0 B12R1.125 CC1=CC=CC=C1CCC(=O)O SC-27982 [0,0,0,0,0,0|1,0,2]=3 1 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SC-17877 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.125 O=C(O)CNC1=CC=CC=C1F SC-92918 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.125 O=C(O)COC1=CC=CC=C1F SC-50195 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SC-81630 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl SC-03976 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.17 O=CCCC1=CC=CC=C1F SC-35091 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92694 [1,0,0,0,0,0|0,0,0]=1 8 B11R1.17 O=C\C=C\C1=CC=CC=C1O SC-92985 [1,0,0,0,0,0|0,0,0]=1 9 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SC-83281 [1,0,0,0,0,0|1,0,2]=4 10 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.91 NC(=O)OCC1=CC=CC=C1 SC-47828 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SC-06047 [1,0,0,0,0,0|1,0,2]=4 13 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SC-13741 [1,0,0,0,0,0|0,0,2]=3 14 B11R1.91 O=C(O)CCC1=NC=CC=C1 SC-50767 [1,0,0,0,0,0|1,0,2]=4 15 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [1,0,0,0,0,0|1,0,1]=3 16 B11R1.91 O=C(O)CNC1=CC=CN=C1 SC-A2839 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.91 O=C(O)COC1=CC=CN=C1 SC-47923 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SC-39613 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SC-57973 [1,0,0,0,0,0|1,0,0]=2 20 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SC-62388 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SC-90388 [1,0,0,0,0,0|1,0,1]=3 22 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CN=C1 SC-16078 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SC-53253 [1,0,0,0,0,0|1,0,1]=3 24 B13R1.90 COC1=CC=CC=C1CCC(=O)O SC-69693 [0,1,0,0,0,0|0,0,2]=3 25 B13R1.164 CC1=CC=C(OCC(=O)O)C(C)=C1 SC-95680 [0,1,0,0,0,0|2,0,1]=4 26 B13R1.164 O=C(O)CCC1=CC=C(Cl)C=C1Cl SC-62399 [0,1,0,0,0,0|1,0,2]=4 27 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1F SC-11447 [0,1,0,0,0,0|1,0,2]=4 28 B13R1.164 O=C(O)\C=C\C1=C(Cl)C=C(Br)C=C1 SC-28764 [0,1,0,0,0,0|1,0,0]=2 29 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1Cl SC-44535 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.164 O=C(O)\C=C\C1=CC=C(Cl)C=C1F SC-02270 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.164 O=C(O)\C=C\C1=CC=C(F)C=C1Cl SC-20650 [0,1,0,0,0,0|1,0,0]=2 32 B13R1.201 CC(CC(=O)O)C1=CC=CC=C1Cl SC-91278 [0,1,0,0,0,0|1,0,2]=4 33 B13R1.202 CC1=CC=CC=C1CC(N)C(=O)O SC-10852 [0,1,0,0,0,0|1,0,2]=4 34 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O SC-44239 [0,1,0,0,0,0|1,0,2]=4 35 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SC-10504 [0,1,0,0,0,0|1,0,2]=4 36 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O SC-10766 [0,1,0,0,0,0|1,0,2]=4 37 B13R1.202 N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O SC-10503 [0,1,0,0,0,0|1,0,2]=4 38 B13R1.202 N[C@@H](CC1=C(F)C=CC=C1)C(=O)O SC-10764 [0,1,0,0,0,0|1,0,2]=4 39 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O SC-10539 [0,1,0,0,0,0|1,0,2]=4 40 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O SC-10787 [0,1,0,0,0,0|0,0,2]=3 41 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O SC-94203 [0,1,0,0,0,0|0,0,2]=3 42 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O SC-10765 [0,1,0,0,0,0|1,0,2]=4 43 B13R1.893 O=C(O)\C=C\C1=CC(F)=CC=C1F SC-46689 [0,1,0,0,0,0|1,0,0]=2 44 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 SC-50143 [0,0,0,1,0,0|2,0,0]=3 45 B13R2.435 CC(=O)C1=CC2=CC=CC=C2S1 SC-02622 [0,0,0,1,0,0|1,1,0]=3 46 B13R2.435 CC(=O)C1=NC2=CC=CC=C2O1 SC-28166 [0,0,0,1,0,0|2,0,0]=3 47 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 SC-04821 [0,0,0,1,0,0|0,0,0]=1 48 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 SC-13722 [0,0,0,1,0,0|0,1,0]=2 49 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 SC-89324 [0,0,0,1,0,0|2,0,0]=3 50 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 SC-27740 [0,0,0,1,0,0|2,0,0]=3 51 B13R2.435 O=C(O)C1=CN2C=CN=CC2=N1 SC-44704 [0,0,0,1,0,0|3,0,0]=4 52 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 SC-03119 [0,0,0,1,0,0|2,0,0]=3 53 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 SC-47323 [0,0,0,1,0,0|1,1,0]=3 54 B13R2.435 O=C(O)C1=NN2C=CC=NC2=C1 SC-68162 [0,0,0,1,0,0|3,0,0]=4 55 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)C1 SC-50301 [0,0,0,1,0,0|1,0,2]=4 56 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 SC-06816 [0,0,0,1,0,0|1,0,2]=4 57 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-21617 [0,0,0,1,0,0|1,0,1]=3 58 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 SC-A2997 [0,0,0,1,0,0|1,0,1]=3 59 B13R2.5179 CC1=CC=CC2=CC(Br)=CC=C12 SC-49915 [0,0,0,1,0,0|3,0,0]=4 60 B13R2.5179 NC1=CC2=C(C=C1)C(O)=NC=C2 SC-83884 [0,0,0,1,0,0|3,0,0]=4 61 B13R2.5179 NC1=CC2=CC=CC(O)=C2C=C1 SC-72415 [0,0,0,1,0,0|2,0,0]=3 62 B13R2.5179 O=C1C=COC2=C1C=CC(O)=C2 SC-11899 [0,0,0,1,0,0|2,0,1]=4 63 B13R2.5179 O=C1CCC2=C(C=CC=C2O)N1 SC-49117 [0,0,0,1,0,0|1,0,2]=4 64 B13R2.5179 OC1=CC2=C(C=C1)C(Cl)=NC=C2 SC-60466 [0,0,0,1,0,0|3,0,0]=4 65 B13R2.5179 OC1=CC=NC2=CC(Cl)=CC=C12 SC-28055 [0,0,0,1,0,0|3,0,0]=4 66 B13R2.5179 OC1=CC=NC2=CC(F)=CC=C12 SC-89562 [0,0,0,1,0,0|3,0,0]=4 67 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SC-44334 [0,0,0,0,1,0|2,0,1]=4 68 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SC-05751 [0,0,0,0,1,0|2,0,0]=3 69 B11R1.86 CC(=O)NC1=CC=CC=C1N SC-67459 [0,0,0,0,1,0|3,0,0]=4 70 B11R1.86 CC1=CC=CC=C1CC(=O)Cl SC-40364 [0,0,0,0,1,0|2,0,1]=4 71 B11R1.86 NC(=O)CC1=CC=CC=C1Br SC-29203 [0,0,0,0,1,0|2,0,1]=4 72 B11R1.86 O=C(Cl)CC1=CC=CC=C1F SC-82872 [0,0,0,0,1,0|2,0,1]=4 73 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 SC-02004 [0,0,0,0,1,0|1,0,1]=3 74 B11R1.86 O=C(O)CC1=C(F)N=CC=C1 SC-33640 [0,0,0,0,1,0|2,0,1]=4 75 B11R1.86 O=C(O)CC1=CC=CC=C1Cl SC-15304 [0,0,0,0,1,0|1,0,1]=3 76 B11R1.86 O=C(O)CC1=CC=CC=C1F SC-04601 [0,0,0,0,1,0|1,0,1]=3 77 B11R1.86 O=C(O)CC1=CC=CC=C1I SC-02003 [0,0,0,0,1,0|1,0,1]=3 78 B11R1.86 O=C(O)CC1=CC=CC=C1O SC-22392 [0,0,0,0,1,0|0,0,1]=2 79 B11R1.86 O=C(O)CC1=CC=CN=C1Cl SC-33825 [0,0,0,0,1,0|2,0,1]=4 80 B11R1.86 O=C(O)CC1=NC=CC=C1Cl SC-65559 [0,0,0,0,1,0|2,0,1]=4 81 B13R1.158 O=C(O)CCCC1=CC=CC=C1F SC-11471 [0,0,0,0,0,1|1,0,2]=4 82 B10R1.4 OCCC1=CC=CC=C1O SC-22438 [2,0,0,0,0,0|0,0,2]=4 83 B10R1.17 O=CCCC1=CC=CC=C1 SC-79262 [2,0,0,0,0,0|0,0,2]=4 84 B10R1.17 O=C\C=C\C1=CC=CC=C1 SC-19143 [2,0,0,0,0,0|0,0,0]=2 85 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SC-01266 [1,1,0,0,0,0|0,0,2]=4 86 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SC-65225 [1,1,0,0,0,0|0,0,0]=2 87 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 SC-14663 [1,1,0,0,0,0|0,0,2]=4 88 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SC-26484 [1,1,0,0,0,0|0,0,2]=4 89 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SC-16870 [1,1,0,0,0,0|0,0,2]=4 90 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SC-45457 [1,1,0,0,0,0|0,0,2]=4 91 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SC-13665 [1,1,0,0,0,0|0,0,2]=4 92 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SC-48332 [1,1,0,0,0,0|1,0,1]=4 93 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SC-25784 [1,1,0,0,0,0|1,0,1]=4 94 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SC-17666 [1,1,0,0,0,0|1,0,1]=4 95 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SC-00565 [1,1,0,0,0,0|0,0,0]=2 96 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-01473 [1,1,0,0,0,0|0,0,0]=2 97 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SC-28823 [1,1,0,0,0,0|0,0,0]=2 98 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SC-25929 [1,1,0,0,0,0|0,0,0]=2 99 B12R1.21 O=C(O)\C=C\C1=CN=C(Cl)C=C1 SC-26343 [1,1,0,0,0,0|1,0,0]=3 100 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(I)C=C1 SC-92202 [1,1,0,0,0,0|1,0,1]=4 101 B12R1.21 OB(O)\C=C\C1=CC=C(Cl)C=C1 SC-85472 [1,1,0,0,0,0|1,0,1]=4 102 B12R1.27 COC(=O)CCC1=CC=CC=C1 SC-15551 [1,1,0,0,0,0|0,0,2]=4 103 B12R1.27 COC(=O)COC1=CC=CC=C1 SC-95721 [1,1,0,0,0,0|1,0,1]=4 104 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 SC-44851 [1,1,0,0,0,0|1,0,0]=3 105 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SC-A2141 [1,1,0,0,0,0|1,0,1]=4 106 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SC-31135 [1,1,0,0,0,0|1,0,1]=4 107 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O SC-01259 [1,1,0,0,0,0|0,0,2]=4 108 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SC-09766 [1,1,0,0,0,0|0,0,2]=4 109 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-09765 [1,1,0,0,0,0|0,0,2]=4 110 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SC-45736 [1,1,0,0,0,0|0,0,2]=4 111 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SC-96045 [1,1,0,0,0,0|0,0,2]=4 112 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SC-02277 [1,1,0,0,0,0|0,0,2]=4 113 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SC-06556 [1,1,0,0,0,0|0,0,2]=4 114 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SC-A2836 [1,1,0,0,0,0|0,0,2]=4 115 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SC-84768 [1,1,0,0,0,0|1,0,1]=4 116 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SC-45519 [1,1,0,0,0,0|0,0,2]=4 117 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SC-19254 [1,1,0,0,0,0|0,0,1]=3 118 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SC-13720 [1,1,0,0,0,0|0,0,2]=4 119 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SC-84996 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 SC-92718 [1,1,0,0,0,0|0,0,0]=2 121 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 SC-02327 [1,1,0,0,0,0|0,0,0]=2 122 B12R1.75 COC1=CC=CC=C1NC(C)=O SC-47661 [0,1,0,0,1,0|2,0,0]=4 123 B12R1.75 NCC1=CC=CC=C1CC(=O)O SC-91922 [0,1,0,0,1,0|1,0,1]=4 124 B12R1.124 CC(C(=O)O)C1=CC=CC=C1F SC-49262 [0,1,0,0,1,0|1,0,1]=4 125 B12R1.124 CC1=CC=CC=C1C(N)C(=O)O SC-21686 [0,1,0,0,1,0|1,0,1]=4 126 B12R1.124 CC1=CC=CC=C1[C@H](N)C(=O)O SC-21704 [0,1,0,0,1,0|1,0,1]=4 127 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O SC-26297 [0,1,0,0,1,0|0,0,1]=3 128 B12R1.124 O=C(O)C(Br)C1=CC=CC=C1Cl SC-12235 [0,1,0,0,1,0|1,0,1]=4 129 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Br SC-75785 [0,1,0,0,1,0|1,0,1]=4 130 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Cl SC-12147 [0,1,0,0,1,0|1,0,1]=4 131 B12R1.124 [C@@H](O)(C(=O)O)C1=CC=CC=C1Cl SC-05082 [0,1,0,0,1,0|1,0,1]=4 132 B12R1.127 CC1=CC=C(Br)C=C1CC(=O)O SC-88176 [0,1,0,0,1,0|1,0,1]=4 133 B12R1.127 CC1=CC=C(F)C(CC(=O)O)=C1 SC-99887 [0,1,0,0,1,0|1,0,1]=4 134 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1Br SC-20112 [0,1,0,0,1,0|1,0,1]=4 135 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1F SC-82277 [0,1,0,0,1,0|1,0,1]=4 136 B12R1.127 O=C(O)CC1=CC(F)=CC=C1F SC-06975 [0,1,0,0,1,0|1,0,1]=4 137 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 SC-03314 [0,1,0,0,1,0|1,0,1]=4 138 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Br SC-A3296 [0,1,0,0,1,0|1,0,1]=4 139 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F SC-70198 [0,1,0,0,1,0|1,0,1]=4 140 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1O SC-14030 [0,1,0,0,1,0|2,0,0]=4 141 B12R1.233 CC1=CC(Br)=C(CC(=O)O)C=C1 SC-99646 [0,1,0,0,1,0|1,0,1]=4 142 B12R1.233 CC1=CC(Br)=CC=C1CC(=O)O SC-32808 [0,1,0,0,1,0|1,0,1]=4 143 B12R1.233 CC1=CC(C)=C(CC(=O)O)C=C1 SC-26513 [0,1,0,0,1,0|1,0,1]=4 144 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 SC-69944 [0,1,0,0,1,0|1,0,1]=4 145 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1Br SC-48088 [0,1,0,0,1,0|1,0,1]=4 146 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1Cl SC-26155 [0,1,0,0,1,0|1,0,1]=4 147 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1F SC-14540 [0,1,0,0,1,0|1,0,1]=4 148 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Br SC-66061 [0,1,0,0,1,0|1,0,1]=4 149 B12R1.233 O=C(O)CC1=CC=C(O)C=C1F SC-06273 [0,1,0,0,1,0|1,0,1]=4 150 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1Br SC-92643 [0,1,0,0,1,0|1,0,1]=4 151 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl SC-06122 [0,1,0,0,1,0|1,0,1]=4 152 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1Cl SC-49318 [0,1,0,0,1,0|1,0,1]=4 153 B12R1.353 COC(=O)\C=C\C1=CC=CN1C SC-96318 [0,1,0,0,1,0|2,0,0]=4 154 B14R1.154 O=C(O)CCCC1=CC=CC(O)=C1O SC-51738 [0,1,0,0,0,1|0,0,2]=4 155 B14R1.15 COC(=O)\C=C\C1=CC=CC(F)=C1F SC-91147 [0,2,0,0,0,0|1,0,0]=3 156 B14R1.81 COC1=C(O)C(\C=C\C(=O)O)=CC=C1 SC-40979 [0,2,0,0,0,0|0,0,0]=2 157 B14R1.103 COC1=CC=C(\C=C\C(=O)O)C(O)=C1 SC-94867 [0,2,0,0,0,0|0,0,0]=2 158 B14R1.727 COC(=O)\C=C/C1=CC=C(F)C=C1F SC-91143 [0,2,0,0,0,0|1,0,0]=3 159 B14R1.727 COC(=O)\C=C\C1=CC=C(F)C=C1F SC-91142 [0,2,0,0,0,0|1,0,0]=3 160 B14R1.5971 CC1=CC=CC(C)=C1NC(=O)C(=O)O SC-83152 [0,2,0,0,0,0|2,0,0]=4 161 B14R1.820 COC(=O)\C=C\C1=CC(F)=CC=C1F SC-91140 [0,2,0,0,0,0|1,0,0]=3 162 B14R1.19598 COC(=O)\C=C\C1=C(Cl)C=CC=C1Cl SC-41562 [0,2,0,0,0,0|1,0,0]=3 163 B14R1.19598 COC(=O)\C=C\C1=C(F)C=CC=C1F SC-91141 [0,2,0,0,0,0|1,0,0]=3 164 B14R1.2335 COC1=CC=C(O)C(\C=C\C(=O)O)=C1 SC-13117 [0,2,0,0,0,0|0,0,0]=2 165 B12R1.56 COC1=CC(C(=O)O)=CC=C1O SC-15609 [0,0,1,1,0,0|1,0,1]=4 166 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1F SC-69671 [0,0,1,1,0,0|2,0,0]=4 167 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1O SC-95837 [0,0,1,1,0,0|1,0,0]=3 168 B12R1.258 CC(=O)C1=CC=CC(C(=O)O)=C1 SC-21464 [0,0,1,1,0,0|0,0,2]=4 169 B12R1.258 O=C(O)C1=CC(B(O)O)=CC=C1 SC-02916 [0,0,1,1,0,0|2,0,0]=4 170 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 SC-47450 [0,0,1,1,0,0|2,0,0]=4 171 B12R1.258 O=C(O)C1=CC=CC(C(=O)O)=C1 SC-00610 [0,0,1,1,0,0|1,0,0]=3 172 B12R1.258 O=C(O)C1=CN=CC(C(=O)O)=C1 SC-04851 [0,0,1,1,0,0|2,0,0]=4 173 B12R1.453 O=CC1=CC=C(O)C(C(=O)O)=C1 SC-26965 [0,0,1,1,0,0|1,0,1]=4 174 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 SC-05491 [1,0,0,1,0,0|2,0,0]=4 175 B12R2.24 IC1=CC=C2C=CC=CC2=C1 SC-66937 [1,0,0,1,0,0|2,0,0]=4 176 B12R2.24 NC1=CC=C2C=CC=CC2=C1 SC-21231 [1,0,0,1,0,0|2,0,0]=4 177 B12R2.24 NC1=NC2=CC=CC=C2C=C1 SC-05494 [1,0,0,1,0,0|2,0,0]=4 178 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 SC-06682 [1,0,0,1,0,0|2,0,0]=4 179 B12R2.24 OC1=CC2=C(C=CC=C2)C=N1 SC-27580 [1,0,0,1,0,0|2,0,0]=4 180 B12R2.24 OC1=CC2=CC=CC=C2N=C1 SC-47514 [1,0,0,1,0,0|2,0,0]=4 181 B12R2.24 OC1=CC=C2C=CC=NC2=C1 SC-05493 [1,0,0,1,0,0|2,0,0]=4 182 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 SC-87209 [1,0,0,1,0,0|2,0,0]=4 183 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 SC-13529 [1,0,0,1,0,0|2,0,0]=4 184 B12R2.32 O=CC1=CC2=CC=CC=C2S1 SC-27762 [1,0,0,1,0,0|0,1,0]=3 185 B12R2.32 O=CC1=CN2C=CC=CC2=N1 SC-47756 [1,0,0,1,0,0|2,0,0]=4 186 B12R2.32 O=CC1=NC2=CC=CC=C2N1 SC-03537 [1,0,0,1,0,0|2,0,0]=4 187 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SC-65177 [1,0,0,1,0,0|1,1,0]=4 188 B12R2.32 O=CC1=NN2C=CC=CC2=C1 SC-35983 [1,0,0,1,0,0|2,0,0]=4 189 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 SC-62843 [1,0,0,1,0,0|1,0,1]=4 190 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 SC-46532 [1,0,0,1,0,0|0,1,1]=4 191 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 SC-04823 [1,0,0,1,0,0|2,0,0]=4 192 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 SC-72162 [1,0,0,1,0,0|2,0,0]=4 193 B12R2.1081 ClC1=C2C=CC=NC2=CC=C1 SC-29505 [1,0,0,1,0,0|2,0,0]=4 194 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 SC-13683 [1,0,0,1,0,0|2,0,0]=4 195 B12R2.1081 NC1=CC=CC2=NC=CC=C12 SC-05713 [1,0,0,1,0,0|2,0,0]=4 196 B12R2.1081 OC1=C2C=CC=NC2=CC=C1 SC-20248 [1,0,0,1,0,0|1,0,0]=3 197 B12R2.1081 OC1=CC=CC2=C1C=NC=C2 SC-88306 [1,0,0,1,0,0|2,0,0]=4 198 B12R2.1081 OC1=CC=CC2=C1N=CC=C2 SC-18904 [1,0,0,1,0,0|2,0,0]=4 199 B12R2.1081 OC1=CC=NC2=CC=CC=C12 SC-05714 [1,0,0,1,0,0|2,0,0]=4 200 B12R2.1081 OC1=CN=CC2=C1C=CC=C2 SC-35208 [1,0,0,1,0,0|2,0,0]=4 201 B12R2.3190 O=C(O)C1=CC2=CC=CC=C21 SC-19627 [1,0,0,1,0,0|0,0,0]=2 202 B12R2.252 O=C(O)C1=CC2=C(C=CS2)S1 SC-90437 [0,0,0,1,1,0|1,1,0]=4 203 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2O1 SC-28084 [0,0,0,1,0,1|0,0,1]=3 204 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=C1 SC-74862 [0,0,0,1,0,1|2,0,0]=4 205 B14R2.781 CC(=O)C1=CC2=CC=CC=C2N=C1 SC-30991 [0,0,0,1,0,1|2,0,0]=4 206 B14R2.781 O=C(O)C1=CC2=C(C=C1)C=NC=C2 SC-25332 [0,0,0,1,0,1|2,0,0]=4 207 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=C1 SC-07352 [0,0,0,1,0,1|1,0,0]=3 208 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 SC-28351 [0,0,0,1,0,1|1,0,0]=3 209 B14R2.781 O=C(O)C1=CC=C2C=CC=NC2=C1 SC-19996 [0,0,0,1,0,1|2,0,0]=4 210 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=C1 SC-00145 [0,0,0,1,0,1|2,0,0]=4 211 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 SC-07133 [0,0,0,1,0,1|1,0,0]=3 212 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 SC-87974 [0,0,0,1,0,1|2,0,0]=4 213 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 SC-14083 [0,0,0,1,0,1|2,0,0]=4 214 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 SC-49701 [0,0,0,1,0,1|2,0,0]=4 215 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 SC-92503 [0,0,0,1,0,1|0,0,2]=4 216 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 SC-23379 [0,0,0,1,0,1|0,0,2]=4 217 B14R2.781 O=C(O)[C@@H]1COC2=CC=CC=C2O1 SC-93049 [0,0,0,1,0,1|0,0,2]=4 218 B14R2.781 O=C(O)[C@H]1COC2=CC=CC=C2O1 SC-69587 [0,0,0,1,0,1|0,0,2]=4 219 B14R2.8032 CC(=O)C1=CNC2=C1C=CC=C2C SC-93147 [0,0,0,1,0,1|2,0,0]=4 220 B14R2.8032 CC1=CC=CC2=C1NC=C2C(=O)O SC-03286 [0,0,0,1,0,1|1,0,0]=3 221 B14R2.8032 O=C(O)C1=C2C=CC=C(Cl)C2=NN1 SC-00719 [0,0,0,1,0,1|2,0,0]=4 222 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Cl SC-12928 [0,0,0,1,0,1|1,0,0]=3 223 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 SC-07103 [0,1,0,1,0,0|1,0,1]=4 224 B14R2.450 CC(=O)C1=CC2=C(C=CC=C2)N1C SC-94269 [0,1,0,1,0,0|2,0,0]=4 225 B14R2.450 CC1=C(C(=O)O)NC2=C1C=CC=C2 SC-A4121 [0,1,0,1,0,0|1,0,0]=3 226 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 SC-46132 [0,1,0,1,0,0|0,0,0]=2 227 B14R2.450 CN1C2=CC=CC=C2N=C1C(=O)O SC-13965 [0,1,0,1,0,0|2,0,0]=4 228 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2S1 SC-78306 [0,1,0,1,0,0|0,1,0]=3 229 B14R2.450 O=C(O)C1=C(Cl)N2C=CC=CC2=N1 SC-22265 [0,1,0,1,0,0|2,0,0]=4 230 B14R2.7969 CC1=CC=CC2=NC(C(=O)O)=CN12 SC-24150 [0,1,0,1,0,0|2,0,0]=4 231 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)N1 SC-01586 [0,1,0,1,0,0|1,0,0]=3 232 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)N1 SC-61032 [0,1,0,1,0,0|1,0,0]=3 233 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2S1 SC-68640 [0,1,0,1,0,0|0,1,0]=3 234 B14R2.7969 O=C(O)C1=CC2=C(N1)C(Br)=CC=C2 SC-23313 [0,1,0,1,0,0|1,0,0]=3 235 B14R2.7969 O=C(O)C1=CC2=C(N1)C(O)=CC=C2 SC-23210 [0,1,0,1,0,0|1,0,0]=3 236 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 SC-45731 [0,1,0,1,0,0|1,0,0]=3 237 B14R2.7969 O=C(O)C1=CN2C(Br)=CC=CC2=N1 SC-31035 [0,1,0,1,0,0|2,0,0]=4 238 B14R2.7969 O=C(O)C1=NC2=CC=CC(Br)=C2S1 SC-82331 [0,1,0,1,0,0|1,1,0]=4 239 B14R2.4529 CC(=O)C1=CC2=CC=C(Br)C=C2O1 SC-33838 [0,1,0,1,0,0|1,0,0]=3 240 B14R2.4529 CC1=CC=C2C=C(C(=O)O)SC2=C1 SC-28171 [0,1,0,1,0,0|0,1,0]=3 241 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)N1 SC-01590 [0,1,0,1,0,0|1,0,0]=3 242 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)N=C2)N1 SC-91803 [0,1,0,1,0,0|2,0,0]=4 243 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 SC-03312 [0,1,0,1,0,0|1,0,0]=3 244 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 SC-06533 [0,1,0,1,0,0|1,0,0]=3 245 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 SC-43762 [0,1,0,1,0,0|0,0,0]=2 246 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 SC-65534 [0,1,0,1,0,0|1,0,0]=3 247 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 SC-68638 [0,1,0,1,0,0|0,1,0]=3 248 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CN=C2N1 SC-35569 [0,1,0,1,0,0|2,0,0]=4 249 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 SC-46131 [0,1,0,1,0,0|1,0,0]=3 250 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2N1 SC-01587 [0,1,0,1,0,0|1,0,0]=3 251 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 SC-90095 [0,1,0,1,0,0|0,1,0]=3 252 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)N=C2N1 SC-35390 [0,1,0,1,0,0|2,0,0]=4 253 B14R2.4529 O=C(O)C1=CC2=CC=C(O)C=C2O1 SC-04138 [0,1,0,1,0,0|0,0,0]=2 254 B14R2.4529 O=C(O)C1=CC2=NC=C(Cl)C=C2N1 SC-B8121 [0,1,0,1,0,0|2,0,0]=4 255 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=N1 SC-22430 [0,1,0,1,0,0|2,0,0]=4 256 B14R2.4529 O=C(O)C1=NC2=CC(Br)=CC=C2S1 SC-14719 [0,1,0,1,0,0|1,1,0]=4 257 B14R2.4529 O=C(O)C1=NC2=CC(Cl)=CC=C2N1 SC-11757 [0,1,0,1,0,0|2,0,0]=4 258 B14R2.4529 O=C(O)C1=NC2=CC(F)=CC=C2O1 SC-A2413 [0,1,0,1,0,0|1,0,0]=3 259 B14R2.4529 O=C(O)C1=NC2=CC=C(Br)C=C2S1 SC-34476 [0,1,0,1,0,0|1,1,0]=4 260 B14R2.4529 O=C(O)C1=NC2=CC=C(F)C=C2S1 SC-14572 [0,1,0,1,0,0|1,1,0]=4 261 B14R2.4529 O=C(O)C1=NN2C=C(Br)C=CC2=C1 SC-A2726 [0,1,0,1,0,0|2,0,0]=4 262 B14R2.4529 O=C(O)C1=NN2C=CC(Br)=CC2=C1 SC-A2735 [0,1,0,1,0,0|2,0,0]=4 263 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 SC-00571 [0,1,0,1,0,0|1,0,0]=3 264 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 SC-27296 [0,1,0,1,0,0|2,0,0]=4 265 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 SC-12508 [0,1,0,1,0,0|2,0,0]=4 266 B14R2.972 COC(=O)C1=NC2=CC=CC=C2S1 SC-87102 [0,1,0,1,0,0|1,1,0]=4 267 B14R2.1801 COC1=CC2=CC=CC(Br)=C2C=C1 SC-91163 [0,1,0,1,0,0|2,0,0]=4 268 B14R2.1801 COC1=CC2=CC=CC(O)=C2C=C1 SC-47537 [0,1,0,1,0,0|1,0,0]=3 269 B14R2.1801 O=CC1=CC=C2C(O)=CC=CC2=C1 SC-90386 [0,1,0,1,0,0|1,0,0]=3 270 B14R2.1801 OCC1=CC2=CC=CC(O)=C2C=C1 SC-90385 [0,1,0,1,0,0|1,0,0]=3 271 B10R1.18 BrC(Br)=CC1=CC=CC=C1 SC-04543 [1,0,0,0,1,0|2,0,0]=4 272 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SC-18821 [1,0,0,0,1,0|2,0,0]=4 273 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-12152 [1,0,0,0,1,0|1,0,1]=4 274 B10R1.18 O=C(O)CC1=CC=CN=C1 SC-16916 [1,0,0,0,1,0|1,0,1]=4 275 B10R1.18 O=C(O)CC1=CC=NC=C1 SC-80508 [1,0,0,0,1,0|1,0,1]=4 276 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-20933 [1,0,0,0,1,0|1,0,1]=4 277 B10R1.18 O=C(O)CC1=NC=CC=C1 SC-26574 [1,0,0,0,1,0|1,0,1]=4 278 B10R1.18 OC(=S)CC1=CC=CC=C1 SC-46270 [1,0,0,0,1,0|0,1,1]=4 279 B10R1.66 O=C(O)\C=C\C1=CC=CN1 SC-39811 [1,0,0,0,1,0|1,0,0]=3 280 B10R1.66 O=C(O)\C=C\C1=CN=CN1 SC-00208 [1,0,0,0,1,0|2,0,0]=4 281 B10R1.66 O=C(O)\C=C\C1=COC=C1 SC-84399 [1,0,0,0,1,0|1,0,0]=3 282 B10R1.61 CC(=O)C1=C(C)C=CC=C1 SC-05472 [0,0,0,0,2,0|2,0,0]=4 283 B10R1.61 CC(=O)C1=CC=CC=C1Br SC-02452 [0,0,0,0,2,0|2,0,0]=4 284 B10R1.61 CC(=O)C1=CC=CC=C1F SC-04547 [0,0,0,0,2,0|2,0,0]=4 285 B10R1.61 CC(=O)C1=CC=CC=C1I SC-69419 [0,0,0,0,2,0|2,0,0]=4 286 B10R1.61 CC(=O)C1=CC=CC=C1N SC-25871 [0,0,0,0,2,0|2,0,0]=4 287 B10R1.61 CC(=O)C1=CC=CC=C1O SC-22737 [0,0,0,0,2,0|1,0,0]=3 288 B10R1.61 CC(=O)C1=NC=CC=C1O SC-68611 [0,0,0,0,2,0|2,0,0]=4 289 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SC-19040 [0,0,0,0,2,0|1,0,0]=3 290 B10R1.61 CC1=C(C(=O)O)C=CN=C1 SC-48966 [0,0,0,0,2,0|2,0,0]=4 291 B10R1.61 CC1=CC=CC=C1C(=O)Cl SC-77647 [0,0,0,0,2,0|2,0,0]=4 292 B10R1.61 CC1=CC=CN=C1C(=O)O SC-20347 [0,0,0,0,2,0|2,0,0]=4 293 B10R1.61 CC1=CC=NC=C1C(=O)O SC-46151 [0,0,0,0,2,0|2,0,0]=4 294 B10R1.61 CC1=NC=CC=C1C(=O)O SC-43918 [0,0,0,0,2,0|2,0,0]=4 295 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 SC-65339 [0,0,0,0,2,0|2,0,0]=4 296 B10R1.61 NC1=C(C(=O)O)C=CN=C1 SC-06649 [0,0,0,0,2,0|2,0,0]=4 297 B10R1.61 NC1=C(C(=O)O)C=NC=C1 SC-06594 [0,0,0,0,2,0|2,0,0]=4 298 B10R1.61 NC1=NC=CC=C1C(=O)O SC-05131 [0,0,0,0,2,0|2,0,0]=4 299 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 SC-07180 [0,0,0,0,2,0|1,0,0]=3 300 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 SC-19164 [0,0,0,0,2,0|2,0,0]=4 301 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 SC-07188 [0,0,0,0,2,0|2,0,0]=4 302 B10R1.61 O=C(O)C1=C(O)C=CC=C1 SC-18305 [0,0,0,0,2,0|0,0,0]=2 303 B10R1.61 O=C(O)C1=C(S)N=CC=C1 SC-15474 [0,0,0,0,2,0|1,1,0]=4 304 B10R1.61 O=C(O)C1=CC=CC=C1F SC-04549 [0,0,0,0,2,0|1,0,0]=3 305 B10R1.61 O=C(O)C1=CC=CC=C1S SC-01204 [0,0,0,0,2,0|0,1,0]=3 306 B10R1.61 O=C(O)C1=CC=CN=C1Br SC-03814 [0,0,0,0,2,0|2,0,0]=4 307 B10R1.61 O=C(O)C1=CC=CN=C1Cl SC-03205 [0,0,0,0,2,0|2,0,0]=4 308 B10R1.61 O=C(O)C1=CC=CN=C1F SC-04139 [0,0,0,0,2,0|2,0,0]=4 309 B10R1.61 O=C(O)C1=CC=CN=C1O SC-05694 [0,0,0,0,2,0|1,0,0]=3 310 B10R1.61 O=C(O)C1=CC=NC=C1Br SC-17226 [0,0,0,0,2,0|2,0,0]=4 311 B10R1.61 O=C(O)C1=CC=NC=C1I SC-21019 [0,0,0,0,2,0|2,0,0]=4 312 B10R1.61 O=C(O)C1=CC=NC=C1O SC-17227 [0,0,0,0,2,0|1,0,0]=3 313 B10R1.61 O=C(O)C1=CN=CC=C1O SC-20172 [0,0,0,0,2,0|1,0,0]=3 314 B10R1.61 O=C(O)C1=NC=CC=C1Br SC-03299 [0,0,0,0,2,0|2,0,0]=4 315 B10R1.61 O=C(O)C1=NC=CC=C1Cl SC-21544 [0,0,0,0,2,0|2,0,0]=4 316 B10R1.61 O=C(O)C1=NC=CC=C1F SC-01296 [0,0,0,0,2,0|2,0,0]=4 317 B10R1.61 O=C(O)C1=NC=CN=C1O SC-54489 [0,0,0,0,2,0|2,0,0]=4 318 B10R1.61 O=[N+]([O-])C1=CC=CC=C1O SC-18124 [0,0,0,0,2,0|1,0,1]=4 319 B10R1.61 OB(O)C1=CC=CC=C1O SC-07209 [0,0,0,0,2,0|1,0,1]=4