0 B9R1.6 C=C(C)C1=CC=CC=C1 SBB060154 [0,0,0,0,0,0|1,0,1]=2 1 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [0,0,0,0,0,0|0,1,1]=2 2 B9R1.6 CC(=O)C1=CC=NC=C1 SBB040256 [0,0,0,0,0,0|1,1,1]=3 3 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [0,0,0,0,0,0|1,1,1]=3 4 B9R1.6 CC(=O)C1=CN=CC=N1 SBB006738 [0,0,0,0,0,0|2,1,1]=4 5 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [0,0,0,0,0,0|1,1,1]=3 6 B9R1.6 CC(=O)C1=NC=CC=N1 SBB055904 [0,0,0,0,0,0|2,1,1]=4 7 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [0,0,0,0,0,0|1,0,0]=1 8 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [0,0,0,0,0,0|1,0,0]=1 10 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [0,0,0,0,0,0|1,0,0]=1 11 B9R1.6 CC(N)C1=CC=NC=C1 SBB007016 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 CC(N)C1=CN=CC=C1 SBB027288 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 CC(N)C1=NC=CC=C1 SBB018707 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [0,0,0,0,0,0|0,1,0]=1 15 B9R1.6 CN(C)C1=CC=CC=C1 SBB040814 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 CN(C)C1=CC=NC=C1 SBB008765 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.6 CN(N)C1=CC=CC=C1 SBB060814 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 C[C@@H](O)C1=CC=NC=C1 SBB065458 [0,0,0,0,0,0|1,1,0]=2 19 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [0,0,0,0,0,0|1,0,0]=1 20 B9R1.6 N=C(N)C1=CC=CC=C1 SBB055093 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.6 N=C(N)C1=CC=CC=N1 SBB087246 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 NC(=O)C1=CC=CC=C1 SBB058198 [0,0,0,0,0,0|1,1,1]=3 23 B9R1.6 NC(=O)C1=CC=CC=N1 SBB008128 [0,0,0,0,0,0|2,1,1]=4 24 B9R1.6 NC(=O)C1=CC=CN=C1 SBB004283 [0,0,0,0,0,0|2,1,1]=4 25 B9R1.6 NC(=O)C1=CC=CN=C1 SBB055585 [0,0,0,0,0,0|2,1,1]=4 26 B9R1.6 NC(=S)C1=CC=CC=C1 SBB041177 [0,0,0,0,0,0|1,0,2]=3 27 B9R1.6 NC(=S)C1=CC=CC=N1 SBB017638 [0,0,0,0,0,0|2,0,2]=4 28 B9R1.6 NC(=S)C1=CC=NC=C1 SBB028258 [0,0,0,0,0,0|2,0,2]=4 29 B9R1.6 NC(=S)C1=CN=CC=C1 SBB028259 [0,0,0,0,0,0|2,0,2]=4 30 B9R1.6 O=C(Cl)C1=CC=CC=C1 SBB059783 [0,0,0,0,0,0|1,1,1]=3 31 B9R1.6 O=C(Cl)C1=CC=CN=C1 SBB005806 [0,0,0,0,0,0|2,1,1]=4 32 B9R1.6 O=C(Cl)C1=CC=NC=C1 SBB000083 [0,0,0,0,0,0|2,1,1]=4 33 B9R1.6 O=C(Cl)C1=NC=CC=C1 SBB053631 [0,0,0,0,0,0|2,1,1]=4 34 B9R1.6 O=C(F)C1=CC=CC=C1 SBB085547 [0,0,0,0,0,0|1,1,1]=3 35 B9R1.6 O=C(O)C1=CC=CC=C1 SBB040515 [0,0,0,0,0,0|1,1,1]=3 36 B9R1.6 O=C(O)C1=CC=CN=C1 SBB004279 [0,0,0,0,0,0|2,1,1]=4 37 B9R1.6 O=C(O)C1=CC=NC=C1 SBB004278 [0,0,0,0,0,0|2,1,1]=4 38 B9R1.6 O=C(O)C1=NC=CC=C1 SBB004277 [0,0,0,0,0,0|2,1,1]=4 39 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 SBB040911 [0,0,0,0,0,0|2,1,0]=3 40 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 SBB065520 [0,0,0,0,0,0|3,1,0]=4 41 B9R1.6 OB(O)C1=CC=NC=C1 SBB004280 [0,0,0,0,0,0|3,1,0]=4 42 B9R1.6 OB(O)C1=CN=CC=C1 SBB025625 [0,0,0,0,0,0|3,1,0]=4 43 B9R1.6 OB(O)C1=NC=CC=C1 SBB052574 [0,0,0,0,0,0|3,1,0]=4 44 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [1,0,0,0,0,0|0,0,2]=3 47 B8R1.2 C#CC1=CC=CC=N1 SBB006619 [1,0,0,0,0,0|1,0,2]=4 48 B8R1.2 C#CC1=CC=CN=C1 SBB065464 [1,0,0,0,0,0|1,0,2]=4 49 B8R1.2 C#CC1=CC=NC=C1 SBB055516 [1,0,0,0,0,0|1,0,2]=4 50 B8R1.2 C#CC1=CC=NC=C1 SBB065466 [1,0,0,0,0,0|1,0,2]=4 51 B8R1.2 CCC1=CC=CC=C1 SBB040891 [1,0,0,0,0,0|0,0,0]=1 52 B8R1.2 CCC1=CC=CC=N1 SBB060373 [1,0,0,0,0,0|1,0,0]=2 53 B8R1.2 CCC1=CC=NC=C1 SBB061128 [1,0,0,0,0,0|1,0,0]=2 54 B8R1.2 CCC1=CN=CC=C1 SBB060374 [1,0,0,0,0,0|1,0,0]=2 55 B8R1.2 CNC1=CC=CC=C1 SBB008162 [1,0,0,0,0,0|1,0,0]=2 56 B8R1.2 CNC1=CC=CC=C1 SBB059778 [1,0,0,0,0,0|1,0,0]=2 57 B8R1.2 CNC1=NC=CN=C1 SBB018751 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [1,0,0,0,0,0|2,0,0]=3 59 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [1,0,0,0,0,0|1,0,1]=3 61 B8R1.2 N#CC1=CC=CN=C1 SBB007554 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.2 N#CC1=CC=NC=C1 SBB008923 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.2 N#CC1=NC=CC=C1 SBB008920 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 NCC1=CC=CC=C1 SBB040473 [1,0,0,0,0,0|1,0,0]=2 65 B8R1.2 NCC1=CC=CN=C1 SBB004351 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 NCC1=CC=NC=C1 SBB004350 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 NCC1=NC=CC=C1 SBB004352 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.2 NCC1=NC=CN=C1 SBB014584 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 NCC1=NC=NC=C1 SBB086444 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 NNC1=CC=CC=C1 SBB040886 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.2 NNC1=CC=NC=C1 SBB018987 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [1,0,0,0,0,0|1,1,1]=4 73 B8R1.2 O=CC1=CC=NC=C1 SBB004357 [1,0,0,0,0,0|1,1,1]=4 74 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [1,0,0,0,0,0|1,1,1]=4 75 B8R1.2 OCC1=CC=CC=C1 SBB058558 [1,0,0,0,0,0|0,1,0]=2 76 B8R1.2 OCC1=CC=CN=C1 SBB004344 [1,0,0,0,0,0|1,1,0]=3 77 B8R1.2 OCC1=CC=CN=N1 SBB054829 [1,0,0,0,0,0|2,1,0]=4 78 B8R1.2 OCC1=CC=NC=C1 SBB004347 [1,0,0,0,0,0|1,1,0]=3 79 B8R1.2 OCC1=CN=CN=C1 SBB065691 [1,0,0,0,0,0|2,1,0]=4 80 B8R1.2 OCC1=NC=CC=C1 SBB004348 [1,0,0,0,0,0|1,1,0]=3 81 B8R1.2 OCC1=NC=CN=C1 SBB054824 [1,0,0,0,0,0|2,1,0]=4 82 B8R1.2 OCC1=NC=NC=C1 SBB054828 [1,0,0,0,0,0|2,1,0]=4 83 B8R1.2 ONC1=CC=CC=C1 SBB008413 [1,0,0,0,0,0|1,1,0]=3 84 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [1,0,0,0,0,0|2,0,0]=3 85 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [0,1,0,0,0,0|0,1,1]=3 87 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [0,1,0,0,0,0|1,1,1]=4 88 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [0,1,0,0,0,0|0,1,1]=3 89 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [0,1,0,0,0,0|1,1,1]=4 90 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [0,1,0,0,0,0|0,1,1]=3 91 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [0,1,0,0,0,0|1,1,1]=4 92 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [0,1,0,0,0,0|0,1,1]=3 93 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [0,1,0,0,0,0|0,1,1]=3 94 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [0,1,0,0,0,0|0,1,1]=3 95 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [0,1,0,0,0,0|0,1,1]=3 96 B10R1.13 CC(C)C1=CC=C(N)C=C1 SBB040447 [0,1,0,0,0,0|1,0,0]=2 97 B10R1.13 CC(N)C1=CC=C(F)C=C1 SBB046789 [0,1,0,0,0,0|1,0,0]=2 98 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SBB063808 [0,1,0,0,0,0|0,1,0]=2 101 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [0,1,0,0,0,0|0,1,0]=2 102 B10R1.13 CC1=CC=C(B(O)O)C=C1 SBB048068 [0,1,0,0,0,0|2,1,0]=4 103 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [0,1,0,0,0,0|1,1,1]=4 105 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [0,1,0,0,0,0|1,1,1]=4 106 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,1,0,0,0,0|0,1,0]=2 109 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [0,1,0,0,0,0|1,1,1]=4 110 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [0,1,0,0,0,0|1,0,2]=4 111 B10R1.13 CN(C)C1=CC=C(Br)C=C1 SBB058575 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.13 CN(C)C1=CC=C(N)C=C1 SBB058715 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 SBB008470 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SBB064275 [0,1,0,0,0,0|0,1,0]=2 115 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SBB064274 [0,1,0,0,0,0|0,1,0]=2 116 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=N1 SBB054302 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 SBB089501 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SBB091235 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB073154 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB088979 [0,1,0,0,0,0|2,0,1]=4 121 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB003838 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB063615 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 N=C(\C1=CC=C(N)C=C1)N SBB005770 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [0,1,0,0,0,0|1,1,1]=4 125 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [0,1,0,0,0,0|1,1,1]=4 126 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [0,1,0,0,0,0|1,1,1]=4 127 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 SBB095205 [0,1,0,0,0,0|1,0,2]=4 128 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 SBB016508 [0,1,0,0,0,0|1,0,2]=4 129 B10R1.13 NC(=S)C1=CC=C(F)C=C1 SBB016503 [0,1,0,0,0,0|1,0,2]=4 130 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SBB066605 [0,1,0,0,0,0|1,0,2]=4 131 B10R1.13 NC(C)C1=CC=C(Br)C=C1 SBB006746 [0,1,0,0,0,0|1,0,0]=2 132 B10R1.13 NC(C)C1=CC=C(Cl)C=C1 SBB004019 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.13 NC1=CC=C(B(O)O)C=C1 SBB070184 [0,1,0,0,0,0|2,1,0]=4 134 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [0,1,0,0,0,0|1,1,1]=4 135 B10R1.13 NC1=CC=C(S(=O)O)C=C1 SBB072620 [0,1,0,0,0,0|2,1,0]=4 136 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 SBB059787 [0,1,0,0,0,0|2,1,0]=4 137 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [0,1,0,0,0,0|1,1,1]=4 138 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [0,1,0,0,0,0|1,1,1]=4 139 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [0,1,0,0,0,0|1,1,1]=4 140 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [0,1,0,0,0,0|1,1,1]=4 141 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [0,1,0,0,0,0|1,1,1]=4 142 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [0,1,0,0,0,0|1,1,1]=4 143 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [0,1,0,0,0,0|1,1,1]=4 144 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 SBB060983 [0,1,0,0,0,0|2,1,0]=4 145 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 SBB054149 [0,1,0,0,0,0|2,1,0]=4 146 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 SBB064696 [0,1,0,0,0,0|2,1,0]=4 147 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 SBB040875 [0,1,0,0,0,0|2,1,0]=4 148 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 SBB058973 [0,1,0,0,0,0|2,1,0]=4 149 B10R1.13 OB(O)C1=CC=C(Br)C=C1 SBB092695 [0,1,0,0,0,0|2,1,0]=4 150 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 SBB048060 [0,1,0,0,0,0|2,1,0]=4 151 B10R1.13 OB(O)C1=CC=C(F)C=C1 SBB048067 [0,1,0,0,0,0|2,1,0]=4 152 B10R1.13 OB(O)C1=CC=C(I)C=C1 SBB071088 [0,1,0,0,0,0|2,1,0]=4 153 B10R1.13 [NH3+]C1=CC=C(N(C)C)C=C1 SBB059799 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.15 BrCC(Br)C1=CC=CC=C1 SBB058656 [0,1,0,0,0,0|1,0,0]=2 155 B10R1.15 C#CC(=O)C1=CC=CC=C1 SBB012771 [0,1,0,0,0,0|0,1,2]=4 156 B10R1.15 C#CC(O)C1=CC=CC=C1 SBB008986 [0,1,0,0,0,0|0,1,1]=3 157 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [0,1,0,0,0,0|0,1,0]=2 158 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [0,1,0,0,0,0|0,1,0]=2 160 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [0,1,0,0,0,0|0,1,1]=3 161 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [0,1,0,0,0,0|1,1,1]=4 162 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [0,1,0,0,0,0|1,0,0]=2 163 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [0,1,0,0,0,0|0,1,0]=2 167 B10R1.15 CN(C=O)C1=CC=CC=C1 SBB056830 [0,1,0,0,0,0|1,1,0]=3 168 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [0,1,0,0,0,0|0,1,1]=3 169 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [0,1,0,0,0,0|1,0,1]=3 170 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [0,1,0,0,0,0|0,1,1]=3 171 B10R1.15 COC(=O)C1=CC=CC=N1 SBB008127 [0,1,0,0,0,0|1,1,1]=4 172 B10R1.15 COC(=O)C1=CC=NC=C1 SBB058848 [0,1,0,0,0,0|1,1,1]=4 173 B10R1.15 COC(=O)C1=CN=CC=C1 SBB040924 [0,1,0,0,0,0|1,1,1]=4 174 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.15 C\C(=N/N)C1=CC=CC=C1 SBB069878 [0,1,0,0,0,0|1,0,1]=3 176 B10R1.15 C\C(=N/O)C1=CC=NC=C1 SBB000069 [0,1,0,0,0,0|1,1,1]=4 177 B10R1.15 C\C(=N/O)C1=CN=CC=C1 SBB085929 [0,1,0,0,0,0|1,1,1]=4 178 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SBB085898 [0,1,0,0,0,0|0,1,1]=3 179 B10R1.15 C\C(=N\O)C1=CC=CC=N1 SBB085936 [0,1,0,0,0,0|1,1,1]=4 180 B10R1.15 ClCC(Cl)C1=CC=CC=C1 SBB007931 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.15 N#CC(=O)C1=CC=CC=C1 SBB058756 [0,1,0,0,0,0|0,1,2]=4 182 B10R1.15 N#CC(Br)C1=CC=CC=C1 SBB061313 [0,1,0,0,0,0|1,0,1]=3 183 B10R1.15 N#CC(N)C1=CC=CC=C1 SBB003872 [0,1,0,0,0,0|1,0,1]=3 184 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [0,1,0,0,0,0|0,1,1]=3 185 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [0,1,0,0,0,0|0,1,1]=3 186 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [0,1,0,0,0,0|0,1,0]=2 187 B10R1.15 NNC(=O)C1=CC=CC=C1 SBB040976 [0,1,0,0,0,0|1,1,1]=4 188 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SBB006667 [0,1,0,0,0,0|1,0,0]=2 189 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB015043 [0,1,0,0,0,0|1,1,1]=4 190 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB055109 [0,1,0,0,0,0|1,1,1]=4 191 B10R1.15 O=C(CBr)C1=CC=NC=C1 SBB051672 [0,1,0,0,0,0|1,1,1]=4 192 B10R1.15 O=C(CBr)C1=CN=CC=C1 SBB005582 [0,1,0,0,0,0|1,1,1]=4 193 B10R1.15 O=C(CBr)C1=NC=CC=C1 SBB005581 [0,1,0,0,0,0|1,1,1]=4 194 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [0,1,0,0,0,0|0,1,1]=3 195 B10R1.15 O=C(NO)C1=CC=CC=C1 SBB058405 [0,1,0,0,0,0|1,1,1]=4 196 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [0,1,0,0,0,0|0,1,2]=4 197 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [0,1,0,0,0,0|0,1,0]=2 198 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [0,1,0,0,0,0|0,1,0]=2 199 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [0,1,0,0,0,0|0,1,1]=3 200 B10R1.28 CC(C)(C)C1=CC=CC=C1 SBB040882 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.28 CC(C)(C)C1=CC=CC=N1 SBB085909 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.28 CC(C)(N)C1=CC=CC=C1 SBB028249 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 SBB037857 [0,1,0,0,0,0|1,1,0]=3 204 B10R1.28 FC(F)(Cl)C1=CN=CC=C1 SBB039118 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.28 FC(F)(F)C1=CC=NC=C1 SBB086525 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.28 FC(F)(F)C1=CN=CC=C1 SBB039117 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.28 FC(F)(F)C1=NC=CC=C1 SBB055693 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 SBB058202 [0,1,0,0,0,0|2,1,0]=4 209 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 SBB040880 [0,1,0,0,0,0|2,1,0]=4 210 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 SBB087419 [0,1,0,0,0,0|2,1,0]=4 211 B10R1.28 [NH-]S(=O)(=O)C1=CC=CC=C1 SBB087157 [0,1,0,0,0,0|2,1,0]=4 212 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [0,1,0,0,0,0|0,1,1]=3 213 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [0,1,0,0,0,0|0,1,1]=3 214 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [0,1,0,0,0,0|0,1,1]=3 215 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [0,1,0,0,0,0|0,1,1]=3 216 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [0,1,0,0,0,0|0,1,1]=3 217 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [0,1,0,0,0,0|0,1,1]=3 218 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [0,1,0,0,0,0|0,1,1]=3 219 B10R1.61 CC(=O)C1=CC=CN=C1F SBB065563 [0,1,0,0,0,0|1,1,1]=4 220 B10R1.61 CC(=O)C1=CC=NC=C1N SBB051881 [0,1,0,0,0,0|1,1,1]=4 221 B10R1.61 CC(=O)C1=CN=CC=C1C SBB055670 [0,1,0,0,0,0|1,1,1]=4 222 B10R1.61 CC(C)C1=C(Br)C=CC=C1 SBB092412 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.61 CC(C)C1=C(N)C=CC=C1 SBB040455 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 SBB046790 [0,1,0,0,0,0|1,0,0]=2 225 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [0,1,0,0,0,0|0,1,0]=2 226 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SBB040521 [0,1,0,0,0,0|1,1,1]=4 227 B10R1.61 CC1=C(C(N)=O)C=CC=C1 SBB007860 [0,1,0,0,0,0|1,1,1]=4 228 B10R1.61 CC1=CC=CC=C1B(O)O SBB052539 [0,1,0,0,0,0|2,1,0]=4 229 B10R1.61 CC1=CC=CC=C1C(N)=S SBB036004 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.61 CN(C)C1=C(N)C=NC=C1 SBB050376 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.61 CS(=O)C1=C(F)C=CC=C1 SBB087301 [0,1,0,0,0,0|1,1,0]=3 232 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [0,1,0,0,0,0|0,1,0]=2 233 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [0,1,0,0,0,0|0,1,0]=2 234 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [0,1,0,0,0,0|0,1,0]=2 235 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 SBB092542 [0,1,0,0,0,0|1,1,1]=4 236 B10R1.61 NC(=O)C1=C(F)C=CC=C1 SBB058361 [0,1,0,0,0,0|1,1,1]=4 237 B10R1.61 NC(=O)C1=C(N)C=CC=C1 SBB007561 [0,1,0,0,0,0|1,1,1]=4 238 B10R1.61 NC(=O)C1=C(O)C=CC=C1 SBB058584 [0,1,0,0,0,0|1,1,1]=4 239 B10R1.61 NC(=O)C1=CC=CC=C1Cl SBB004023 [0,1,0,0,0,0|1,1,1]=4 240 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 SBB095207 [0,1,0,0,0,0|1,0,2]=4 241 B10R1.61 NC(=S)C1=C(F)C=CC=C1 SBB016504 [0,1,0,0,0,0|1,0,2]=4 242 B10R1.61 NC(=S)C1=CC=CC=C1N SBB045972 [0,1,0,0,0,0|1,0,2]=4 243 B10R1.61 NC1=C([N+](=O)[O-])C=CC=C1 SBB040877 [0,1,0,0,0,0|2,1,0]=4 244 B10R1.61 NC1=CC=CC=C1B(O)O SBB069893 [0,1,0,0,0,0|2,1,0]=4 245 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 SBB040697 [0,1,0,0,0,0|1,1,1]=4 246 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=C1 SBB058743 [0,1,0,0,0,0|1,1,1]=4 247 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 SBB040627 [0,1,0,0,0,0|1,1,1]=4 248 B10R1.61 O=C(O)C1=CC=CC=C1Br SBB058412 [0,1,0,0,0,0|1,1,1]=4 249 B10R1.61 O=C(O)C1=CC=CC=C1Cl SBB040524 [0,1,0,0,0,0|1,1,1]=4 250 B10R1.61 O=C(O)C1=CC=CC=C1F SBB040569 [0,1,0,0,0,0|1,1,1]=4 251 B10R1.61 O=C(O)C1=CC=CC=C1I SBB063117 [0,1,0,0,0,0|1,1,1]=4 252 B10R1.61 O=C(O)C1=CC=CC=C1O SBB052826 [0,1,0,0,0,0|1,1,1]=4 253 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 SBB060648 [0,1,0,0,0,0|2,1,0]=4 254 B10R1.61 O=[N+]([O-])C1=CC=CC=C1Br SBB064688 [0,1,0,0,0,0|2,1,0]=4 255 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F SBB063156 [0,1,0,0,0,0|2,1,0]=4 256 B10R1.61 O=[N+]([O-])C1=CC=CC=C1I SBB064692 [0,1,0,0,0,0|2,1,0]=4 257 B10R1.61 OB(O)C1=C(F)C=CC=C1 SBB048079 [0,1,0,0,0,0|2,1,0]=4 258 B10R1.61 OB(O)C1=CC=CC=C1Cl SBB048063 [0,1,0,0,0,0|2,1,0]=4 259 B10R1.61 OB(O)C1=CC=CC=C1O SBB071215 [0,1,0,0,0,0|2,1,0]=4 260 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 SBB040258 [0,1,0,0,0,0|0,1,1]=3 261 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 SBB055121 [0,1,0,0,0,0|0,1,1]=3 262 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SBB055594 [0,1,0,0,0,0|1,1,1]=4 263 B10R1.113 CC(=O)C1=CC=CC(C)=C1 SBB061772 [0,1,0,0,0,0|0,1,1]=3 264 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SBB068974 [0,1,0,0,0,0|1,1,1]=4 265 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SBB063564 [0,1,0,0,0,0|0,1,1]=3 266 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SBB058713 [0,1,0,0,0,0|0,1,1]=3 267 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SBB040280 [0,1,0,0,0,0|0,1,1]=3 268 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 SBB054319 [0,1,0,0,0,0|1,1,1]=4 269 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 SBB065468 [0,1,0,0,0,0|1,1,1]=4 270 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 SBB055630 [0,1,0,0,0,0|1,1,1]=4 271 B10R1.113 CC(N)C1=CC(Br)=CC=C1 SBB047651 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 SBB046822 [0,1,0,0,0,0|1,0,0]=2 273 B10R1.113 CC(N)C1=CC=CC(O)=C1 SBB080427 [0,1,0,0,0,0|1,0,0]=2 274 B10R1.113 CC(O)C1=CC(N)=CC=C1 SBB008559 [0,1,0,0,0,0|0,1,0]=2 275 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SBB068833 [0,1,0,0,0,0|0,1,0]=2 276 B10R1.113 CC(O)C1=CC=C[N+]([O-])=C1 SBB086069 [0,1,0,0,0,0|1,1,0]=3 277 B10R1.113 CC1=CC(B(O)O)=CC=C1 SBB048058 [0,1,0,0,0,0|2,1,0]=4 278 B10R1.113 CC1=CC(C(Br)Br)=CC=C1 SBB061660 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.113 CC1=CC(C(N)=O)=CC=C1 SBB007861 [0,1,0,0,0,0|1,1,1]=4 280 B10R1.113 CC1=CC(N(C)C)=CC=C1 SBB008276 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 SBB058758 [0,1,0,0,0,0|1,1,1]=4 282 B10R1.113 CC1=CC=CC(C(=O)O)=C1 SBB040526 [0,1,0,0,0,0|1,1,1]=4 283 B10R1.113 CC1=CC=CC(C(C)C)=C1 SBB061535 [0,1,0,0,0,0|1,0,0]=2 284 B10R1.113 CC1=CC=CC(C(C)N)=C1 SBB046820 [0,1,0,0,0,0|1,0,0]=2 285 B10R1.113 CC1=CC=CC(C(N)=S)=C1 SBB086796 [0,1,0,0,0,0|1,0,2]=4 286 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 SBB008273 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.113 CN(C)C1=CC=CC(F)=C1 SBB086090 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SBB064272 [0,1,0,0,0,0|0,1,0]=2 289 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 SBB086151 [0,1,0,0,0,0|0,1,0]=2 290 B10R1.113 N=C(N)C1=CC(N)=CC=C1 SBB003839 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 SBB301617 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 SBB009893 [0,1,0,0,0,0|1,1,1]=4 293 B10R1.113 NC(=O)C1=CC=CC(F)=C1 SBB086055 [0,1,0,0,0,0|1,1,1]=4 294 B10R1.113 NC(=O)C1=CC=CC(N)=C1 SBB028153 [0,1,0,0,0,0|1,1,1]=4 295 B10R1.113 NC(=O)C1=CC=CC(O)=C1 SBB079277 [0,1,0,0,0,0|1,1,1]=4 296 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 SBB095206 [0,1,0,0,0,0|1,0,2]=4 297 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 SBB017686 [0,1,0,0,0,0|1,0,2]=4 298 B10R1.113 NC1=CC(C(=O)O)=CC=C1 SBB028148 [0,1,0,0,0,0|1,1,1]=4 299 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 SBB073008 [0,1,0,0,0,0|2,1,0]=4 300 B10R1.113 NC1=CC=CC(B(O)O)=C1 SBB052525 [0,1,0,0,0,0|2,1,0]=4 301 B10R1.113 NC1=CC=CC(C(=O)O)=C1 SBB017556 [0,1,0,0,0,0|1,1,1]=4 302 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 SBB058851 [0,1,0,0,0,0|2,1,0]=4 303 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 SBB040625 [0,1,0,0,0,0|1,1,1]=4 304 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 SBB058871 [0,1,0,0,0,0|1,1,1]=4 305 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 SBB040525 [0,1,0,0,0,0|1,1,1]=4 306 B10R1.113 O=C(O)C1=CC(F)=CC=C1 SBB052761 [0,1,0,0,0,0|1,1,1]=4 307 B10R1.113 O=C(O)C1=CC(I)=CC=C1 SBB052819 [0,1,0,0,0,0|1,1,1]=4 308 B10R1.113 O=C(O)C1=CC(O)=CC=C1 SBB058844 [0,1,0,0,0,0|1,1,1]=4 309 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 SBB058408 [0,1,0,0,0,0|1,1,1]=4 310 B10R1.113 O=[N+]([O-])C1=CC(F)=CC=C1 SBB064196 [0,1,0,0,0,0|2,1,0]=4 311 B10R1.113 O=[N+]([O-])C1=CC(I)=CC=C1 SBB064697 [0,1,0,0,0,0|2,1,0]=4 312 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 SBB061211 [0,1,0,0,0,0|2,1,0]=4 313 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 SBB063141 [0,1,0,0,0,0|2,1,0]=4 314 B10R1.113 OB(O)C1=CC(N)=CC=C1 SBB004197 [0,1,0,0,0,0|2,1,0]=4 315 B10R1.113 OB(O)C1=CC(O)=CC=C1 SBB052523 [0,1,0,0,0,0|2,1,0]=4 316 B10R1.113 OB(O)C1=CC=CC(Br)=C1 SBB092696 [0,1,0,0,0,0|2,1,0]=4 317 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 SBB048059 [0,1,0,0,0,0|2,1,0]=4 318 B10R1.113 OB(O)C1=CC=CC(F)=C1 SBB048069 [0,1,0,0,0,0|2,1,0]=4 319 B10R1.113 OB(O)C1=CC=CC(I)=C1 SBB071105 [0,1,0,0,0,0|2,1,0]=4 320 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [0,0,0,0,1,0|1,1,1]=4 321 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [0,0,0,0,1,0|1,1,1]=4 322 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [0,0,0,0,1,0|1,1,1]=4 323 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [0,0,0,0,1,0|1,1,1]=4 324 B8R1.7 CC(C)C1=NNC=C1 SBB026130 [0,0,0,0,1,0|3,0,0]=4 325 B8R1.7 CC(C)N1C=CC=N1 SBB025134 [0,0,0,0,1,0|3,0,0]=4 326 B8R1.7 CC(C)N1C=CN=C1 SBB046689 [0,0,0,0,1,0|3,0,0]=4 327 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [0,0,0,0,1,0|2,0,0]=3 328 B8R1.7 CC(N)C1=CC=CS1 SBB028228 [0,0,0,0,1,0|2,0,0]=3 329 B8R1.7 CN(C)C1=CC=CS1 SBB059107 [0,0,0,0,1,0|3,0,0]=4 330 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [0,0,0,0,0,1|1,1,1]=4 331 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,0,0,0,0,1|0,1,1]=3 332 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [0,0,0,0,0,1|1,1,1]=4 333 B10R1.18 CC(=O)NC1=CC=NC=C1 SBB085931 [0,0,0,0,0,1|1,1,1]=4 334 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [0,0,0,0,0,1|0,1,1]=3 335 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [0,0,0,0,0,1|0,0,2]=3 336 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [0,0,0,0,0,1|1,0,0]=2 337 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [0,0,0,0,0,1|2,0,0]=3 338 B10R1.18 CC(N)CC1=CN=CC=N1 SBB025636 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [0,0,0,0,0,1|2,0,0]=3 340 B10R1.18 C\[N+]([O-])=C/C1=CC=CC=C1 SBB085895 [0,0,0,0,0,1|1,1,0]=3 341 B10R1.18 FC(F)OC1=CC=CC=C1 SBB070688 [0,0,0,0,0,1|2,0,0]=3 342 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [0,0,0,0,0,1|1,1,1]=4 343 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [0,0,0,0,0,1|1,1,1]=4 344 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [0,0,0,0,0,1|1,0,2]=4 345 B10R1.18 NC(=S)NC1=CC=CC=C1 SBB036022 [0,0,0,0,0,1|1,0,2]=4 346 B10R1.18 NC(N)=NC1=CC=CC=C1 SBB055106 [0,0,0,0,0,1|2,0,1]=4 347 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [0,0,0,0,0,1|1,1,1]=4 348 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [0,0,0,0,0,1|1,1,1]=4 349 B10R1.18 OB(O)CC1=CC=CC=C1 SBB052526 [0,0,0,0,0,1|2,1,0]=4 350 B10R1.18 [NH2+](C(=O)Cl)C1=CC=CC=C1 SBB060746 [0,0,0,0,0,1|1,1,1]=4 351 B7R1.3 BrC1=CC=CN=C1 SBB003998 [2,0,0,0,0,0|2,0,0]=4 352 B7R1.3 BrC1=CC=NC=C1 SBB003600 [2,0,0,0,0,0|2,0,0]=4 353 B7R1.3 BrC1=NC=CC=C1 SBB003999 [2,0,0,0,0,0|2,0,0]=4 354 B7R1.3 CC1=CN=CC=N1 SBB060830 [2,0,0,0,0,0|2,0,0]=4 355 B7R1.3 ClC1=CC=CC=C1 SBB040899 [2,0,0,0,0,0|1,0,0]=3 356 B7R1.3 ClC1=NC=CC=C1 SBB079180 [2,0,0,0,0,0|2,0,0]=4 357 B7R1.3 FC1=CC=CN=C1 SBB054315 [2,0,0,0,0,0|2,0,0]=4 358 B7R1.3 FC1=CC=NC=C1 SBB054247 [2,0,0,0,0,0|2,0,0]=4 359 B7R1.3 FC1=NC=CC=C1 SBB062911 [2,0,0,0,0,0|2,0,0]=4 360 B7R1.3 IC1=CC=CN=C1 SBB054246 [2,0,0,0,0,0|2,0,0]=4 361 B7R1.3 IC1=CC=NC=C1 SBB009104 [2,0,0,0,0,0|2,0,0]=4 362 B7R1.3 IC1=NC=CC=C1 SBB054364 [2,0,0,0,0,0|2,0,0]=4 363 B7R1.3 NC1=CC=CC=N1 SBB004394 [2,0,0,0,0,0|2,0,0]=4 364 B7R1.3 NC1=CC=NC=C1 SBB004393 [2,0,0,0,0,0|2,0,0]=4 365 B7R1.3 NC1=CN=CC=C1 SBB004395 [2,0,0,0,0,0|2,0,0]=4 366 B7R1.3 O=C1C=CNC=C1 SBB005800 [2,0,0,0,0,0|1,1,0]=4 367 B7R1.3 OC1=CC=CC=N1 SBB004392 [2,0,0,0,0,0|1,1,0]=4 368 B7R1.3 OC1=CC=NC=C1 SBB000030 [2,0,0,0,0,0|1,1,0]=4 369 B7R1.3 OC1=CN=CC=C1 SBB004391 [2,0,0,0,0,0|1,1,0]=4 370 B7R1.3 SC1=CC=CC=N1 SBB058593 [2,0,0,0,0,0|1,0,0]=3 371 B7R1.3 SC1=NC=CC=N1 SBB007595 [2,0,0,0,0,0|2,0,0]=4 372 B7R1.3 [NH+]1=CC=C(Cl)C=C1 SBB058933 [2,0,0,0,0,0|2,0,0]=4 373 B9R1.1 BrCC1=CC=C(Br)C=C1 SBB040668 [1,1,0,0,0,0|1,0,0]=3 374 B9R1.1 BrCC1=CC=C(I)C=C1 SBB054901 [1,1,0,0,0,0|1,0,0]=3 375 B9R1.1 C#CC1=CC=C(Br)C=C1 SBB064530 [1,1,0,0,0,0|0,0,2]=4 376 B9R1.1 C#CC1=CC=C(F)C=C1 SBB064531 [1,1,0,0,0,0|0,0,2]=4 377 B9R1.1 CC1=CC=C(C#N)C=C1 SBB055483 [1,1,0,0,0,0|1,0,1]=4 378 B9R1.1 CC1=CC=C(CCl)C=C1 SBB040648 [1,1,0,0,0,0|1,0,0]=3 379 B9R1.1 CC1=CC=C(CN)C=C1 SBB040468 [1,1,0,0,0,0|1,0,0]=3 380 B9R1.1 CC1=CC=C(CO)C=C1 SBB063354 [1,1,0,0,0,0|0,1,0]=3 381 B9R1.1 CC1=CC=C(CS)C=C1 SBB086032 [1,1,0,0,0,0|0,0,0]=2 382 B9R1.1 CCC1=CC=C(Br)C=C1 SBB054183 [1,1,0,0,0,0|0,0,0]=2 383 B9R1.1 CCC1=CC=C(Br)C=C1 SBB060979 [1,1,0,0,0,0|0,0,0]=2 384 B9R1.1 CCC1=CC=C(C)N=C1 SBB060375 [1,1,0,0,0,0|1,0,0]=3 385 B9R1.1 CCC1=CC=C(F)C=C1 SBB085565 [1,1,0,0,0,0|0,0,0]=2 386 B9R1.1 CCC1=CC=C(N)C=C1 SBB040445 [1,1,0,0,0,0|0,0,0]=2 387 B9R1.1 CCC1=CC=C(O)C=C1 SBB057513 [1,1,0,0,0,0|0,0,0]=2 388 B9R1.1 CNC1=CC=C(N)C=C1 SBB003597 [1,1,0,0,0,0|1,0,0]=3 389 B9R1.1 COC1=CC=C(Br)C=C1 SBB060208 [1,1,0,0,0,0|1,0,0]=3 390 B9R1.1 COC1=CC=C(Br)C=N1 SBB059393 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.1 COC1=CC=C(C)C=C1 SBB060064 [1,1,0,0,0,0|1,0,0]=3 392 B9R1.1 COC1=CC=C(Cl)C=C1 SBB061022 [1,1,0,0,0,0|1,0,0]=3 393 B9R1.1 COC1=CC=C(F)C=C1 SBB085645 [1,1,0,0,0,0|1,0,0]=3 394 B9R1.1 COC1=CC=C(N)C=C1 SBB040441 [1,1,0,0,0,0|1,0,0]=3 395 B9R1.1 COC1=CC=C(O)C=C1 SBB060425 [1,1,0,0,0,0|1,0,0]=3 396 B9R1.1 COC1=NC=C(F)C=C1 SBB085672 [1,1,0,0,0,0|2,0,0]=4 397 B9R1.1 COC1=NC=C(N)C=C1 SBB016584 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.1 CSC1=CC=C(F)C=C1 SBB086252 [1,1,0,0,0,0|1,0,0]=3 399 B9R1.1 CSC1=CC=C(O)C=C1 SBB071908 [1,1,0,0,0,0|1,0,0]=3 400 B9R1.1 ClCC1=CC=C(Cl)C=C1 SBB058606 [1,1,0,0,0,0|1,0,0]=3 401 B9R1.1 ClCC1=CN=C(Cl)C=C1 SBB003948 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.1 FC1=CC=C(CBr)C=C1 SBB058857 [1,1,0,0,0,0|1,0,0]=3 403 B9R1.1 FC1=CC=C(CCl)C=C1 SBB040604 [1,1,0,0,0,0|1,0,0]=3 404 B9R1.1 FC1=CC=C([Zn]Br)C=C1 SBB099307 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.1 N#CC1=CC=C(Br)C=C1 SBB054163 [1,1,0,0,0,0|1,0,1]=4 406 B9R1.1 N#CC1=CC=C(Cl)C=C1 SBB028659 [1,1,0,0,0,0|1,0,1]=4 407 B9R1.1 N#CC1=CC=C(F)C=C1 SBB059276 [1,1,0,0,0,0|1,0,1]=4 408 B9R1.1 N#CC1=CC=C(I)C=C1 SBB017618 [1,1,0,0,0,0|1,0,1]=4 409 B9R1.1 N#CC1=CC=C(N)C=C1 SBB008363 [1,1,0,0,0,0|1,0,1]=4 410 B9R1.1 N#CC1=CC=C(O)C=C1 SBB008054 [1,1,0,0,0,0|1,0,1]=4 411 B9R1.1 NC1=CC=C(CO)C=C1 SBB063021 [1,1,0,0,0,0|0,1,0]=3 412 B9R1.1 NC1=CC=C(CO)C=N1 SBB085554 [1,1,0,0,0,0|1,1,0]=4 413 B9R1.1 NC1=CC=C(SC)C=C1 SBB006658 [1,1,0,0,0,0|1,0,0]=3 414 B9R1.1 NCC1=CC=C(Br)C=C1 SBB090347 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.1 NCC1=CC=C(Cl)C=C1 SBB004154 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.1 NCC1=CC=C(Cl)N=C1 SBB049618 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.1 NCC1=CC=C(F)C=C1 SBB017547 [1,1,0,0,0,0|1,0,0]=3 418 B9R1.1 NCC1=CC=C(F)C=C1 SBB028215 [1,1,0,0,0,0|1,0,0]=3 419 B9R1.1 NCC1=CC=C(I)C=C1 SBB052373 [1,1,0,0,0,0|1,0,0]=3 420 B9R1.1 NCC1=CC=C(N)C=C1 SBB002565 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.1 NCC1=CC=C(N)N=C1 SBB052464 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.1 NCC1=CC=C(O)C=C1 SBB046561 [1,1,0,0,0,0|1,0,0]=3 423 B9R1.1 NNC1=CC=C(Br)C=C1 SBB017153 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.1 NNC1=CC=C(Cl)C=C1 SBB017155 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.1 NNC1=CC=C(F)C=C1 SBB012626 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.1 NNC1=CC=C(F)C=C1 SBB063152 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.1 NNC1=CC=C(I)C=C1 SBB017151 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.1 O=CC1=CC=C(Br)C=C1 SBB007609 [1,1,0,0,0,0|0,1,1]=4 429 B9R1.1 O=CC1=CC=C(Cl)C=C1 SBB040227 [1,1,0,0,0,0|0,1,1]=4 430 B9R1.1 O=CC1=CC=C(F)C=C1 SBB040209 [1,1,0,0,0,0|0,1,1]=4 431 B9R1.1 O=CC1=CC=C(I)C=C1 SBB062822 [1,1,0,0,0,0|0,1,1]=4 432 B9R1.1 O=CC1=CC=C(O)C=C1 SBB028743 [1,1,0,0,0,0|0,1,1]=4 433 B9R1.1 OCC1=CC=C(Br)C=C1 SBB064717 [1,1,0,0,0,0|0,1,0]=3 434 B9R1.1 OCC1=CC=C(Cl)C=C1 SBB058581 [1,1,0,0,0,0|0,1,0]=3 435 B9R1.1 OCC1=CC=C(F)C=C1 SBB058560 [1,1,0,0,0,0|0,1,0]=3 436 B9R1.1 OCC1=CC=C(F)N=C1 SBB065619 [1,1,0,0,0,0|1,1,0]=4 437 B9R1.1 OCC1=CC=C(I)C=C1 SBB063681 [1,1,0,0,0,0|0,1,0]=3 438 B9R1.1 OCC1=CC=C(O)C=C1 SBB059322 [1,1,0,0,0,0|0,1,0]=3 439 B9R1.1 OCC1=CN=C(Cl)C=C1 SBB054780 [1,1,0,0,0,0|1,1,0]=4 440 B9R1.1 OCC1=NC=C(Br)C=C1 SBB065294 [1,1,0,0,0,0|1,1,0]=4 441 B9R1.1 OCC1=NC=C(Cl)C=C1 SBB086303 [1,1,0,0,0,0|1,1,0]=4 442 B9R1.1 SCC1=CC=C(Br)C=C1 SBB067614 [1,1,0,0,0,0|0,0,0]=2 443 B9R1.1 [NH2+](C)C1=CC=C(O)C=C1 SBB060652 [1,1,0,0,0,0|1,0,0]=3 444 B9R1.1 [NH3+]NC1=CC=C(C)C=C1 SBB058586 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.1 [NH3+]NC1=CC=C(Cl)C=C1 SBB058434 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.2 C#CC1=CC=CC(F)=C1 SBB064527 [1,1,0,0,0,0|0,0,2]=4 447 B9R1.2 C#CC1=CC=CC(N)=C1 SBB064269 [1,1,0,0,0,0|0,0,2]=4 448 B9R1.2 C#CC1=CC=CC(O)=C1 SBB005886 [1,1,0,0,0,0|0,0,2]=4 449 B9R1.2 CC1=CC(CN)=NC=C1 SBB052434 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.2 CC1=CC=CC(C#N)=C1 SBB059209 [1,1,0,0,0,0|1,0,1]=4 451 B9R1.2 CC1=CC=CC(CBr)=C1 SBB054906 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.2 CC1=CC=CC(CCl)=C1 SBB040670 [1,1,0,0,0,0|1,0,0]=3 454 B9R1.2 CC1=CC=CC(CN)=C1 SBB048016 [1,1,0,0,0,0|1,0,0]=3 455 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.2 CC1=CC=CC(CO)=C1 SBB064816 [1,1,0,0,0,0|0,1,0]=3 457 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [1,1,0,0,0,0|1,1,0]=4 458 B9R1.2 CC1=CC=CC(CS)=C1 SBB086034 [1,1,0,0,0,0|0,0,0]=2 459 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [1,1,0,0,0,0|0,0,0]=2 460 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [1,1,0,0,0,0|0,0,0]=2 461 B9R1.2 CCC1=CC=CC(Br)=C1 SBB090239 [1,1,0,0,0,0|0,0,0]=2 462 B9R1.2 CCC1=CC=NC(N)=C1 SBB028207 [1,1,0,0,0,0|1,0,0]=3 463 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [1,1,0,0,0,0|1,0,0]=3 464 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [1,1,0,0,0,0|1,0,0]=3 465 B9R1.2 CNC1=CC(Cl)=CC=C1 SBB086218 [1,1,0,0,0,0|1,0,0]=3 466 B9R1.2 COC1=CC(Br)=CC=C1 SBB007886 [1,1,0,0,0,0|1,0,0]=3 467 B9R1.2 COC1=CC(F)=CC=C1 SBB085642 [1,1,0,0,0,0|1,0,0]=3 468 B9R1.2 COC1=CC(N)=NC=C1 SBB051898 [1,1,0,0,0,0|2,0,0]=4 469 B9R1.2 COC1=CC(O)=CC=C1 SBB060932 [1,1,0,0,0,0|1,0,0]=3 470 B9R1.2 COC1=CC=CC(Br)=N1 SBB054383 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.2 COC1=CC=CC(C)=C1 SBB061028 [1,1,0,0,0,0|1,0,0]=3 472 B9R1.2 COC1=CC=CC(F)=N1 SBB085671 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.2 COC1=CC=CC(I)=C1 SBB059058 [1,1,0,0,0,0|1,0,0]=3 474 B9R1.2 COC1=CC=CC(N)=C1 SBB040499 [1,1,0,0,0,0|1,0,0]=3 475 B9R1.2 COC1=CC=CC(N)=N1 SBB051862 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.2 COC1=CN=CC(Br)=C1 SBB054402 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.2 COC1=NC=CC(Br)=C1 SBB054328 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.2 COC1=NC=CC(N)=C1 SBB051798 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.2 ClCC1=CC(Br)=CN=C1 SBB054923 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.2 ClCC1=CC(Cl)=CC=C1 SBB040671 [1,1,0,0,0,0|1,0,0]=3 481 B9R1.2 FC1=CC(CBr)=CC=C1 SBB090883 [1,1,0,0,0,0|1,0,0]=3 482 B9R1.2 FC1=CC=CC(CCl)=C1 SBB040605 [1,1,0,0,0,0|1,0,0]=3 483 B9R1.2 N#CC1=CC(Br)=CC=C1 SBB054164 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.2 N#CC1=CC(I)=CC=C1 SBB055464 [1,1,0,0,0,0|1,0,1]=4 485 B9R1.2 N#CC1=CC=CC(Cl)=C1 SBB063150 [1,1,0,0,0,0|1,0,1]=4 486 B9R1.2 N#CC1=CC=CC(F)=C1 SBB063653 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.2 N#CC1=CC=CC(N)=C1 SBB063161 [1,1,0,0,0,0|1,0,1]=4 488 B9R1.2 NC1=CC=CC(CO)=C1 SBB037932 [1,1,0,0,0,0|0,1,0]=3 489 B9R1.2 NC1=NC=CC(CO)=C1 SBB046494 [1,1,0,0,0,0|1,1,0]=4 490 B9R1.2 NCC1=CC(Br)=CN=C1 SBB090527 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.2 NCC1=CC(Cl)=CC=C1 SBB004155 [1,1,0,0,0,0|1,0,0]=3 492 B9R1.2 NCC1=CC(Cl)=NC=C1 SBB052439 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.2 NCC1=CC=CC(Br)=C1 SBB005796 [1,1,0,0,0,0|1,0,0]=3 494 B9R1.2 NCC1=CC=CC(F)=C1 SBB028218 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.2 NNC1=CC(Cl)=CC=C1 SBB017147 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.2 NNC1=CC=CC(Br)=C1 SBB064980 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.2 NNC1=CC=CC(Cl)=C1 SBB063250 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.2 NNC1=CC=CC(F)=C1 SBB063994 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.2 O=CC1=CC=CC(Br)=C1 SBB028648 [1,1,0,0,0,0|0,1,1]=4 500 B9R1.2 O=CC1=CC=CC(Cl)=C1 SBB040204 [1,1,0,0,0,0|0,1,1]=4 501 B9R1.2 O=CC1=CC=CC(F)=C1 SBB040273 [1,1,0,0,0,0|0,1,1]=4 502 B9R1.2 O=CC1=CC=CC(I)=C1 SBB064701 [1,1,0,0,0,0|0,1,1]=4 503 B9R1.2 O=CC1=CC=CC(O)=C1 SBB040208 [1,1,0,0,0,0|0,1,1]=4 504 B9R1.2 OCC1=CC(Br)=CN=C1 SBB065467 [1,1,0,0,0,0|1,1,0]=4 505 B9R1.2 OCC1=CC(Br)=NC=C1 SBB054782 [1,1,0,0,0,0|1,1,0]=4 506 B9R1.2 OCC1=CC(Cl)=CC=N1 SBB065656 [1,1,0,0,0,0|1,1,0]=4 507 B9R1.2 OCC1=CC(Cl)=NC=C1 SBB054800 [1,1,0,0,0,0|1,1,0]=4 508 B9R1.2 OCC1=CC(F)=CC=C1 SBB064188 [1,1,0,0,0,0|0,1,0]=3 509 B9R1.2 OCC1=CC(I)=CC=C1 SBB068728 [1,1,0,0,0,0|0,1,0]=3 510 B9R1.2 OCC1=CC(S)=CC=C1 SBB054760 [1,1,0,0,0,0|0,1,0]=3 511 B9R1.2 OCC1=CC=CC(Br)=C1 SBB063014 [1,1,0,0,0,0|0,1,0]=3 512 B9R1.2 OCC1=CC=CC(Cl)=C1 SBB064716 [1,1,0,0,0,0|0,1,0]=3 513 B9R1.2 OCC1=CC=CC(O)=C1 SBB068731 [1,1,0,0,0,0|0,1,0]=3 514 B9R1.2 OCC1=NC(Cl)=CC=C1 SBB054794 [1,1,0,0,0,0|1,1,0]=4 515 B9R1.2 [NH3+]CC1=CC(I)=CC=C1 SBB058984 [1,1,0,0,0,0|1,0,0]=3 516 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [1,1,0,0,0,0|0,0,0]=2 517 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [1,1,0,0,0,0|1,0,0]=3 518 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [1,1,0,0,0,0|0,0,0]=2 519 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [1,1,0,0,0,0|0,0,0]=2 520 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [1,1,0,0,0,0|0,0,0]=2 521 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.8 CNCC1=CC=NC=C1 SBB047816 [1,1,0,0,0,0|1,0,0]=3 523 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.8 CNCC1=NC=CN=C1 SBB014431 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.8 COCC1=CC=CC=C1 SBB063549 [1,1,0,0,0,0|0,0,0]=2 526 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [1,1,0,0,0,0|1,0,0]=3 527 B9R1.8 N#CCC1=CC=CC=C1 SBB058386 [1,1,0,0,0,0|0,0,1]=3 528 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [1,1,0,0,0,0|1,0,1]=4 529 B9R1.8 N#CCC1=CC=NC=C1 SBB066966 [1,1,0,0,0,0|1,0,1]=4 530 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [1,1,0,0,0,0|1,0,1]=4 531 B9R1.8 N#CSC1=CC=CC=C1 SBB060831 [1,1,0,0,0,0|1,0,1]=4 532 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [1,1,0,0,0,0|0,0,0]=2 533 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [1,1,0,0,0,0|1,0,0]=3 534 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [1,1,0,0,0,0|1,0,0]=3 535 B9R1.8 NCCC1=CC=NC=C1 SBB014221 [1,1,0,0,0,0|1,0,0]=3 536 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [1,1,0,0,0,0|1,0,0]=3 537 B9R1.8 NCCC1=NC=CN=C1 SBB010197 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.8 NNCC1=CC=CC=C1 SBB063024 [1,1,0,0,0,0|1,0,0]=3 539 B9R1.8 NOCC1=CC=CC=C1 SBB003971 [1,1,0,0,0,0|0,1,0]=3 540 B9R1.8 NOCC1=CC=CC=C1 SBB032957 [1,1,0,0,0,0|0,1,0]=3 541 B9R1.8 O=CCC1=CC=CC=C1 SBB061710 [1,1,0,0,0,0|0,0,1]=3 542 B9R1.8 O=CNC1=CC=CC=C1 SBB058769 [1,1,0,0,0,0|0,1,1]=4 543 B9R1.8 O=S=NC1=CC=CC=C1 SBB007761 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [1,1,0,0,0,0|0,0,0]=2 545 B9R1.8 S=C=NC1=CC=CC=C1 SBB040940 [1,1,0,0,0,0|0,0,2]=4 546 B9R1.8 SCCC1=CC=NC=C1 SBB065275 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.8 SCCC1=NC=CN=C1 SBB067078 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.15 BrCC1=CC=CN=C1Br SBB070876 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.15 CC1=C(C#N)C=CC=C1 SBB058479 [1,1,0,0,0,0|1,0,1]=4 550 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.15 CC1=C(CCl)C=CC=C1 SBB040606 [1,1,0,0,0,0|1,0,0]=3 552 B9R1.15 CC1=C(CN)C=CC=C1 SBB042694 [1,1,0,0,0,0|1,0,0]=3 553 B9R1.15 CC1=C(NN)C=CC=C1 SBB017148 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.15 CC1=C(NN)C=CC=C1 SBB064148 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.15 CC1=CC=CC=C1CO SBB065157 [1,1,0,0,0,0|0,1,0]=3 556 B9R1.15 CC1=CC=CC=C1CS SBB086035 [1,1,0,0,0,0|0,0,0]=2 557 B9R1.15 CC1=CC=CN=C1CN SBB052454 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.15 CCC1=C(N)C=CC=C1 SBB040452 [1,1,0,0,0,0|0,0,0]=2 559 B9R1.15 CCC1=CC=CC=C1C SBB061450 [1,1,0,0,0,0|0,0,0]=2 560 B9R1.15 CNC1=CC=CC=C1Cl SBB086216 [1,1,0,0,0,0|1,0,0]=3 561 B9R1.15 CNC1=CC=CC=C1F SBB051706 [1,1,0,0,0,0|1,0,0]=3 562 B9R1.15 CNC1=CC=CC=C1N SBB071575 [1,1,0,0,0,0|1,0,0]=3 563 B9R1.15 COC1=C(I)N=CC=C1 SBB098345 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.15 COC1=C(N)C=CC=C1 SBB028142 [1,1,0,0,0,0|1,0,0]=3 565 B9R1.15 COC1=C(O)C=CC=C1 SBB058681 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.15 COC1=CC=CC=C1Cl SBB060957 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.15 COC1=CC=CC=C1F SBB040818 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.15 COC1=CC=CN=C1Br SBB005633 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.15 COC1=CC=CN=C1N SBB051907 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.15 COC1=CC=CN=C1O SBB046500 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.15 CSC1=C(Br)C=CC=C1 SBB006566 [1,1,0,0,0,0|1,0,0]=3 572 B9R1.15 CSC1=C(Cl)C=CC=C1 SBB058978 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.15 CSC1=NC=CC=C1N SBB072554 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.15 ClCC1=C(Cl)C=CC=C1 SBB040669 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.15 FC1=C(CBr)C=CC=C1 SBB058868 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.15 FC1=C(CCl)C=CC=C1 SBB040603 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.15 N#CC1=C(Br)C=CC=C1 SBB008569 [1,1,0,0,0,0|1,0,1]=4 578 B9R1.15 N#CC1=C(Cl)C=CC=C1 SBB058443 [1,1,0,0,0,0|1,0,1]=4 579 B9R1.15 N#CC1=C(I)C=CC=C1 SBB059075 [1,1,0,0,0,0|1,0,1]=4 580 B9R1.15 N#CC1=C(N)C=CC=C1 SBB059814 [1,1,0,0,0,0|1,0,1]=4 581 B9R1.15 N#CC1=C(O)C=CC=C1 SBB007959 [1,1,0,0,0,0|1,0,1]=4 582 B9R1.15 N#CC1=CC=CC=C1F SBB063132 [1,1,0,0,0,0|1,0,1]=4 583 B9R1.15 NC1=C(CO)C=CC=C1 SBB058759 [1,1,0,0,0,0|0,1,0]=3 584 B9R1.15 NC1=CC=CC=C1C=O SBB061591 [1,1,0,0,0,0|0,1,1]=4 585 B9R1.15 NC1=CC=NC=C1CO SBB054791 [1,1,0,0,0,0|1,1,0]=4 586 B9R1.15 NC1=CN=CC=C1CO SBB054795 [1,1,0,0,0,0|1,1,0]=4 587 B9R1.15 NC1=NC=CC=C1CO SBB054786 [1,1,0,0,0,0|1,1,0]=4 588 B9R1.15 NCC1=C(Cl)C=CC=C1 SBB004151 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.15 NCC1=C(F)C=CC=C1 SBB028214 [1,1,0,0,0,0|1,0,0]=3 590 B9R1.15 NCC1=CC=CC=C1Br SBB052369 [1,1,0,0,0,0|1,0,0]=3 591 B9R1.15 NCC1=CC=CC=C1Br SBB052411 [1,1,0,0,0,0|1,0,0]=3 592 B9R1.15 NNC1=C(Cl)C=CC=C1 SBB017145 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.15 NNC1=CC=CC=C1Br SBB017150 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.15 NNC1=CC=CC=C1Br SBB063185 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.15 NNC1=CC=CC=C1F SBB012668 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.15 NNC1=CC=CC=C1F SBB063993 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.15 NNC1=CC=CC=C1I SBB001769 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.15 O=CC1=CC=CC=C1Br SBB040217 [1,1,0,0,0,0|0,1,1]=4 599 B9R1.15 O=CC1=CC=CC=C1Cl SBB040228 [1,1,0,0,0,0|0,1,1]=4 600 B9R1.15 O=CC1=CC=CC=C1F SBB040198 [1,1,0,0,0,0|0,1,1]=4 601 B9R1.15 O=CC1=CC=CC=C1I SBB017119 [1,1,0,0,0,0|0,1,1]=4 602 B9R1.15 O=CC1=CC=CC=C1O SBB040225 [1,1,0,0,0,0|0,1,1]=4 603 B9R1.15 OCC1=C(F)C=CC=C1 SBB064085 [1,1,0,0,0,0|0,1,0]=3 604 B9R1.15 OCC1=C(O)C=CC=N1 SBB085588 [1,1,0,0,0,0|1,1,0]=4 605 B9R1.15 OCC1=CC=CC=C1Br SBB063922 [1,1,0,0,0,0|0,1,0]=3 606 B9R1.15 OCC1=CC=CC=C1Cl SBB058557 [1,1,0,0,0,0|0,1,0]=3 607 B9R1.15 OCC1=CC=CC=C1O SBB065036 [1,1,0,0,0,0|0,1,0]=3 608 B9R1.15 OCC1=CC=CN=C1Cl SBB054785 [1,1,0,0,0,0|1,1,0]=4 609 B9R1.15 SCC1=CC=CC=C1Br SBB066540 [1,1,0,0,0,0|0,0,0]=2 610 B9R1.15 [NH3+]NC1=CC=CC=C1Cl SBB058433 [1,1,0,0,0,0|2,0,0]=4 611 B9R1.11 CCC(N)C1=CC=CS1 SBB018551 [0,1,0,0,1,0|2,0,0]=4 612 B9R1.11 CNC(C)C1=CC=CO1 SBB302114 [0,1,0,0,1,0|2,0,0]=4 613 B9R1.19 CC(C)(O)C1=CC=CS1 SBB073587 [0,1,0,0,1,0|1,1,0]=4 614 B9R1.35 CC(O)C1=CC=C(F)S1 SBB073298 [0,1,0,0,1,0|1,1,0]=4 615 B9R1.35 CC1=CC=C(C(C)N)O1 SBB010239 [0,1,0,0,1,0|2,0,0]=4 616 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SBB058424 [0,1,0,0,0,1|0,1,1]=4 617 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [0,1,0,0,0,1|0,1,1]=4 618 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SBB054161 [0,1,0,0,0,1|0,1,1]=4 619 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [0,1,0,0,0,1|0,1,1]=4 620 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SBB058218 [0,1,0,0,0,1|0,1,1]=4 621 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SBB086906 [0,1,0,0,0,1|0,1,1]=4 622 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB028292 [0,1,0,0,0,1|0,1,1]=4 623 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB090514 [0,1,0,0,0,1|0,1,1]=4 624 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SBB043758 [0,1,0,0,0,1|0,1,1]=4 625 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [0,1,0,0,0,1|0,1,1]=4 626 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [0,1,0,0,0,1|0,1,1]=4 627 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 SBB047818 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.20 CC(C)OC1=CC=C(N)C=C1 SBB010330 [0,1,0,0,0,1|1,0,0]=3 629 B11R1.20 CC(N)CC1=CC=C(Cl)C=C1 SBB000454 [0,1,0,0,0,1|1,0,0]=3 630 B11R1.20 CC(N)CC1=CC=C(F)C=C1 SBB052387 [0,1,0,0,0,1|1,0,0]=3 631 B11R1.20 CC1=CC=C(OC(F)F)C=C1 SBB087277 [0,1,0,0,0,1|2,0,0]=4 632 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 SBB109890 [0,1,0,0,0,1|2,0,0]=4 633 B11R1.20 FC(F)OC1=CC=C(Br)C=C1 SBB096413 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.20 NC1=CC=C(OC(F)F)C=C1 SBB003981 [0,1,0,0,0,1|2,0,0]=4 635 B11R1.20 NC1=CC=C(SC(F)F)C=C1 SBB073004 [0,1,0,0,0,1|2,0,0]=4 636 B11R1.20 SC1=CC=C(NC(C)=O)C=C1 SBB003881 [0,1,0,0,0,1|0,1,1]=4 637 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SBB064017 [0,1,0,0,0,1|0,1,1]=4 638 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 SBB055478 [0,1,0,0,0,1|0,1,1]=4 639 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SBB086654 [0,1,0,0,0,1|0,1,1]=4 640 B11R1.36 CC(=O)N(O)C1=CC=CC=C1 SBB058639 [0,1,0,0,0,1|0,1,1]=4 641 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 SBB058576 [0,1,0,0,0,1|1,0,0]=3 642 B11R1.36 CN(C)C(=O)C1=CC=CC=C1 SBB058219 [0,1,0,0,0,1|2,0,0]=4 643 B11R1.36 O=C(C1=CC=CC=C1)C(F)F SBB087123 [0,1,0,0,0,1|2,0,0]=4 644 B11R1.40 C1=CC=C(NC(=S)NC)C=C1 SBB003887 [0,1,0,0,0,1|0,0,2]=4 645 B11R1.40 CC(CN)OC1=CC=CC=C1 SBB028307 [0,1,0,0,0,1|1,0,0]=3 646 B11R1.40 CCC(=O)CC1=CC=CC=C1 SBB060892 [0,1,0,0,0,1|0,1,1]=4 647 B11R1.40 CNC(=O)NC1=CC=CC=C1 SBB008334 [0,1,0,0,0,1|0,1,1]=4 648 B11R1.40 CNC(C)CC1=CC=CC=N1 SBB025630 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 SBB040229 [0,1,0,0,0,1|0,1,1]=4 650 B11R1.40 NCC(=O)NC1=CC=CC=C1 SBB004992 [0,1,0,0,0,1|0,1,1]=4 651 B11R1.40 O=C(CBr)NC1=CC=CC=C1 SBB051003 [0,1,0,0,0,1|0,1,1]=4 652 B11R1.40 O=C(CCl)NC1=CC=CC=C1 SBB030441 [0,1,0,0,0,1|0,1,1]=4 653 B11R1.40 O=C(CCl)OC1=CC=CC=C1 SBB060340 [0,1,0,0,0,1|0,1,1]=4 654 B11R1.40 O=C(CS)NC1=CC=CC=C1 SBB008339 [0,1,0,0,0,1|0,1,1]=4 655 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SBB054187 [0,1,0,0,0,1|0,1,1]=4 656 B11R1.86 CC(=O)CC1=CC=CC=C1F SBB086844 [0,1,0,0,0,1|0,1,1]=4 657 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 SBB084427 [0,1,0,0,0,1|0,1,1]=4 658 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 SBB048028 [0,1,0,0,0,1|0,1,1]=4 659 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SBB080001 [0,1,0,0,0,1|0,1,1]=4 660 B11R1.86 CC(=O)NC1=CC=CC=C1Br SBB094902 [0,1,0,0,0,1|0,1,1]=4 661 B11R1.86 CC(=O)NC1=CC=CC=C1C SBB058208 [0,1,0,0,0,1|0,1,1]=4 662 B11R1.86 CC(=O)NC1=CC=CC=C1F SBB055359 [0,1,0,0,0,1|0,1,1]=4 663 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 SBB060700 [0,1,0,0,0,1|0,1,1]=4 664 B11R1.86 CC(=O)OC1=CC=CC=C1F SBB086981 [0,1,0,0,0,1|0,1,1]=4 665 B11R1.86 CC(C)OC1=CC=CC=C1N SBB010329 [0,1,0,0,0,1|1,0,0]=3 666 B11R1.86 CC1=CC=CC=C1OC(C)C SBB079028 [0,1,0,0,0,1|1,0,0]=3 667 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 SBB109891 [0,1,0,0,0,1|2,0,0]=4 668 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB080144 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB111386 [0,1,0,0,0,1|2,0,0]=4 670 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 SBB096418 [0,1,0,0,0,1|2,0,0]=4 671 B11R1.86 NC1=CC=CC=C1OC(F)F SBB003980 [0,1,0,0,0,1|2,0,0]=4 672 B11R1.157 C(F)(F)OC1=CC=CC(N)=C1 SBB073340 [0,1,0,0,0,1|2,0,0]=4 673 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 SBB086850 [0,1,0,0,0,1|0,1,1]=4 674 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 SBB051044 [0,1,0,0,0,1|0,1,1]=4 675 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [0,1,0,0,0,1|0,1,1]=4 676 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 SBB088343 [0,1,0,0,0,1|0,1,1]=4 677 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 SBB086915 [0,1,0,0,0,1|0,1,1]=4 678 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 SBB008515 [0,1,0,0,0,1|0,1,1]=4 679 B11R1.157 CC(=O)NC1=CC(O)=CC=C1 SBB055395 [0,1,0,0,0,1|0,1,1]=4 680 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 SBB060031 [0,1,0,0,0,1|0,1,1]=4 681 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SBB086985 [0,1,0,0,0,1|0,1,1]=4 682 B11R1.157 CC(C)OC1=CC=CC(N)=C1 SBB010221 [0,1,0,0,0,1|1,0,0]=3 683 B11R1.157 CC1=NC(CC(C)O)=CC=C1 SBB025634 [0,1,0,0,0,1|1,1,0]=4 684 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 SBB109591 [0,1,0,0,0,1|2,0,0]=4 685 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 SBB096417 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.509 CC(C)(O)CC1=CC=CC=C1 SBB071444 [0,1,0,0,0,1|0,1,0]=3 687 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 SBB059072 [0,1,0,0,0,1|1,1,0]=4 688 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 SBB008328 [0,1,0,0,0,1|1,1,0]=4 689 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB055074 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB059062 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060274 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060930 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.509 FC(F)(F)OC1=CC=CC=C1 SBB087565 [0,1,0,0,0,1|2,0,0]=4 694 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SBB055505 [0,2,0,0,0,0|1,0,1]=4 695 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SBB063042 [0,2,0,0,0,0|0,1,1]=4 696 B11R1.3 CC(C)C1=CC=C(C#N)C=C1 SBB086428 [0,2,0,0,0,0|1,0,0]=3 697 B11R1.3 CC(C)C1=CC=C(C=O)C=C1 SBB040237 [0,2,0,0,0,0|1,0,0]=3 698 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 SBB042664 [0,2,0,0,0,0|1,0,0]=3 699 B11R1.3 CC(C)C1=CC=C(CN)C=C1 SBB017646 [0,2,0,0,0,0|1,0,0]=3 700 B11R1.3 CC(C)C1=CC=C(CO)C=C1 SBB065188 [0,2,0,0,0,0|1,0,0]=3 701 B11R1.3 CC(C)C1=CC=C(NN)C=C1 SBB063839 [0,2,0,0,0,0|1,0,0]=3 702 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SBB040909 [0,2,0,0,0,0|0,1,1]=4 703 B11R1.3 CCC1=CC=C(C(C)N)C=C1 SBB016483 [0,2,0,0,0,0|1,0,0]=3 704 B11R1.3 CN(C)C1=CC=C(C#N)C=C1 SBB008018 [0,2,0,0,0,0|2,0,0]=4 705 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 SBB008757 [0,2,0,0,0,0|2,0,0]=4 706 B11R1.3 CN(C)C1=CC=C(CO)C=C1 SBB059054 [0,2,0,0,0,0|2,0,0]=4 707 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 SBB058598 [0,2,0,0,0,0|2,0,0]=4 708 B11R1.3 COC1=CC=C(C(C)=O)C=C1 SBB040242 [0,2,0,0,0,0|0,1,1]=4 709 B11R1.3 COC1=CC=C(C(C)N)C=C1 SBB007015 [0,2,0,0,0,0|1,0,0]=3 710 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 SBB088031 [0,2,0,0,0,0|0,1,1]=4 711 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 SBB054162 [0,2,0,0,0,0|1,0,0]=3 712 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 SBB007738 [0,2,0,0,0,0|1,0,0]=3 713 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 SBB060742 [0,2,0,0,0,0|1,0,0]=3 714 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 SBB086788 [0,2,0,0,0,0|2,0,0]=4 715 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 SBB052375 [0,2,0,0,0,0|1,0,0]=3 716 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 SBB052370 [0,2,0,0,0,0|1,0,0]=3 717 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 SBB087016 [0,2,0,0,0,0|0,1,0]=3 718 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 SBB052376 [0,2,0,0,0,0|1,0,0]=3 719 B11R1.19 CC1=CC=C(C(C)(C)O)C=C1 SBB063535 [0,2,0,0,0,0|0,1,0]=3 720 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 SBB087416 [0,2,0,0,0,0|2,0,0]=4 721 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 SBB059073 [0,2,0,0,0,0|1,1,0]=4 722 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 SBB006294 [0,2,0,0,0,0|1,1,0]=4 723 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 SBB006326 [0,2,0,0,0,0|1,1,0]=4 724 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 SBB088901 [0,2,0,0,0,0|1,1,0]=4 725 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 SBB048033 [0,2,0,0,0,0|1,1,0]=4 726 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 SBB049566 [0,2,0,0,0,0|1,1,0]=4 727 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 SBB096753 [0,2,0,0,0,0|2,0,0]=4 728 B11R1.19 FC(F)(F)C1=CC=C(Cl)C=C1 SBB089721 [0,2,0,0,0,0|2,0,0]=4 729 B11R1.19 FC(F)(F)C1=CC=C(S)C=C1 SBB089395 [0,2,0,0,0,0|2,0,0]=4 730 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 SBB087758 [0,2,0,0,0,0|2,0,0]=4 731 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 SBB003956 [0,2,0,0,0,0|2,0,0]=4 732 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 SBB051729 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.19 [NH3+]C1=CC=C(S(C)(=O)=O)C=C1 SBB058965 [0,2,0,0,0,0|1,1,0]=4 734 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 SBB055073 [0,2,0,0,0,0|0,1,1]=4 735 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 SBB040254 [0,2,0,0,0,0|0,1,1]=4 736 B11R1.21 CC(=O)C1=CC(N)=C(Cl)C=C1 SBB055484 [0,2,0,0,0,0|0,1,1]=4 737 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 SBB063673 [0,2,0,0,0,0|0,1,1]=4 738 B11R1.21 CC(=O)C1=CC=C(C)C(F)=C1 SBB086851 [0,2,0,0,0,0|0,1,1]=4 739 B11R1.21 CC(=O)C1=CC=C(Cl)C(F)=C1 SBB064325 [0,2,0,0,0,0|0,1,1]=4 740 B11R1.21 CC(=O)C1=CC=C(F)C(Br)=C1 SBB063810 [0,2,0,0,0,0|0,1,1]=4 741 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 SBB063231 [0,2,0,0,0,0|0,1,1]=4 742 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 SBB016583 [0,2,0,0,0,0|0,1,1]=4 743 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 SBB063472 [0,2,0,0,0,0|0,1,1]=4 744 B11R1.21 CC(=O)C1=CC=C(O)C(Cl)=C1 SBB088451 [0,2,0,0,0,0|0,1,1]=4 745 B11R1.21 CC(=O)C1=CC=C(O)C(F)=C1 SBB086987 [0,2,0,0,0,0|0,1,1]=4 746 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 SBB061719 [0,2,0,0,0,0|0,1,1]=4 747 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 SBB013738 [0,2,0,0,0,0|1,0,0]=3 748 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 SBB009345 [0,2,0,0,0,0|1,0,0]=3 749 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 SBB060790 [0,2,0,0,0,0|1,0,0]=3 750 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SBB038706 [0,2,0,0,0,0|0,1,1]=4 751 B11R1.22 CC1=CC=C(C(O)C#N)C=C1 SBB086534 [0,2,0,0,0,0|0,1,1]=4 752 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SBB058414 [0,2,0,0,0,0|0,1,1]=4 753 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SBB056753 [0,2,0,0,0,0|0,1,1]=4 754 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SBB035779 [0,2,0,0,0,0|0,1,1]=4 755 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 SBB058461 [0,2,0,0,0,0|0,1,1]=4 756 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SBB040250 [0,2,0,0,0,0|0,1,1]=4 757 B11R1.22 CCC(N)C1=CC=C(C)C=C1 SBB017924 [0,2,0,0,0,0|1,0,0]=3 758 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 SBB046785 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.22 CCC(N)C1=CC=C(F)C=C1 SBB010339 [0,2,0,0,0,0|1,0,0]=3 760 B11R1.22 CCC(N)C1=CC=C(O)C=C1 SBB080407 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.22 CCC(O)C1=CC=C(F)C=C1 SBB087018 [0,2,0,0,0,0|0,1,0]=3 762 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SBB051043 [0,2,0,0,0,0|0,1,1]=4 763 B11R1.22 CNC(=O)C1=CC=C(C)C=C1 SBB008263 [0,2,0,0,0,0|0,1,1]=4 764 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 SBB003861 [0,2,0,0,0,0|0,1,1]=4 765 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SBB000104 [0,2,0,0,0,0|0,1,1]=4 766 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SBB063144 [0,2,0,0,0,0|0,1,1]=4 767 B11R1.22 COC(=O)C1=CC=C(C)C=C1 SBB064103 [0,2,0,0,0,0|0,1,1]=4 768 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SBB063826 [0,2,0,0,0,0|0,1,1]=4 769 B11R1.22 COC(=O)C1=CC=C(F)C=C1 SBB053694 [0,2,0,0,0,0|0,1,1]=4 770 B11R1.22 COC(=O)C1=CC=C(I)C=C1 SBB063273 [0,2,0,0,0,0|0,1,1]=4 771 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SBB040908 [0,2,0,0,0,0|0,1,1]=4 772 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 SBB029872 [0,2,0,0,0,0|0,1,1]=4 773 B11R1.22 N#C[C@H](O)C1=CC=C(Cl)C=C1 SBB088117 [0,2,0,0,0,0|0,1,1]=4 774 B11R1.22 NC1=CC=C(C(=O)OC)C=C1 SBB004063 [0,2,0,0,0,0|0,1,1]=4 775 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SBB100801 [0,2,0,0,0,0|0,1,1]=4 776 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB017900 [0,2,0,0,0,0|0,1,1]=4 777 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SBB093579 [0,2,0,0,0,0|0,1,1]=4 778 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 SBB038654 [0,2,0,0,0,0|0,1,1]=4 779 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 SBB006561 [0,2,0,0,0,0|0,1,1]=4 780 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 SBB086841 [0,2,0,0,0,0|0,1,1]=4 781 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 SBB086842 [0,2,0,0,0,0|0,1,1]=4 782 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 SBB071469 [0,2,0,0,0,0|0,1,1]=4 783 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 SBB040836 [0,2,0,0,0,0|0,1,1]=4 784 B11R1.166 CC(=O)C1=CC=C(C)C=C1C SBB058451 [0,2,0,0,0,0|0,1,1]=4 785 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl SBB063949 [0,2,0,0,0,0|0,1,1]=4 786 B11R1.166 CC(=O)C1=CC=C(F)C=C1Br SBB064291 [0,2,0,0,0,0|0,1,1]=4 787 B11R1.166 CC(=O)C1=CC=C(F)C=C1Cl SBB064482 [0,2,0,0,0,0|0,1,1]=4 788 B11R1.166 CC(=O)C1=CC=C(F)C=C1F SBB063127 [0,2,0,0,0,0|0,1,1]=4 789 B11R1.166 CC(=O)C1=CC=C(F)C=C1O SBB063885 [0,2,0,0,0,0|0,1,1]=4 790 B11R1.166 CC(=O)C1=CC=C(O)C=C1C SBB063800 [0,2,0,0,0,0|0,1,1]=4 791 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 SBB046783 [0,2,0,0,0,0|1,0,0]=3 792 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 SBB059023 [0,2,0,0,0,0|1,0,0]=3 793 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 SBB073013 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.166 CC1=CC(Br)=CC=C1N(C)C SBB094912 [0,2,0,0,0,0|2,0,0]=4 795 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 SBB020377 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 SBB060429 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F SBB070347 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 SBB008971 [0,2,0,0,0,0|0,1,0]=3 799 B11R1.7 C#CC(C)(O)C1=CC=CN=C1 SBB013344 [0,2,0,0,0,0|1,1,0]=4 800 B11R1.7 C#CC(C)(O)C1=CC=NC=C1 SBB014399 [0,2,0,0,0,0|1,1,0]=4 801 B11R1.7 C#CC(C)(O)C1=NC=CC=C1 SBB014396 [0,2,0,0,0,0|1,1,0]=4 802 B11R1.7 CC(C)(CN)C1=CC=CC=C1 SBB052397 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.7 CCC(C)(C)C1=CC=CC=C1 SBB060977 [0,2,0,0,0,0|1,0,0]=3 804 B11R1.7 CNS(=O)(=O)C1=CC=CC=C1 SBB058121 [0,2,0,0,0,0|1,1,0]=4 805 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 SBB040933 [0,2,0,0,0,0|1,1,0]=4 806 B11R1.12 CCC(C#N)C1=CC=CC=C1 SBB068828 [0,2,0,0,0,0|1,0,0]=3 807 B11R1.12 CCC(CC)C1=CC=CC=C1 SBB060456 [0,2,0,0,0,0|1,0,0]=3 808 B11R1.12 CCC(CN)C1=CC=CC=C1 SBB073168 [0,2,0,0,0,0|1,0,0]=3 809 B11R1.12 CCN(CC)C1=CC=CC=C1 SBB060520 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.12 CC\C(=N/O)C1=CC=CC=C1 SBB080355 [0,2,0,0,0,0|0,1,1]=4 811 B11R1.12 N#CC(CO)C1=CC=CC=C1 SBB059710 [0,2,0,0,0,0|1,0,0]=3 812 B11R1.12 O\N=C(/CBr)C1=CC=CC=C1 SBB085154 [0,2,0,0,0,0|0,1,1]=4 813 B11R1.16 CC(CCN)C1=CC=CC=C1 SBB085501 [0,2,0,0,0,0|1,0,0]=3 814 B11R1.16 CC(N=C=O)C1=CC=CC=C1 SBB023344 [0,2,0,0,0,0|0,1,0]=3 815 B11R1.16 CC(N=C=S)C1=CC=CC=C1 SBB029868 [0,2,0,0,0,0|0,0,1]=3 816 B11R1.16 CC(NC=O)C1=CC=CC=C1 SBB068791 [0,2,0,0,0,0|0,1,0]=3 817 B11R1.16 CCCC(=O)C1=CC=CC=C1 SBB058761 [0,2,0,0,0,0|0,1,1]=4 818 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 SBB070021 [0,2,0,0,0,0|1,0,0]=3 819 B11R1.16 CCNC(=O)C1=CC=CC=C1 SBB058216 [0,2,0,0,0,0|0,1,1]=4 820 B11R1.16 CCOC(=O)C1=CC=CC=C1 SBB058595 [0,2,0,0,0,0|0,1,1]=4 821 B11R1.16 CN(CCN)C1=CC=CC=C1 SBB085429 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.16 CN(CCO)C1=CC=CC=C1 SBB007818 [0,2,0,0,0,0|1,1,0]=4 823 B11R1.16 CNCC(C)C1=CC=CC=C1 SBB028094 [0,2,0,0,0,0|1,0,0]=3 824 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SBB004121 [0,2,0,0,0,0|0,1,1]=4 825 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SBB063710 [0,2,0,0,0,0|0,1,1]=4 826 B11R1.16 O=C(CCF)C1=CC=CC=C1 SBB063711 [0,2,0,0,0,0|0,1,1]=4 827 B11R1.16 O=C(SCO)C1=CC=CC=C1 SBB088192 [0,2,0,0,0,0|0,1,1]=4 828 B11R1.16 OC(C#CBr)C1=CC=CC=C1 SBB013371 [0,2,0,0,0,0|0,1,1]=4 829 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 SBB012414 [0,2,0,0,0,0|0,1,1]=4 830 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 SBB058431 [0,2,0,0,0,0|0,1,1]=4 831 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SBB086852 [0,2,0,0,0,0|0,1,1]=4 832 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 SBB046784 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.23 CCC(O)C1=CC(F)=CC=C1 SBB087015 [0,2,0,0,0,0|0,1,0]=3 834 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 SBB051764 [0,2,0,0,0,0|0,1,1]=4 835 B11R1.23 COC(=O)C1=CC(O)=CC=C1 SBB040838 [0,2,0,0,0,0|0,1,1]=4 836 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 SBB063142 [0,2,0,0,0,0|0,1,1]=4 837 B11R1.23 COC(=O)C1=CC=CC(C)=C1 SBB063121 [0,2,0,0,0,0|0,1,1]=4 838 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 SBB063165 [0,2,0,0,0,0|0,1,1]=4 839 B11R1.23 COC(=O)C1=CC=CC(N)=C1 SBB028299 [0,2,0,0,0,0|0,1,1]=4 840 B11R1.23 NCC(O)C1=CC(O)=CC=C1 SBB000279 [0,2,0,0,0,0|0,1,0]=3 841 B11R1.23 OC1=CC=CC(C(CN)O)=C1 SBB004042 [0,2,0,0,0,0|0,1,0]=3 842 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 SBB086854 [0,2,0,0,0,0|0,1,1]=4 843 B11R1.222 CCC(=O)C1=CC=CC=C1O SBB063301 [0,2,0,0,0,0|0,1,1]=4 844 B11R1.222 CCC(C)C1=CC=CC=C1N SBB061726 [0,2,0,0,0,0|1,0,0]=3 845 B11R1.222 CCC(C)C1=CC=CC=C1O SBB061123 [0,2,0,0,0,0|1,0,0]=3 846 B11R1.222 CNC(=O)C1=C(C)C=CC=C1 SBB086650 [0,2,0,0,0,0|0,1,1]=4 847 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 SBB017650 [0,2,0,0,0,0|0,1,1]=4 848 B11R1.222 COC(=O)C1=C(I)C=CC=C1 SBB064152 [0,2,0,0,0,0|0,1,1]=4 849 B11R1.222 COC(=O)C1=C(S)C=CC=C1 SBB108743 [0,2,0,0,0,0|0,1,1]=4 850 B11R1.222 COC(=O)C1=CC=CC=C1Br SBB065110 [0,2,0,0,0,0|0,1,1]=4 851 B11R1.222 COC(=O)C1=CC=CC=C1C SBB063118 [0,2,0,0,0,0|0,1,1]=4 852 B11R1.222 COC(=O)C1=CC=CC=C1Cl SBB058225 [0,2,0,0,0,0|0,1,1]=4 853 B11R1.222 COC(=O)C1=CC=CC=C1F SBB063605 [0,2,0,0,0,0|0,1,1]=4 854 B11R1.222 COC(=O)C1=CC=CC=C1N SBB059788 [0,2,0,0,0,0|0,1,1]=4 855 B11R1.222 COC(=O)C1=CC=CC=C1O SBB053705 [0,2,0,0,0,0|0,1,1]=4 856 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 SBB080216 [0,2,0,0,0,0|0,1,1]=4 857 B11R1.222 O=C(CBr)C1=CC=CC=C1F SBB051669 [0,2,0,0,0,0|0,1,1]=4 858 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 SBB040454 [0,2,0,0,0,0|1,0,0]=3 859 B11R1.87 CC(C)(C)C1=CC=CC=C1O SBB061124 [0,2,0,0,0,0|1,0,0]=3 860 B11R1.87 CC(C)(O)C1=C(N)C=CC=C1 SBB072175 [0,2,0,0,0,0|0,1,0]=3 861 B11R1.87 CC1=C(C(F)(F)F)C=CC=C1 SBB087418 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.87 CS(=O)(=O)C1=C(F)C=CC=C1 SBB088902 [0,2,0,0,0,0|1,1,0]=4 863 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 SBB093941 [0,2,0,0,0,0|1,1,0]=4 864 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Cl SBB079391 [0,2,0,0,0,0|1,1,0]=4 865 B11R1.87 FC(F)(F)C1=C(Br)C=CC=C1 SBB096757 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.87 FC(F)(F)C1=C(Cl)C=CC=C1 SBB089720 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.87 FC(F)(F)C1=CC=CC=C1S SBB066490 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.87 FC1=C(C(F)(F)F)C=CC=C1 SBB087760 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.87 NC1=C(C(F)(F)F)C=CC=C1 SBB003955 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 SBB087572 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 SBB054177 [0,2,0,0,0,0|1,0,0]=3 872 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 SBB051750 [0,2,0,0,0,0|1,0,0]=3 873 B11R1.155 CC1=CC=CC(C(F)(F)F)=C1 SBB087415 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.155 CS(=O)(=O)C1=CC(Br)=CC=C1 SBB098367 [0,2,0,0,0,0|1,1,0]=4 875 B11R1.155 CS(=O)(=O)C1=CC(N)=CC=C1 SBB072758 [0,2,0,0,0,0|1,1,0]=4 876 B11R1.155 FC(F)(F)C1=CC(Cl)=CC=C1 SBB089719 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.155 FC(F)(F)C1=CC=CC(Br)=C1 SBB096754 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.155 FC(F)(F)C1=CC=CC(S)=C1 SBB066515 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.155 FC1=CC(C(F)(F)F)=CC=C1 SBB087759 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.155 FC1=CC=CC(C(Cl)(Cl)Cl)=C1 SBB094842 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.155 NC1=CC=CC(C(F)(F)F)=C1 SBB003954 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.155 OC1=CC=CC(C(F)(F)F)=C1 SBB008329 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.155 [NH3+]C1=CC=CC(S(C)(=O)=O)=C1 SBB058964 [0,2,0,0,0,0|1,1,0]=4 884 B11R1.53 CC(C)C1=CC=CC=C1NN SBB001771 [0,2,0,0,0,0|1,0,0]=3 885 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 SBB027293 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 SBB027290 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.53 COC1=CC=CC=C1C(C)=O SBB040282 [0,2,0,0,0,0|0,1,1]=4 888 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl SBB064285 [0,2,0,0,0,0|0,1,1]=4 889 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F SBB088715 [0,2,0,0,0,0|0,1,1]=4 890 B11R1.156 CC(=O)C1=C(F)C=CC=C1F SBB006686 [0,2,0,0,0,0|0,1,1]=4 891 B11R1.156 CC(=O)C1=C(F)C=CC=C1O SBB086984 [0,2,0,0,0,0|0,1,1]=4 892 B11R1.156 CC(=O)C1=C(O)C=CC=C1O SBB063298 [0,2,0,0,0,0|0,1,1]=4 893 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl SBB090885 [0,2,0,0,0,0|0,1,1]=4 894 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F SBB062874 [0,2,0,0,0,0|0,1,1]=4 895 B11R1.159 CC(=O)C1=CC=CC(F)=C1C SBB086846 [0,2,0,0,0,0|0,1,1]=4 896 B11R1.159 CC(=O)C1=CC=CC(F)=C1F SBB087125 [0,2,0,0,0,0|0,1,1]=4 897 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 SBB086847 [0,2,0,0,0,0|0,1,1]=4 898 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 SBB086848 [0,2,0,0,0,0|0,1,1]=4 899 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 SBB006573 [0,2,0,0,0,0|0,1,1]=4 900 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 SBB042578 [0,2,0,0,0,0|0,1,1]=4 901 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 SBB005399 [0,2,0,0,0,0|0,1,1]=4 902 B11R1.167 CC(=O)C1=CC(C)=CC=C1C SBB058819 [0,2,0,0,0,0|0,1,1]=4 903 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl SBB063969 [0,2,0,0,0,0|0,1,1]=4 904 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1O SBB064877 [0,2,0,0,0,0|0,1,1]=4 905 B11R1.167 CC(=O)C1=CC(F)=CC=C1Br SBB064290 [0,2,0,0,0,0|0,1,1]=4 906 B11R1.167 CC(=O)C1=CC(F)=CC=C1O SBB063131 [0,2,0,0,0,0|0,1,1]=4 907 B11R1.167 CC(=O)C1=CC(O)=CC=C1O SBB056808 [0,2,0,0,0,0|0,1,1]=4 908 B11R1.167 CC(O)C1=CC(Cl)=CC=C1Cl SBB064319 [0,2,0,0,0,0|0,1,0]=3 909 B11R1.167 CC1=C(N(C)C)C=C(O)C=C1 SBB050299 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.167 CC1=CC=C(C)C(C(C)N)=C1 SBB009346 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.167 CC1=CC=C(Cl)C=C1N(C)C SBB088346 [0,2,0,0,0,0|2,0,0]=4 912 B11R1.74 CC(=O)C1=CC(C)=CC(F)=C1 SBB086843 [0,2,0,0,0,0|0,1,1]=4 913 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 SBB055399 [0,2,0,0,0,0|0,1,1]=4 914 B11R1.74 CC(=O)C1=CC(F)=CC(Cl)=C1 SBB088712 [0,2,0,0,0,0|0,1,1]=4 915 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 SBB048179 [0,2,0,0,0,0|0,1,1]=4 916 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 SBB063186 [0,2,0,0,0,0|0,1,1]=4 917 B11R1.74 CC(N)C1=CC(F)=CC(F)=C1 SBB087201 [0,2,0,0,0,0|1,0,0]=3 918 B11R1.74 CC1=CC(C)=CC(N(C)C)=C1 SBB008140 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 SBB059192 [0,2,0,0,0,0|0,1,1]=4 920 B11R1.266 CN(C)C1=CC=CC(CO)=C1 SBB086789 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.266 COC1=CC(C(C)=O)=CC=C1 SBB040249 [0,2,0,0,0,0|0,1,1]=4 922 B11R1.266 COC1=CC(C(C)O)=CC=C1 SBB079068 [0,2,0,0,0,0|0,1,0]=3 923 B11R1.266 COC1=CC(N(C)C)=CC=C1 SBB060811 [0,2,0,0,0,0|2,0,0]=4 924 B11R1.266 COC1=CC=CC(C(C)N)=C1 SBB018584 [0,2,0,0,0,0|1,0,0]=3 925 B11R2.10 BrC1=NC2=CC=CC=C2S1 SBB054571 [0,0,0,1,0,1|1,0,1]=4 926 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SBB058480 [0,0,0,1,0,1|1,0,1]=4 927 B11R2.10 CC1=NC2=C(C=CC=C2)S1 SBB059092 [0,0,0,1,0,1|0,0,1]=3 928 B11R2.10 CC1=NC2=C(C=CC=C2)[Se]1 SBB059124 [0,0,0,1,0,1|0,1,1]=4 929 B11R2.10 CC1=NC2=CC=CC=C2N1 SBB046157 [0,0,0,1,0,1|1,0,1]=4 930 B11R2.10 CC1=NC2=CC=CC=C2O1 SBB108741 [0,0,0,1,0,1|0,1,1]=4 931 B11R2.10 CC1CC2=C(C=CC=C2)N1 SBB058847 [0,0,0,1,0,1|1,0,0]=3 932 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 SBB059270 [0,0,0,1,0,1|1,0,1]=4 933 B11R2.10 FC1=NC2=C(C=CC=C2)S1 SBB086921 [0,0,0,1,0,1|1,0,1]=4 934 B11R2.10 NC1=NC2=C(C=CC=C2)S1 SBB004071 [0,0,0,1,0,1|1,0,1]=4 935 B11R2.10 NC1CC2=C(C=CC=C2)C1 SBB003858 [0,0,0,1,0,1|1,0,0]=3 936 B11R2.10 NC1CC2=CC=CC=C2C1 SBB052059 [0,0,0,1,0,1|1,0,0]=3 937 B11R2.10 O=C1CC2=CC=CC=C2N1 SBB004215 [0,0,0,1,0,1|0,1,1]=4 938 B11R2.10 O=C1NC2=C(C=CC=C2)S1 SBB037873 [0,0,0,1,0,1|1,0,1]=4 939 B11R2.10 OC1=NC2=C(C=CC=C2)S1 SBB005792 [0,0,0,1,0,1|1,0,1]=4 940 B11R2.10 OC1CC2=C(C=CC=C2)C1 SBB061554 [0,0,0,1,0,1|0,1,0]=3 941 B11R2.10 S=C1NC2=CC=CC=C2S1 SBB037840 [0,0,0,1,0,1|1,0,1]=4 942 B11R2.10 SC1=NC2=C(C=CC=C2)N1 SBB004069 [0,0,0,1,0,1|1,0,1]=4 943 B11R2.10 SC1=NC2=CC=CC=C2O1 SBB055994 [0,0,0,1,0,1|1,0,1]=4 944 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 SBB064278 [0,1,0,1,0,0|0,1,0]=3 945 B11R2.1 BrC1=CSC2=C1C=CC=C2 SBB003415 [0,1,0,1,0,0|1,0,1]=4 946 B11R2.1 CC1=CNC2=CC=CC=C12 SBB055975 [0,1,0,1,0,0|1,0,1]=4 947 B11R2.1 CC1=CSC2=CC=CC=C12 SBB086600 [0,1,0,1,0,0|0,0,1]=3 948 B11R2.1 ClC1=NSC2=C1C=CC=C2 SBB088345 [0,1,0,1,0,0|1,0,1]=4 949 B11R2.1 NC1=C2C=CC=CC2=NS1 SBB018834 [0,1,0,1,0,0|1,0,1]=4 950 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003870 [0,1,0,1,0,0|1,0,1]=4 951 B11R2.1 NC1=NCC2=C1C=CC=C2 SBB003871 [0,1,0,1,0,0|1,0,1]=4 952 B11R2.1 NC1CCC2=C1C=CC=C2 SBB004212 [0,1,0,1,0,0|1,0,0]=3 953 B11R2.1 O=C1CCC2=CC=CC=C12 SBB056339 [0,1,0,1,0,0|0,1,1]=4 954 B11R2.1 O=C1COC2=CC=CC=C12 SBB056285 [0,1,0,1,0,0|0,1,1]=4 955 B11R2.1 O=C1OCC2=C1C=CC=C2 SBB056840 [0,1,0,1,0,0|0,1,1]=4 956 B11R2.1 OC1CCC2=C1C=CC=N2 SBB056373 [0,1,0,1,0,0|1,1,0]=4 957 B11R2.40 NC1(C2=CC=CC=C2)CC1 SBB052390 [0,1,0,1,0,0|1,0,0]=3 958 B11R2.988 N#CC1CC2=CC=CC=C21 SBB056297 [0,1,0,1,0,0|1,0,0]=3 959 B11R2.55 NC1=C(C2CC2)C=CC=C1 SBB010265 [0,1,0,1,0,0|1,0,0]=3 960 B11R2.35 BrC1=CC(C2CC2)=CC=C1 SBB054182 [0,1,0,1,0,0|1,0,0]=3 961 B7R1.1 BrCC1=CSC=C1 SBB070721 [1,0,0,0,1,0|2,0,0]=4 962 B7R1.1 CCN1C=CC=N1 SBB020346 [1,0,0,0,1,0|2,0,0]=4 963 B7R1.1 CCN1C=CN=C1 SBB045396 [1,0,0,0,1,0|2,0,0]=4 964 B7R1.1 CSC1=CC=CS1 SBB085766 [1,0,0,0,1,0|2,0,0]=4 965 B7R1.1 CSC1=CSC=C1 SBB055747 [1,0,0,0,1,0|2,0,0]=4 966 B7R1.1 NCC1=CC=CO1 SBB004376 [1,0,0,0,1,0|2,0,0]=4 967 B7R1.1 NCC1=CC=CS1 SBB004315 [1,0,0,0,1,0|2,0,0]=4 968 B7R1.1 NCC1=CSC=C1 SBB079179 [1,0,0,0,1,0|2,0,0]=4 969 B7R1.1 OCC1=CC=CO1 SBB004373 [1,0,0,0,1,0|1,1,0]=4 970 B7R1.1 OCC1=CC=CS1 SBB058563 [1,0,0,0,1,0|1,1,0]=4 971 B7R1.1 OCC1=CSC=C1 SBB004309 [1,0,0,0,1,0|1,1,0]=4 972 B7R1.1 SCC1=CC=CO1 SBB004308 [1,0,0,0,1,0|1,0,0]=3 973 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SBB015101 [0,0,0,0,0,2|0,1,1]=4 974 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [0,0,0,0,0,2|0,1,1]=4 975 B11R1.91 CC(=O)NNC1=CC=CC=C1 SBB058004 [0,0,0,0,0,2|0,1,1]=4 976 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [0,0,0,0,0,2|0,1,1]=4 977 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 SBB057853 [0,0,0,0,0,2|0,1,1]=4 978 B11R1.91 CC(C)=CCC1=CC=CC=C1 SBB007979 [0,0,0,0,0,2|1,0,1]=4 979 B11R1.91 CC(C)NCC1=CC=CC=C1 SBB048017 [0,0,0,0,0,2|1,0,0]=3 980 B11R1.91 CC(N)CCC1=CC=CC=C1 SBB059846 [0,0,0,0,0,2|1,0,0]=3 981 B11R1.91 CC(N)COC1=CC=CC=C1 SBB084093 [0,0,0,0,0,2|1,0,0]=3 982 B11R1.91 CC(O)C#CC1=CC=CC=C1 SBB015100 [0,0,0,0,0,2|0,1,0]=3 983 B11R1.91 CN(C)\C=N\C1=CC=CC=C1 SBB007927 [0,0,0,0,0,2|2,0,0]=4