,0,0,0,0|0,0,0]=2 1101 B14R1.763 C#CCSc1cc(cc(c1)OC)OC 62a_100000038162_100000685218 [0,2,0,0,0,0|0,1,0]=3 1102 B14R1.763 C#CCSc1cc(cc(c1)SC)OC 62a_100000038162_200010709149 [0,2,0,0,0,0|0,2,0]=4 1103 B14R1.763 C#CCSc1cc(cc(n1)OC)OC 62a_100000038162_100010008354 [0,2,0,0,0,0|1,1,0]=4 1104 B14R1.763 C=CCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000210623 [0,2,0,0,0,0|1,0,0]=3 1105 B14R1.763 C=CCNc1cc(cc(c1)OC)OC 34a_100000210928_100015514636 [0,2,0,0,0,0|1,0,0]=3 1106 B14R1.763 C=CCOc1cc(cc(c1)OC)OC 34a_100000181322_100015514636 [0,2,0,0,0,0|0,0,0]=2 1107 B14R1.763 C=CCOc1cc(cc(c1)OC)OC 7a_100000181322_100015514636 [0,2,0,0,0,0|0,0,0]=2 1108 B14R1.763 C=CCSc1cc(cc(c1)OC)OC 62a_100000210623_100000685218 [0,2,0,0,0,0|0,1,0]=3 1109 B14R1.763 C=CCSc1cc(cc(c1)SC)OC 62a_100000210623_200010709149 [0,2,0,0,0,0|0,2,0]=4 1110 B14R1.763 C=CCSc1cc(cc(c1)SC)OC 62a_200010709149_100000210623 [0,2,0,0,0,0|0,2,0]=4 1111 B14R1.763 C=CCSc1cc(cc(n1)OC)OC 62a_100000210623_100010008354 [0,2,0,0,0,0|1,1,0]=4 1112 B14R1.763 C=CCSc1cc(cc(n1)OC)OC 62a_100010008354_100000210623 [0,2,0,0,0,0|1,1,0]=4 1113 B14R1.763 CCCCc1cc(cc(c1)OC)OC 271570a_100020621405_100000685218 [0,2,0,0,0,0|1,0,0]=3 1114 B14R1.763 CCCCc1cc(cc(c1)SC)OC 271570a_100020621405_200010709149 [0,2,0,0,0,0|1,1,0]=4 1115 B14R1.763 CCCCc1cc(cc(n1)OC)OC 271570a_100020621405_100010008354 [0,2,0,0,0,0|2,0,0]=4 1116 B14R1.763 CCCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000210303 [0,2,0,0,0,0|1,0,0]=3 1117 B14R1.763 CCCNc1cc(cc(c1)OC)OC 34a_100000210928_100000210303 [0,2,0,0,0,0|1,0,0]=3 1118 B14R1.763 CCCOc1cc(cc(c1)OC)OC 34a_100000181322_100000210303 [0,2,0,0,0,0|0,0,0]=2 1119 B14R1.763 CCCOc1cc(cc(c1)OC)OC 7a_100000181322_100000210303 [0,2,0,0,0,0|0,0,0]=2 1120 B14R1.763 CCCSc1cc(cc(c1)OC)OC 62a_100000210303_100000685218 [0,2,0,0,0,0|0,1,0]=3 1121 B14R1.763 CCCSc1cc(cc(c1)SC)OC 62a_100000210303_200010709149 [0,2,0,0,0,0|0,2,0]=4 1122 B14R1.763 CCCSc1cc(cc(c1)SC)OC 62a_200010709149_100000210303 [0,2,0,0,0,0|0,2,0]=4 1123 B14R1.763 CCCSc1cc(cc(n1)OC)OC 62a_100000210303_100010008354 [0,2,0,0,0,0|1,1,0]=4 1124 B14R1.763 CCCSc1cc(cc(n1)OC)OC 62a_100010008354_100000210303 [0,2,0,0,0,0|1,1,0]=4 1125 B14R1.763 CCNCc1cc(cc(c1)OC)OC 207a_100015525214_100000211681 [0,2,0,0,0,0|1,0,0]=3 1126 B14R1.763 CCNCc1cc(cc(c1)OC)OC 2230a_100000737887_100000210202 [0,2,0,0,0,0|1,0,0]=3 1127 B14R1.763 CCNCc1cc(cc(c1)OC)OC 2230a_100015525214_100011215721 [0,2,0,0,0,0|1,0,0]=3 1128 B14R1.763 CCNCc1cc(cc(c1)OC)OC 270004a_100015525214_100000211681 [0,2,0,0,0,0|1,0,0]=3 1129 B14R1.763 CCNCc1cc(cc(c1)OC)OC 34a_100000737887_100000210202 [0,2,0,0,0,0|1,0,0]=3 1130 B14R1.763 CCOCc1cc(cc(c1)OC)OC 34a_100000700211_100000210202 [0,2,0,0,0,0|0,0,0]=2 1131 B14R1.763 CCOCc1cc(cc(c1)OC)OC 34a_100121572206_100011215721 [0,2,0,0,0,0|0,0,0]=2 1132 B14R1.763 CCOCc1cc(cc(c1)OC)OC 7a_100000700211_100000210202 [0,2,0,0,0,0|0,0,0]=2 1133 B14R1.763 CCOCc1nc(cc(n1)OC)OC 34a_100121572206_100000042204 [0,2,0,0,0,0|2,0,0]=4 1134 B14R1.763 CCSCc1cc(cc(c1)OC)OC 62a_100000210202_100011215721 [0,2,0,0,0,0|0,1,0]=3 1135 B14R1.763 CCSCc1cc(cc(c1)OC)OC 62a_100011215721_100000210202 [0,2,0,0,0,0|0,1,0]=3 1136 B14R1.763 CCc1cc(cc(c1)SCOC)CC 62a_100000766300_100010187588 [0,2,0,0,0,0|2,0,0]=4 1137 B14R1.763 CCc1cc(cc(c1)SCOC)CC 62a_100010187588_100000766300 [0,2,0,0,0,0|2,0,0]=4 1138 B14R1.763 CNCCc1cc(cc(c1)OC)OC 2230a_100011227904_200000210301 [0,2,0,0,0,0|1,0,0]=3 1139 B14R1.763 CNCCc1cc(cc(c1)OC)OC 34a_100011227904_200000210301 [0,2,0,0,0,0|1,0,0]=3 1140 B14R1.763 COCCc1cc(cc(c1)OC)OC 34a_100012001145_200000210301 [0,2,0,0,0,0|0,0,0]=2 1141 B14R1.763 COCCc1cc(cc(c1)OC)OC 7a_100012001145_200000210301 [0,2,0,0,0,0|0,0,0]=2 1142 B14R1.763 COCNc1cc(cc(c1)OC)CO 2230a_100012182899_100000766300 [0,2,0,0,0,0|2,0,0]=4 1143 B14R1.763 COCNc1cc(cc(c1)OC)OC 2230a_100000210928_100000766300 [0,2,0,0,0,0|0,0,0]=2 1144 B14R1.763 COCSc1cc(cc(c1)OC)C#N 62a_100000766300_100011934654 [0,2,0,0,0,0|2,0,0]=4 1145 B14R1.763 COCSc1cc(cc(c1)OC)C=O 62a_100000766300_100009816777 [0,2,0,0,0,0|2,0,0]=4 1146 B14R1.763 COCSc1cc(cc(c1)OC)C=O 62a_100009816777_100000766300 [0,2,0,0,0,0|2,0,0]=4 1147 B14R1.763 COCSc1cc(cc(c1)OC)CO 62a_100000766300_100009995317 [0,2,0,0,0,0|2,0,0]=4 1148 B14R1.763 COCSc1cc(cc(c1)OC)CO 62a_100009995317_100000766300 [0,2,0,0,0,0|2,0,0]=4 1149 B14R1.763 COCSc1cc(cc(c1)OC)OC 62a_100000766300_100000685218 [0,2,0,0,0,0|0,0,0]=2 1150 B14R1.763 COCSc1cc(cc(c1)SC)OC 62a_100000766300_200010709149 [0,2,0,0,0,0|0,1,0]=3 1151 B14R1.763 COCSc1cc(cc(c1)SC)OC 62a_200010709149_100000766300 [0,2,0,0,0,0|0,1,0]=3 1152 B14R1.763 COCSc1cc(cc(n1)OC)OC 62a_100000766300_100010008354 [0,2,0,0,0,0|1,0,0]=3 1153 B14R1.763 COCSc1cc(cc(n1)OC)OC 62a_100010008354_100000766300 [0,2,0,0,0,0|1,0,0]=3 1154 B14R1.763 COCSc1cc(nc(n1)OC)OC 62a_100000038909_100000766300 [0,2,0,0,0,0|2,0,0]=4 1155 B14R1.763 COCSc1cc(nc(n1)OC)OC 62a_100000766300_100000038909 [0,2,0,0,0,0|2,0,0]=4 1156 B14R1.763 COCSc1nc(cc(n1)OC)OC 62a_100000758842_100000766300 [0,2,0,0,0,0|2,0,0]=4 1157 B14R1.763 COCSc1nc(cc(n1)OC)OC 62a_100000766300_100000758842 [0,2,0,0,0,0|2,0,0]=4 1158 B14R1.763 COc1cc(cc(c1)OC)CCN[13CH3] 2230a_100011227904_200025704644 [0,2,0,0,0,0|1,0,0]=3 1159 B14R1.763 COc1cc(cc(c1)OC)CCN[13CH3] 34a_100011227904_200025704644 [0,2,0,0,0,0|1,0,0]=3 1160 B14R1.763 COc1cc(cc(c1)OC)CCO[13CH3] 34a_100012001145_200025704644 [0,2,0,0,0,0|0,0,0]=2 1161 B14R1.763 COc1cc(cc(c1)OC)CCO[13CH3] 7a_100012001145_200025704644 [0,2,0,0,0,0|0,0,0]=2 1162 B14R1.763 COc1cc(cc(c1)OC)CNCF 34a_100000737887_100015361967 [0,2,0,0,0,0|1,0,0]=3 1163 B14R1.763 COc1cc(cc(c1)OC)COCF 34a_100000700211_100015361967 [0,2,0,0,0,0|0,0,0]=2 1164 B14R1.763 COc1cc(cc(c1)OC)COCF 7a_100000700211_100015361967 [0,2,0,0,0,0|0,0,0]=2 1165 B14R1.763 COc1cc(cc(c1)OC)CSCF 62a_100011215721_100015361967 [0,2,0,0,0,0|0,1,0]=3 1166 B14R1.763 COc1cc(cc(c1)OC)CSCF 62a_100015361967_100011215721 [0,2,0,0,0,0|0,1,0]=3 1167 B14R1.763 COc1cc(cc(c1)OC)NCC#N 2230a_100000210928_100011215382 [0,2,0,0,0,0|1,0,0]=3 1168 B14R1.763 COc1cc(cc(c1)OC)NCC=O 2230a_100000210928_200015260668 [0,2,0,0,0,0|1,0,0]=3 1169 B14R1.763 COc1cc(cc(c1)OC)NCC=O 34a_100000210928_200009817547 [0,2,0,0,0,0|1,0,0]=3 1170 B14R1.763 COc1cc(cc(c1)OC)NCCF 2230a_100000210928_100011217306 [0,2,0,0,0,0|1,0,0]=3 1171 B14R1.763 COc1cc(cc(c1)OC)NCCF 34a_100000210928_100011217306 [0,2,0,0,0,0|1,0,0]=3 1172 B14R1.763 COc1cc(cc(c1)OC)NCCO 2230a_100000210928_100000211926 [0,2,0,0,0,0|1,0,0]=3 1173 B14R1.763 COc1cc(cc(c1)OC)NCCO 34a_100000210928_100000211926 [0,2,0,0,0,0|1,0,0]=3 1174 B14R1.763 COc1cc(cc(c1)OC)NCSC 2230a_100000210928_100011218213 [0,2,0,0,0,0|0,1,0]=3 1175 B14R1.763 COc1cc(cc(c1)OC)NCSC 34a_100000210928_100011218213 [0,2,0,0,0,0|0,1,0]=3 1176 B14R1.763 COc1cc(cc(c1)OCC#N)OC 7a_100000181322_100011215382 [0,2,0,0,0,0|0,0,0]=2 1177 B14R1.763 COc1cc(cc(c1)OCC=O)OC 34a_100000181322_200009817547 [0,2,0,0,0,0|0,0,0]=2 1178 B14R1.763 COc1cc(cc(c1)OCC=O)OC 7a_100000181322_200015260668 [0,2,0,0,0,0|0,0,0]=2 1179 B14R1.763 COc1cc(cc(c1)OCCF)OC 34a_100000181322_100011217306 [0,2,0,0,0,0|0,0,0]=2 1180 B14R1.763 COc1cc(cc(c1)OCCF)OC 7a_100000181322_100011217306 [0,2,0,0,0,0|0,0,0]=2 1181 B14R1.763 COc1cc(cc(c1)OCCO)OC 34a_100000181322_100000211926 [0,2,0,0,0,0|0,0,0]=2 1182 B14R1.763 COc1cc(cc(c1)OCCO)OC 7a_100000181322_100000211926 [0,2,0,0,0,0|0,0,0]=2 1183 B14R1.763 COc1cc(cc(c1)OCSC)OC 34a_100000181322_100011218213 [0,2,0,0,0,0|0,0,0]=2 1184 B14R1.763 COc1cc(cc(c1)SCC#N)OC 62a_100011215382_100000685218 [0,2,0,0,0,0|0,1,0]=3 1185 B14R1.763 COc1cc(cc(c1)SCC#N)SC 62a_100011215382_200010709149 [0,2,0,0,0,0|0,2,0]=4 1186 B14R1.763 COc1cc(cc(c1)SCC#N)SC 62a_200010709149_100011215382 [0,2,0,0,0,0|0,2,0]=4 1187 B14R1.763 COc1cc(cc(c1)SCC=O)OC 62a_200015260668_100000685218 [0,2,0,0,0,0|0,1,0]=3 1188 B14R1.763 COc1cc(cc(c1)SCC=O)SC 62a_200010709149_200015260668 [0,2,0,0,0,0|0,2,0]=4 1189 B14R1.763 COc1cc(cc(c1)SCC=O)SC 62a_200015260668_200010709149 [0,2,0,0,0,0|0,2,0]=4 1190 B14R1.763 COc1cc(cc(c1)SCCF)OC 62a_100011217306_100000685218 [0,2,0,0,0,0|0,1,0]=3 1191 B14R1.763 COc1cc(cc(c1)SCCF)SC 62a_100011217306_200010709149 [0,2,0,0,0,0|0,2,0]=4 1192 B14R1.763 COc1cc(cc(c1)SCCF)SC 62a_200010709149_100011217306 [0,2,0,0,0,0|0,2,0]=4 1193 B14R1.763 COc1cc(cc(c1)SCCO)OC 62a_100000211926_100000685218 [0,2,0,0,0,0|0,1,0]=3 1194 B14R1.763 COc1cc(cc(c1)SCCO)SC 62a_100000211926_200010709149 [0,2,0,0,0,0|0,2,0]=4 1195 B14R1.763 COc1cc(cc(c1)SCCO)SC 62a_200010709149_100000211926 [0,2,0,0,0,0|0,2,0]=4 1196 B14R1.763 COc1cc(cc(c1)SCSC)OC 62a_100011218213_100000685218 [0,2,0,0,0,0|0,1,0]=3 1197 B14R1.763 COc1cc(cc(c1)SCSC)SC 62a_100011218213_200010709149 [0,2,0,0,0,0|0,2,0]=4 1198 B14R1.763 COc1cc(cc(c1)SCSC)SC 62a_200010709149_100011218213 [0,2,0,0,0,0|0,2,0]=4 1199 B14R1.763 COc1cc(nc(c1)SCC#N)OC 62a_100010008354_100011215382 [0,2,0,0,0,0|1,1,0]=4 1200 B14R1.763 COc1cc(nc(c1)SCC#N)OC 62a_100011215382_100010008354 [0,2,0,0,0,0|1,1,0]=4 1201 B14R1.763 COc1cc(nc(c1)SCC=O)OC 62a_100010008354_200015260668 [0,2,0,0,0,0|1,1,0]=4 1202 B14R1.763 COc1cc(nc(c1)SCC=O)OC 62a_200015260668_100010008354 [0,2,0,0,0,0|1,1,0]=4 1203 B14R1.763 COc1cc(nc(c1)SCCF)OC 62a_100010008354_100011217306 [0,2,0,0,0,0|1,1,0]=4 1204 B14R1.763 COc1cc(nc(c1)SCCF)OC 62a_100011217306_100010008354 [0,2,0,0,0,0|1,1,0]=4 1205 B14R1.763 COc1cc(nc(c1)SCCO)OC 62a_100000211926_100010008354 [0,2,0,0,0,0|1,1,0]=4 1206 B14R1.763 COc1cc(nc(c1)SCCO)OC 62a_100010008354_100000211926 [0,2,0,0,0,0|1,1,0]=4 1207 B14R1.763 COc1cc(nc(c1)SCSC)OC 62a_100010008354_100011218213 [0,2,0,0,0,0|1,1,0]=4 1208 B14R1.763 COc1cc(nc(c1)SCSC)OC 62a_100011218213_100010008354 [0,2,0,0,0,0|1,1,0]=4 1209 B14R1.3200 CCNc1cc(cc(c1Cl)OC)OC 34a_100009955059_100000210202 [0,2,0,0,0,0|1,0,0]=3 1210 B14R1.3200 CCOc1cc(cc(c1Cl)OC)OC 34a_100010658696_100000210202 [0,2,0,0,0,0|0,0,0]=2 1211 B14R1.3200 CCOc1cc(cc(c1Cl)OC)OC 7a_100010658696_100000210202 [0,2,0,0,0,0|0,0,0]=2 1212 B14R1.3200 CNCc1cc(cc(c1Cl)OC)OC 26a_100102657272_100010658696 [0,2,0,0,0,0|1,0,0]=3 1213 B14R1.3200 COc1cc(c(c(c1)OC)Cl)NCF 34a_100009955059_100015361967 [0,2,0,0,0,0|1,0,0]=3 1214 B14R1.3200 COc1cc(c(c(c1)OCF)Cl)OC 34a_100010658696_100015361967 [0,2,0,0,0,0|0,0,0]=2 1215 B14R1.3200 COc1cc(c(c(c1)OCF)Cl)OC 7a_100010658696_100015361967 [0,2,0,0,0,0|0,0,0]=2 1216 B14R1.3236 C=C=Cc1cc(c(c(c1)OC)F)OC 271570a_100015277604_100015304952 [0,2,0,0,0,0|1,0,1]=4 1217 B14R1.3236 C=C=Cc1cc(c(c(c1)OC)O)OC 271570a_100015277604_100000691893 [0,2,0,0,0,0|1,0,1]=4 1218 B14R1.3236 CC=Cc1cc(c(c(c1)OC)F)OC 271570a_100016259895_100015304952 [0,2,0,0,0,0|1,0,0]=3 1219 B14R1.3236 CC=Cc1cc(c(c(c1)OC)O)OC 271570a_100016259895_100000691893 [0,2,0,0,0,0|1,0,0]=3 1220 B14R1.3236 CCNc1cc(c(c(c1)OC)Cl)OC 34a_100009986809_100000210202 [0,2,0,0,0,0|1,0,0]=3 1221 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100000210202_100015304952 [0,2,0,0,0,0|0,1,0]=3 1222 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100015304952_100000210202 [0,2,0,0,0,0|0,1,0]=3 1223 B14R1.3236 CNCc1cc(c(c(c1)OC)Br)OC 207a_100102657272_100009814401 [0,2,0,0,0,0|1,0,0]=3 1224 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 207a_100102657272_200012186444 [0,2,0,0,0,0|1,0,0]=3 1225 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 270004a_106832991635_200012186444 [0,2,0,0,0,0|1,0,0]=3 1226 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 207a_100102657272_200009839898 [0,2,0,0,0,0|1,0,0]=3 1227 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 270004a_106832991635_200009839898 [0,2,0,0,0,0|1,0,0]=3 1228 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 34a_100010169844_200000210301 [0,2,0,0,0,0|0,0,0]=2 1229 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 7a_100010169844_200000210301 [0,2,0,0,0,0|0,0,0]=2 1230 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 34a_100010169844_200025704644 [0,2,0,0,0,0|0,0,0]=2 1231 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 7a_100010169844_200025704644 [0,2,0,0,0,0|0,0,0]=2 1232 B14R1.3236 COc1cc(cc(c1Cl)OC)NCF 34a_100009986809_100015361967 [0,2,0,0,0,0|1,0,0]=3 1233 B14R1.3236 COc1cc(cc(c1F)OC)SCF 62a_100015304952_100015361967 [0,2,0,0,0,0|0,1,0]=3 1234 B14R1.3236 COc1cc(cc(c1F)OC)SCF 62a_100015361967_100015304952 [0,2,0,0,0,0|0,1,0]=3 1235 B14R1.566 C=Cc1c(c(cc(c1F)OC)OC)F 271570a_100011290941_100010780958 [0,2,0,0,0,0|1,0,1]=4 1236 B14R1.566 CNc1c(c(cc(c1Cl)OC)OC)Cl 34a_100010296497_200000210301 [0,2,0,0,0,0|1,0,0]=3 1237 B14R1.566 CNc1c(c(cc(c1F)OC)OC)F 34a_100009883675_200000210301 [0,2,0,0,0,0|1,0,0]=3 1238 B14R1.566 COc1cc(c(c(c1Cl)N[13CH3])Cl)OC 34a_100010296497_200025704644 [0,2,0,0,0,0|1,0,0]=3 1239 B14R1.566 COc1cc(c(c(c1F)N[13CH3])F)OC 34a_100009883675_200025704644 [0,2,0,0,0,0|1,0,0]=3 1240 B14R1.566 COc1cc(c(c(c1F)SC)F)OC 62a_100010780958_200000210301 [0,2,0,0,0,0|0,1,0]=3 1241 B14R1.566 COc1cc(c(c(c1F)SC)F)OC 62a_200000210301_100010780958 [0,2,0,0,0,0|0,1,0]=3 1242 B14R1.566 COc1cc(c(c(c1F)S[13CH3])F)OC 62a_100010780958_200025704644 [0,2,0,0,0,0|0,1,0]=3 1243 B14R1.566 COc1cc(c(c(c1F)S[13CH3])F)OC 62a_200025704644_100010780958 [0,2,0,0,0,0|0,1,0]=3 1244 B14R1.576 C=Cc1c(cc(cc1OC)CO)OC 271570a_100011290941_100010169844 [0,2,0,0,0,0|2,0,0]=4 1245 B14R1.576 C=Cc1c(cc(cc1OC)OC)OC 271570a_100011290941_100000186544 [0,2,0,0,0,0|0,0,0]=2 1246 B14R1.576 C=Cc1cc(c(c(c1)OC)C=O)OC 271570a_100011290941_100010380724 [0,2,0,0,0,0|1,0,1]=4 1247 B14R1.576 C=Cc1cc(c(c(c1)OC)OC)OC 271570a_100011290941_100009814342 [0,2,0,0,0,0|1,0,1]=4 1248 B14R1.576 C=Cc1cc(cc(c1C=O)OC)OC 271570a_100011290941_100000688085 [0,2,0,0,0,0|1,0,1]=4 1249 B14R1.576 CNc1c(cc(cc1OC)OC)OC 2230a_100011205168_200000210301 [0,2,0,0,0,0|0,0,0]=2 1250 B14R1.576 CNc1c(cc(cc1OC)OC)OC 34a_100011205168_200000210301 [0,2,0,0,0,0|0,0,0]=2 1251 B14R1.576 CNc1cc(c(c(c1)OC)OC)OC 34a_100000209829_200000210301 [0,2,0,0,0,0|1,0,0]=3 1252 B14R1.576 COc1cc(c(c(c1)OC)N[13CH3])OC 2230a_100011205168_200025704644 [0,2,0,0,0,0|0,0,0]=2 1253 B14R1.576 COc1cc(c(c(c1)OC)N[13CH3])OC 34a_100011205168_200025704644 [0,2,0,0,0,0|0,0,0]=2 1254 B14R1.576 COc1cc(c(c(c1)OC)OC)OC 34a_100000757337_200000210301 [0,2,0,0,0,0|0,0,0]=2 1255 B14R1.576 COc1cc(c(c(c1)OC)OC)OC 34a_200000073592_200000210301 [0,2,0,0,0,0|0,0,0]=2 1256 B14R1.576 COc1cc(c(c(c1)OC)O[13CH3])OC 34a_200000073592_200025704644 [0,2,0,0,0,0|0,0,0]=2 1257 B14R1.576 COc1cc(c(c(c1)OC)SC)OC 62a_100000186544_200000210301 [0,2,0,0,0,0|0,0,0]=2 1258 B14R1.576 COc1cc(c(c(c1)OC)SC)OC 62a_200000210301_100000186544 [0,2,0,0,0,0|0,0,0]=2 1259 B14R1.576 COc1cc(c(c(c1)OC)S[13CH3])OC 62a_100000186544_200025704644 [0,2,0,0,0,0|0,0,0]=2 1260 B14R1.576 COc1cc(c(c(c1)OC)S[13CH3])OC 62a_200025704644_100000186544 [0,2,0,0,0,0|0,0,0]=2 1261 B14R1.576 COc1cc(cc(c1C=O)OC)SC 62a_100010380724_200000210301 [0,2,0,0,0,0|0,1,0]=3 1262 B14R1.576 COc1cc(cc(c1C=O)OC)S[13CH3] 62a_100010380724_200025704644 [0,2,0,0,0,0|0,1,0]=3 1263 B14R1.576 COc1cc(cc(c1OC)OC)CO 34a_200011216933_200000210301 [0,2,0,0,0,0|2,0,0]=4 1264 B14R1.576 COc1cc(cc(c1OC)OC)N[13CH3] 34a_100000209829_200025704644 [0,2,0,0,0,0|1,0,0]=3 1265 B14R1.576 COc1cc(cc(c1OC)OC)O[13CH3] 34a_100000757337_200025704644 [0,2,0,0,0,0|0,0,0]=2 1266 B14R1.576 COc1cc(cc(c1O[13CH3])OC)CO 34a_200011216933_200025704644 [0,2,0,0,0,0|2,0,0]=4 1267 B14R1.576 COc1cc(cc(c1SC)OC)C=O 62a_100009814401_200000210301 [0,2,0,0,0,0|2,0,0]=4 1268 B14R1.576 COc1cc(cc(c1SC)OC)C=O 62a_200000210301_100009814401 [0,2,0,0,0,0|2,0,0]=4 1269 B14R1.576 COc1cc(cc(c1SC)OC)CO 62a_100010169844_200000210301 [0,2,0,0,0,0|2,0,0]=4 1270 B14R1.576 COc1cc(cc(c1SC)OC)CO 62a_200000210301_100010169844 [0,2,0,0,0,0|2,0,0]=4 1271 B14R1.576 COc1cc(cc(c1S[13CH3])OC)C=O 62a_100009814401_200025704644 [0,2,0,0,0,0|2,0,0]=4 1272 B14R1.576 COc1cc(cc(c1S[13CH3])OC)C=O 62a_200025704644_100009814401 [0,2,0,0,0,0|2,0,0]=4 1273 B14R1.576 COc1cc(cc(c1S[13CH3])OC)CO 62a_100010169844_200025704644 [0,2,0,0,0,0|2,0,0]=4 1274 B14R1.576 COc1cc(cc(c1S[13CH3])OC)CO 62a_200025704644_100010169844 [0,2,0,0,0,0|2,0,0]=4 1275 B14R2.3170 COc1cc(cc(c1)C2CC2)OC 271570a_100011220607_100000685218 [0,1,0,1,0,0|1,0,0]=3 1276 B14R2.3170 COc1cc(cc(c1)C2CC2)SC 271570a_100011220607_200010709149 [0,1,0,1,0,0|1,1,0]=4 1277 B14R2.3170 COc1cc(nc(c1)C2CC2)OC 271570a_100011220607_100010008354 [0,1,0,1,0,0|2,0,0]=4 1278 B12R1.78 C=Cc1cc(ccc1OC)OC 271570a_100011290941_100011215452 [0,0,0,0,1,1|1,0,1]=4 1279 B12R1.78 C=Cc1ccc(c(c1)OC)OC 271570a_100011290941_100000187503 [0,0,0,0,1,1|1,0,1]=4 1280 B12R1.78 C=Cc1ccc(c(c1)OC)OC 34a_100011217988_200000210301 [0,0,0,0,1,1|1,0,1]=4 1281 B12R1.78 C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100011217988_200025704644 [0,0,0,0,1,1|1,0,1]=4 1282 B12R1.78 C=Cc1ccc(cc1OC)OC 271570a_100011290941_100000750026 [0,0,0,0,1,1|1,0,1]=4 1283 B12R1.78 C=Cc1cnc(c(c1)OC)OC 271570a_100011290941_100010234541 [0,0,0,0,1,1|1,0,1]=4 1284 B12R1.78 C=Cc1cnc(cc1OC)OC 271570a_100011290941_100010191559 [0,0,0,0,1,1|1,0,1]=4 1285 B12R1.78 CCc1cc(ccc1OC)SC 62a_200000210301_200010179862 [0,0,0,0,1,1|1,1,0]=4 1286 B12R1.78 CCc1cc(ccc1OC)SC 62a_200010179862_200000210301 [0,0,0,0,1,1|1,1,0]=4 1287 B12R1.78 CCc1cc(ccc1OC)S[13CH3] 62a_200010179862_200025704644 [0,0,0,0,1,1|1,1,0]=4 1288 B12R1.78 CCc1cc(ccc1OC)S[13CH3] 62a_200025704644_200010179862 [0,0,0,0,1,1|1,1,0]=4 1289 B12R1.78 CCc1cc(ccc1SC)OC 62a_100000720562_200000210301 [0,0,0,0,1,1|1,1,0]=4 1290 B12R1.78 CCc1cc(ccc1SC)OC 62a_200000210301_100000720562 [0,0,0,0,1,1|1,1,0]=4 1291 B12R1.78 CCc1cc(ccc1S[13CH3])OC 62a_100000720562_200025704644 [0,0,0,0,1,1|1,1,0]=4 1292 B12R1.78 CCc1cc(ccc1S[13CH3])OC 62a_200025704644_100000720562 [0,0,0,0,1,1|1,1,0]=4 1293 B12R1.78 CCc1ccc(c(c1)NC)OC 2230a_100012035449_200000210301 [0,0,0,0,1,1|2,0,0]=4 1294 B12R1.78 CCc1ccc(c(c1)NC)OC 34a_100012035449_200000210301 [0,0,0,0,1,1|2,0,0]=4 1295 B12R1.78 CCc1ccc(c(c1)N[13CH3])OC 2230a_100012035449_200025704644 [0,0,0,0,1,1|2,0,0]=4 1296 B12R1.78 CCc1ccc(c(c1)N[13CH3])OC 34a_100012035449_200025704644 [0,0,0,0,1,1|2,0,0]=4 1297 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100000186467_200000210301 [0,0,0,0,1,1|1,0,0]=3 1298 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100009844796_200000210301 [0,0,0,0,1,1|1,0,0]=3 1299 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100000186467_200000210301 [0,0,0,0,1,1|1,0,0]=3 1300 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100009844796_200000210301 [0,0,0,0,1,1|1,0,0]=3 1301 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 34a_100000186467_200025704644 [0,0,0,0,1,1|1,0,0]=3 1302 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 7a_100000186467_200025704644 [0,0,0,0,1,1|1,0,0]=3 1303 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200000210301_200010710389 [0,0,0,0,1,1|1,1,0]=4 1304 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200010710389_200000210301 [0,0,0,0,1,1|1,1,0]=4 1305 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200010710389_200025704644 [0,0,0,0,1,1|1,1,0]=4 1306 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_200010710389 [0,0,0,0,1,1|1,1,0]=4 1307 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 34a_100009844796_200025704644 [0,0,0,0,1,1|1,0,0]=3 1308 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 7a_100009844796_200025704644 [0,0,0,0,1,1|1,0,0]=3 1309 B12R1.78 CCc1ccc(c(c1)SC)OC 62a_100010062400_200000210301 [0,0,0,0,1,1|1,1,0]=4 1310 B12R1.78 CCc1ccc(c(c1)SC)OC 62a_200000210301_100010062400 [0,0,0,0,1,1|1,1,0]=4 1311 B12R1.78 CCc1ccc(c(c1)S[13CH3])OC 62a_100010062400_200025704644 [0,0,0,0,1,1|1,1,0]=4 1312 B12R1.78 CCc1ccc(c(c1)S[13CH3])OC 62a_200025704644_100010062400 [0,0,0,0,1,1|1,1,0]=4 1313 B12R1.78 CCc1ccc(cc1OC)SC 62a_200000210301_200010710398 [0,0,0,0,1,1|1,1,0]=4 1314 B12R1.78 CCc1ccc(cc1OC)SC 62a_200010710398_200000210301 [0,0,0,0,1,1|1,1,0]=4 1315 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200010710398_200025704644 [0,0,0,0,1,1|1,1,0]=4 1316 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200025704644_200010710398 [0,0,0,0,1,1|1,1,0]=4 1317 B12R1.78 CNc1cc(ccc1OC)OC 2230a_100000184736_200000210301 [0,0,0,0,1,1|1,0,0]=3 1318 B12R1.78 CNc1cc(ccc1OC)OC 34a_100000184736_200000210301 [0,0,0,0,1,1|1,0,0]=3 1319 B12R1.78 CNc1ccc(c(c1)OC)OC 34a_100000187404_200000210301 [0,0,0,0,1,1|1,0,0]=3 1320 B12R1.78 CNc1ccc(c(c1)SC)OC 62a_114948341033_200000210301 [0,0,0,0,1,1|1,1,0]=4 1321 B12R1.78 CNc1ccc(c(c1)SC)OC 62a_200000210301_114948341033 [0,0,0,0,1,1|1,1,0]=4 1322 B12R1.78 CNc1ccc(c(c1)S[13CH3])OC 62a_114948341033_200025704644 [0,0,0,0,1,1|1,1,0]=4 1323 B12R1.78 CNc1ccc(c(c1)S[13CH3])OC 62a_200025704644_114948341033 [0,0,0,0,1,1|1,1,0]=4 1324 B12R1.78 CNc1ccc(cc1OC)OC 2230a_100000211191_200000210301 [0,0,0,0,1,1|1,0,0]=3 1325 B12R1.78 CNc1ccc(cc1OC)OC 34a_100000211191_200000210301 [0,0,0,0,1,1|1,0,0]=3 1326 B12R1.78 CNc1ccc(cc1OC)SC 2230a_100000766855_200000210301 [0,0,0,0,1,1|1,1,0]=4 1327 B12R1.78 CNc1ccc(cc1OC)SC 34a_100000766855_200000210301 [0,0,0,0,1,1|1,1,0]=4 1328 B12R1.78 COc1cc(c(cn1)SC)OC 62a_100010191559_200000210301 [0,0,0,0,1,1|0,1,0]=3 1329 B12R1.78 COc1cc(c(cn1)SC)OC 62a_200000210301_100010191559 [0,0,0,0,1,1|0,1,0]=3 1330 B12R1.78 COc1cc(c(cn1)S[13CH3])OC 62a_100010191559_200025704644 [0,0,0,0,1,1|0,1,0]=3 1331 B12R1.78 COc1cc(c(cn1)S[13CH3])OC 62a_200025704644_100010191559 [0,0,0,0,1,1|0,1,0]=3 1332 B12R1.78 COc1cc(c(nn1)OC)OC 34a_200010760773_200000210301 [0,0,0,0,1,1|1,0,0]=3 1333 B12R1.78 COc1cc(c(nn1)OC)O[13CH3] 34a_200010760773_200025704644 [0,0,0,0,1,1|1,0,0]=3 1334 B12R1.78 COc1cc(ccc1CO)O[13CH3] 34a_200000116926_200025704644 [0,0,0,0,1,1|2,0,0]=4 1335 B12R1.78 COc1cc(ccc1N[13CH3])SC 2230a_100000766855_200025704644 [0,0,0,0,1,1|1,1,0]=4 1336 B12R1.78 COc1cc(ccc1N[13CH3])SC 34a_100000766855_200025704644 [0,0,0,0,1,1|1,1,0]=4 1337 B12R1.78 COc1cc(ccc1O[13CH3])C#N 34a_100000184589_200025704644 [0,0,0,0,1,1|2,0,0]=4 1338 B12R1.78 COc1cc(ccc1O[13CH3])C#N 7a_100000184589_200025704644 [0,0,0,0,1,1|2,0,0]=4 1339 B12R1.78 COc1cc(ccc1O[13CH3])CN 34a_100000185554_200025704644 [0,0,0,0,1,1|2,0,0]=4 1340 B12R1.78 COc1cc(ccc1SC)SC 62a_200011001119_200000210301 [0,0,0,0,1,1|0,2,0]=4 1341 B12R1.78 COc1cc(ccc1SC)S[13CH3] 62a_200011001119_200025704644 [0,0,0,0,1,1|0,2,0]=4 1342 B12R1.78 COc1cc(cnc1OC)SC 62a_200000210301_100010234541 [0,0,0,0,1,1|0,1,0]=3 1343 B12R1.78 COc1cc(cnc1OC)S[13CH3] 62a_200025704644_100010234541 [0,0,0,0,1,1|0,1,0]=3 1344 B12R1.78 COc1cc(nnc1OC)SC 62a_200000210301_200000095610 [0,0,0,0,1,1|1,1,0]=4 1345 B12R1.78 COc1cc(nnc1OC)S[13CH3] 62a_200025704644_200000095610 [0,0,0,0,1,1|1,1,0]=4 1346 B12R1.78 COc1ccc(c(c1)C#N)OC 34a_200011934229_200000210301 [0,0,0,0,1,1|2,0,0]=4 1347 B12R1.78 COc1ccc(c(c1)C#N)OC 7a_200011934229_200000210301 [0,0,0,0,1,1|2,0,0]=4 1348 B12R1.78 COc1ccc(c(c1)C#N)O[13CH3] 34a_200011934229_200025704644 [0,0,0,0,1,1|2,0,0]=4 1349 B12R1.78 COc1ccc(c(c1)C#N)O[13CH3] 7a_200011934229_200025704644 [0,0,0,0,1,1|2,0,0]=4 1350 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 2230a_100000184736_200025704644 [0,0,0,0,1,1|1,0,0]=3 1351 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 34a_100000184736_200025704644 [0,0,0,0,1,1|1,0,0]=3 1352 B12R1.78 COc1ccc(c(c1)OC)C#N 34a_100011999188_200000210301 [0,0,0,0,1,1|2,0,0]=4 1353 B12R1.78 COc1ccc(c(c1)OC)C#N 7a_100011999188_200000210301 [0,0,0,0,1,1|2,0,0]=4 1354 B12R1.78 COc1ccc(c(c1)OC)CO 34a_200000116926_200000210301 [0,0,0,0,1,1|2,0,0]=4 1355 B12R1.78 COc1ccc(c(c1)OC)N=O 34a_200010658452_200000210301 [0,0,0,0,1,1|2,0,0]=4 1356 B12R1.78 COc1ccc(c(c1)OC)N=O 7a_200010658452_200000210301 [0,0,0,0,1,1|2,0,0]=4 1357 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 2230a_100000211191_200025704644 [0,0,0,0,1,1|1,0,0]=3 1358 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 34a_100000211191_200025704644 [0,0,0,0,1,1|1,0,0]=3 1359 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000039706_200000210301 [0,0,0,0,1,1|0,0,0]=2 1360 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000074795_200000210301 [0,0,0,0,1,1|0,0,0]=2 1361 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100009840267_200000210301 [0,0,0,0,1,1|0,0,0]=2 1362 B12R1.78 COc1ccc(c(c1)OC)O[13CH3] 34a_100009840267_200025704644 [0,0,0,0,1,1|0,0,0]=2 1363 B12R1.78 COc1ccc(c(c1)OC)SC 62a_100000750026_200000210301 [0,0,0,0,1,1|0,1,0]=3 1364 B12R1.78 COc1ccc(c(c1)OC)SC 62a_200000210301_100000750026 [0,0,0,0,1,1|0,1,0]=3 1365 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_100000750026_200025704644 [0,0,0,0,1,1|0,1,0]=3 1366 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100000750026 [0,0,0,0,1,1|0,1,0]=3 1367 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 34a_100011999188_200025704644 [0,0,0,0,1,1|2,0,0]=4 1368 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 7a_100011999188_200025704644 [0,0,0,0,1,1|2,0,0]=4 1369 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 34a_200010658452_200025704644 [0,0,0,0,1,1|2,0,0]=4 1370 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 7a_200010658452_200025704644 [0,0,0,0,1,1|2,0,0]=4 1371 B12R1.78 COc1ccc(c(c1)O[13CH3])OC 34a_100000074795_200025704644 [0,0,0,0,1,1|0,0,0]=2 1372 B12R1.78 COc1ccc(c(c1)SC)OC 62a_100011215452_200000210301 [0,0,0,0,1,1|0,1,0]=3 1373 B12R1.78 COc1ccc(c(c1)SC)OC 62a_200000210301_100011215452 [0,0,0,0,1,1|0,1,0]=3 1374 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_100011215452_200025704644 [0,0,0,0,1,1|0,1,0]=3 1375 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_200025704644_100011215452 [0,0,0,0,1,1|0,1,0]=3 1376 B12R1.78 COc1ccc(c(n1)OC)OC 34a_100000085135_200000210301 [0,0,0,0,1,1|1,0,0]=3 1377 B12R1.78 COc1ccc(c(n1)OC)O[13CH3] 34a_100000085135_200025704644 [0,0,0,0,1,1|1,0,0]=3 1378 B12R1.78 COc1ccc(c(n1)OC)SC 62a_100009816055_200000210301 [0,0,0,0,1,1|1,1,0]=4 1379 B12R1.78 COc1ccc(c(n1)OC)SC 62a_200000210301_100009816055 [0,0,0,0,1,1|1,1,0]=4 1380 B12R1.78 COc1ccc(c(n1)OC)S[13CH3] 62a_100009816055_200025704644 [0,0,0,0,1,1|1,1,0]=4 1381 B12R1.78 COc1ccc(c(n1)OC)S[13CH3] 62a_200025704644_100009816055 [0,0,0,0,1,1|1,1,0]=4 1382 B12R1.78 COc1ccc(cc1OC)C#N 34a_100000184589_200000210301 [0,0,0,0,1,1|2,0,0]=4 1383 B12R1.78 COc1ccc(cc1OC)C#N 34a_100000188611_200000210301 [0,0,0,0,1,1|2,0,0]=4 1384 B12R1.78 COc1ccc(cc1OC)C#N 7a_100000184589_200000210301 [0,0,0,0,1,1|2,0,0]=4 1385 B12R1.78 COc1ccc(cc1OC)C#N 7a_100000188611_200000210301 [0,0,0,0,1,1|2,0,0]=4 1386 B12R1.78 COc1ccc(cc1OC)CN 34a_100000185554_200000210301 [0,0,0,0,1,1|2,0,0]=4 1387 B12R1.78 COc1ccc(cc1OC)CN 34a_100000740000_200000210301 [0,0,0,0,1,1|2,0,0]=4 1388 B12R1.78 COc1ccc(cc1OC)CO 34a_100011215239_200000210301 [0,0,0,0,1,1|2,0,0]=4 1389 B12R1.78 COc1ccc(cc1OC)N[13CH3] 34a_100000187404_200025704644 [0,0,0,0,1,1|1,0,0]=3 1390 B12R1.78 COc1ccc(cc1OC)O[13CH3] 34a_100000039706_200025704644 [0,0,0,0,1,1|0,0,0]=2 1391 B12R1.78 COc1ccc(cc1OC)SC 62a_200000210301_100011356967 [0,0,0,0,1,1|0,1,0]=3 1392 B12R1.78 COc1ccc(cc1OC)S[13CH3] 62a_200025704644_100011356967 [0,0,0,0,1,1|0,1,0]=3 1393 B12R1.78 COc1ccc(cc1O[13CH3])C#N 34a_100000188611_200025704644 [0,0,0,0,1,1|2,0,0]=4 1394 B12R1.78 COc1ccc(cc1O[13CH3])C#N 7a_100000188611_200025704644 [0,0,0,0,1,1|2,0,0]=4 1395 B12R1.78 COc1ccc(cc1O[13CH3])CN 34a_100000740000_200025704644 [0,0,0,0,1,1|2,0,0]=4 1396 B12R1.78 COc1ccc(cc1O[13CH3])CO 34a_100011215239_200025704644 [0,0,0,0,1,1|2,0,0]=4 1397 B12R1.78 COc1ccc(cc1SC)SC 62a_200009892704_200000210301 [0,0,0,0,1,1|0,2,0]=4 1398 B12R1.78 COc1ccc(cc1SC)S[13CH3] 62a_200009892704_200025704644 [0,0,0,0,1,1|0,2,0]=4 1399 B12R1.78 COc1ccc(nc1OC)SC 62a_200000210301_100010214848 [0,0,0,0,1,1|1,1,0]=4 1400 B12R1.78 COc1ccc(nc1OC)S[13CH3] 62a_200025704644_100010214848 [0,0,0,0,1,1|1,1,0]=4 1401 B12R1.78 COc1cnc(nc1OC)SC 62a_200000210301_100010280452 [0,0,0,0,1,1|1,1,0]=4 1402 B12R1.78 COc1cnc(nc1OC)S[13CH3] 62a_200025704644_100010280452 [0,0,0,0,1,1|1,1,0]=4 1403 B12R1.78 COc1ncc(c(n1)OC)SC 62a_100011215025_200000210301 [0,0,0,0,1,1|1,1,0]=4 1404 B12R1.78 COc1ncc(c(n1)OC)SC 62a_200000210301_100011215025 [0,0,0,0,1,1|1,1,0]=4 1405 B12R1.78 COc1ncc(c(n1)OC)S[13CH3] 62a_100011215025_200025704644 [0,0,0,0,1,1|1,1,0]=4 1406 B12R1.78 COc1ncc(c(n1)OC)S[13CH3] 62a_200025704644_100011215025 [0,0,0,0,1,1|1,1,0]=4 1407 B12R1.78 COc1ncc(nc1OC)SC 62a_100010132954_200000210301 [0,0,0,0,1,1|1,1,0]=4 1408 B12R1.78 COc1ncc(nc1OC)SC 62a_200000210301_100010132954 [0,0,0,0,1,1|1,1,0]=4 1409 B12R1.78 COc1ncc(nc1OC)S[13CH3] 62a_100010132954_200025704644 [0,0,0,0,1,1|1,1,0]=4 1410 B12R1.78 COc1ncc(nc1OC)S[13CH3] 62a_200025704644_100010132954 [0,0,0,0,1,1|1,1,0]=4