0 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.18 CC(=O)NC1=CC=NC=C1 SBB085931 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.18 C\[N+]([O-])=C/C1=CC=CC=C1 SBB085895 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.18 FC(F)OC1=CC=CC=C1 SBB070688 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.18 N=C(N)CC1=CC=CC=N1 SBB019209 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.18 N=C(N)CC1=CC=CN=C1 SBB019447 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [0,0,0,0,0,0|1,1,0]=2 16 B10R1.18 NC(=S)NC1=CC=CC=C1 SBB036022 [0,0,0,0,0,0|2,1,0]=3 17 B10R1.18 NC(=S)NC1=CC=NC=C1 SBB028308 [0,0,0,0,0,0|3,1,0]=4 18 B10R1.18 NC(=S)NC1=CN=CC=C1 SBB028309 [0,0,0,0,0,0|3,1,0]=4 19 B10R1.18 NC(=S)NC1=NC=CC=C1 SBB017620 [0,0,0,0,0,0|3,1,0]=4 20 B10R1.18 NC(N)=NC1=CC=CC=C1 SBB055106 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 O=C(O)CC1=CC=CN=C1 SBB003812 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.18 O=C(O)CC1=CCCCC1 SBB008386 [0,0,0,0,0,0|0,0,4]=4 25 B10R1.18 O=C(O)CC1=NC=CC=C1 SBB003810 [0,0,0,0,0,0|1,0,0]=1 26 B10R1.18 O=[N+]([O-])NC1=CC=CC=N1 SBB086047 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.18 OB(O)CC1=CC=CC=C1 SBB052526 [0,0,0,0,0,0|1,0,1]=2 28 B10R1.18 OC(=O)CC1=CC=NC=C1 SBB005759 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.18 [NH2+](C(=O)Cl)C1=CC=CC=C1 SBB060746 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [1,0,0,0,0,0|1,0,1]=3 31 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [1,0,0,0,0,0|1,0,1]=3 33 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.8 CNCC1=CC=NC=C1 SBB047816 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 COCC1=CC=CC=C1 SBB063549 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [1,0,0,0,0,0|2,0,1]=4 40 B9R1.8 N#CCC1=CC=CC=C1 SBB058386 [1,0,0,0,0,0|1,0,1]=3 41 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.8 N#CCC1=CC=NC=C1 SBB066966 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.8 N#CSC1=CC=CC=C1 SBB060831 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [1,0,0,0,0,0|1,0,1]=3 46 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.8 NCCC1=CC=NC=C1 SBB014221 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.8 NNCC1=CC=CC=C1 SBB063024 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.8 NOCC1=CC=CC=C1 SBB003971 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.8 NOCC1=CC=CC=C1 SBB032957 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.8 O=CCC1=CC=CC=C1 SBB061710 [1,0,0,0,0,0|0,0,0]=1 54 B9R1.8 O=CNC1=CC=CC=C1 SBB058769 [1,0,0,0,0,0|1,0,0]=2 55 B9R1.8 O=S=NC1=CC=CC=C1 SBB007761 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [1,0,0,0,0,0|0,0,1]=2 57 B9R1.8 O\N=C\C1=CC=CN=C1 SBB004285 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.8 O\N=C\C1=NC=CC=C1 SBB004284 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 S=C=NC1=CC=CC=C1 SBB040940 [1,0,0,0,0,0|1,1,1]=4 60 B9R1.8 SCCC1=CC=NC=C1 SBB065275 [1,0,0,0,0,0|1,1,1]=4 61 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SBB058424 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SBB054161 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.20 CC(=O)NC1=CC=C(Br)C=N1 SBB095054 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.20 CC(=O)NC1=CC=C(C)C=N1 SBB086721 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SBB058218 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.20 CC(=O)NC1=CC=C(Cl)C=N1 SBB113300 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SBB086906 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB028292 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB090514 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SBB043758 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 SBB102484 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 SBB028302 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.20 CC(N)CC1=CC=C(Cl)C=C1 SBB000454 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.20 CC(N)CC1=CC=C(F)C=C1 SBB052387 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SBB063734 [0,1,0,0,0,0|0,0,0]=1 80 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 SBB087944 [0,1,0,0,0,0|1,1,0]=3 81 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 SBB028290 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 SBB061970 [0,1,0,0,0,0|2,1,0]=4 83 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 SBB109890 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SBB028300 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 SBB062099 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 SBB055187 [0,1,0,0,0,0|1,1,0]=3 87 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 SBB055366 [0,1,0,0,0,0|1,1,0]=3 88 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 SBB041175 [0,1,0,0,0,0|2,1,0]=4 89 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 SBB041176 [0,1,0,0,0,0|2,1,0]=4 90 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 SBB038551 [0,1,0,0,0,0|2,1,0]=4 91 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 SBB055107 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SBB028301 [0,1,0,0,0,0|0,0,0]=1 93 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 SBB005859 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SBB067909 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SBB042842 [0,1,0,0,0,0|0,0,0]=1 96 B11R1.20 O=C(O)CC1=CC=C(Br)C=N1 SBB062888 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 SBB008374 [0,1,0,0,0,0|0,0,0]=1 98 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 SBB027117 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [0,1,0,0,0,0|0,0,0]=1 100 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SBB052672 [0,1,0,0,0,0|0,0,0]=1 101 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SBB059600 [0,1,0,0,0,0|0,0,0]=1 102 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 SBB017930 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.20 SC1=CC=C(NC(C)=O)C=C1 SBB003881 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SBB063201 [0,1,0,0,0,0|0,0,1]=2 105 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SBB064017 [0,1,0,0,0,0|1,0,1]=3 106 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 SBB055478 [0,1,0,0,0,0|1,0,0]=2 107 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SBB086654 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.36 CC(=O)N(O)C1=CC=CC=C1 SBB058639 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SBB007855 [0,1,0,0,0,0|0,0,0]=1 110 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 SBB055419 [0,1,0,0,0,0|2,1,0]=4 111 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 SBB017231 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 SBB028298 [0,1,0,0,0,0|1,0,0]=2 113 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SBB056598 [0,1,0,0,0,0|0,0,0]=1 114 B11R1.36 N[C@@H](C(=O)O)C1=CCC=CC1 SBB058321 [0,1,0,0,0,0|0,0,2]=3 115 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 SBB007783 [0,1,0,0,0,0|1,0,0]=2 116 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SBB057084 [0,1,0,0,0,0|0,0,1]=2 117 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 SBB007654 [0,1,0,0,0,0|0,0,0]=1 118 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 SBB086979 [0,1,0,0,0,0|0,0,0]=1 119 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 SBB007730 [0,1,0,0,0,0|0,0,0]=1 120 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 SBB017395 [0,1,0,0,0,0|0,0,0]=1 121 B11R1.40 C1=CC=C(NC(=S)NC)C=C1 SBB003887 [0,1,0,0,0,0|2,1,0]=4 122 B11R1.40 CCC(=O)CC1=CC=CC=C1 SBB060892 [0,1,0,0,0,0|1,0,0]=2 123 B11R1.40 CNC(=O)NC1=CC=CC=C1 SBB008334 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 SBB040229 [0,1,0,0,0,0|1,0,1]=3 125 B11R1.40 NCC(=O)NC1=CC=CC=C1 SBB004992 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.40 NNC(=O)CC1=CC=CC=C1 SBB046750 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 SBB040738 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.40 NNC(=O)NC1=CC=CC=C1 SBB028305 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.40 NNC(=S)NC1=CC=CC=C1 SBB007538 [0,1,0,0,0,0|2,1,0]=4 130 B11R1.40 N\C(CC1=CC=CC=C1)=N/O SBB055188 [0,1,0,0,0,0|1,0,0]=2 131 B11R1.40 O=C(CBr)NC1=CC=CC=C1 SBB051003 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.40 O=C(CC1=CC=CC=C1)NO SBB086771 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.40 O=C(CCl)NC1=CC=CC=C1 SBB030441 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SBB000164 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.40 O=C(CCl)OC1=CC=CC=C1 SBB060340 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.40 O=C(CS)NC1=CC=CC=C1 SBB008339 [0,1,0,0,0,0|1,1,0]=3 137 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SBB040238 [0,1,0,0,0,0|1,0,1]=3 138 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SBB054187 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.86 CC(=O)CC1=CC=CC=C1F SBB086844 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.86 CC(=O)NC1=C(Br)C=NC=C1 SBB019103 [0,1,0,0,0,0|3,0,0]=4 141 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 SBB084427 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 SBB048028 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SBB080001 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.86 CC(=O)NC1=CC=CC=C1Br SBB094902 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.86 CC(=O)NC1=CC=CC=C1C SBB058208 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.86 CC(=O)NC1=CC=CC=C1F SBB055359 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.86 CC(=O)NC1=CC=CN=C1Cl SBB047028 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.86 CC(=O)NC1=NC=CC=C1C SBB113292 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 SBB060700 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.86 CC(=O)OC1=CC=CC=C1F SBB086981 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.86 CC1=C(NC(N)=O)C=CC=C1 SBB028293 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.86 CC1=CC=CC=C1CC(=O)O SBB063148 [0,1,0,0,0,0|0,0,0]=1 153 B11R1.86 CC1=CC=CC=C1NC(N)=S SBB038580 [0,1,0,0,0,0|2,1,0]=4 154 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 SBB109891 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB080144 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB111386 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.86 NC(=O)CC1=CC=CC=C1O SBB072925 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.86 NC(=O)NC1=CC=CC=C1Cl SBB023415 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.86 NC(=O)NC1=CC=CC=C1F SBB057912 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 SBB062100 [0,1,0,0,0,0|2,1,0]=4 161 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 SBB003697 [0,1,0,0,0,0|2,1,0]=4 162 B11R1.86 NC(=S)NC1=CC=CC=C1F SBB038591 [0,1,0,0,0,0|2,1,0]=4 163 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 SBB006626 [0,1,0,0,0,0|0,0,0]=1 164 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 SBB057750 [0,1,0,0,0,0|0,0,0]=1 165 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 SBB057963 [0,1,0,0,0,0|0,0,0]=1 166 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 SBB057742 [0,1,0,0,0,0|0,0,0]=1 167 B11R1.86 O=C(O)CC1=CC=CC=C1I SBB063206 [0,1,0,0,0,0|0,0,0]=1 168 B11R1.86 O=C(O)CN1C=CC=CC1=O SBB010337 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.86 O=C(O)CN1C=CC=NC1=O SBB010342 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.157 CC(=O)CC1=CC(C)=CC=N1 SBB025632 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 SBB086850 [0,1,0,0,0,0|1,0,0]=2 172 B11R1.157 CC(=O)C[N+]1=CC(C)=CC=C1 SBB002639 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 SBB051044 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 SBB088343 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 SBB086915 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 SBB008515 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.157 CC(=O)NC1=CC(O)=CC=C1 SBB055395 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.157 CC(=O)NC1=CC=CC(C)=N1 SBB086718 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 SBB060031 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SBB086985 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.157 CC1=CC(NC(N)=O)=CC=C1 SBB028291 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.157 CC1=CC(NC(N)=S)=CC=C1 SBB017678 [0,1,0,0,0,0|2,1,0]=4 184 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 SBB068547 [0,1,0,0,0,0|0,0,0]=1 185 B11R1.157 CC1=NC(CC(C)O)=CC=C1 SBB025634 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 SBB109591 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.157 NC(=O)NC1=CC(Br)=CC=C1 SBB055210 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.157 NC(=S)NC1=CC(Cl)=CC=C1 SBB041173 [0,1,0,0,0,0|2,1,0]=4 189 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 SBB055209 [0,1,0,0,0,0|2,1,0]=4 190 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 SBB062112 [0,1,0,0,0,0|2,1,0]=4 191 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 SBB068772 [0,1,0,0,0,0|0,0,0]=1 192 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 SBB088714 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SBB037935 [0,1,0,0,0,0|0,0,0]=1 194 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SBB063159 [0,1,0,0,0,0|0,0,0]=1 195 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SBB063367 [0,1,0,0,0,0|0,0,0]=1 196 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SBB064349 [0,1,0,0,0,0|0,0,0]=1 197 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SBB063147 [0,1,0,0,0,0|0,0,0]=1 198 B11R1.509 CC(C)(O)CC1=CC=CC=C1 SBB071444 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 SBB059072 [0,1,0,0,0,0|1,0,1]=3 200 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 SBB008328 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB055074 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB059062 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060274 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060930 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.509 O=P(O)(O)CC1=CC=CC=C1 SBB057481 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 SBB016732 [0,1,0,0,0,0|1,0,1]=3 207 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 SBB088900 [0,1,0,0,0,0|1,0,1]=3 208 B11R2.10 BrC1=NC2=CC=CC=C2N1 SBB054573 [0,0,0,1,0,0|3,0,0]=4 209 B11R2.10 BrC1=NC2=CC=CC=C2S1 SBB054571 [0,0,0,1,0,0|2,1,0]=4 210 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SBB058480 [0,0,0,1,0,0|2,0,1]=4 211 B11R2.10 CC1=NC2=C(C=CC=C2)S1 SBB059092 [0,0,0,1,0,0|2,1,0]=4 212 B11R2.10 CC1=NC2=C(C=CC=C2)[Se]1 SBB059124 [0,0,0,1,0,0|2,1,0]=4 213 B11R2.10 CC1=NC2=CC=CC=C2N1 SBB046157 [0,0,0,1,0,0|3,0,0]=4 214 B11R2.10 CC1=NC2=CC=CC=C2O1 SBB108741 [0,0,0,1,0,0|2,0,0]=3 215 B11R2.10 CC1=NC2=NC=CC=C2O1 SBB056403 [0,0,0,1,0,0|3,0,0]=4 216 B11R2.10 CC1CC2=C(C=CC=C2)N1 SBB058847 [0,0,0,1,0,0|2,0,1]=4 217 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 SBB080914 [0,0,0,1,0,0|2,0,0]=3 218 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 SBB059270 [0,0,0,1,0,0|2,1,0]=4 219 B11R2.10 ClC1=NC2=CC=CC=C2N1 SBB006585 [0,0,0,1,0,0|3,0,0]=4 220 B11R2.10 FC1=NC2=C(C=CC=C2)S1 SBB086921 [0,0,0,1,0,0|2,1,0]=4 221 B11R2.10 NC1=NC2=C(C=CC=C2)N1 SBB028244 [0,0,0,1,0,0|3,0,0]=4 222 B11R2.10 NC1=NC2=C(C=CC=C2)S1 SBB004071 [0,0,0,1,0,0|2,1,0]=4 223 B11R2.10 NC1=NC2=CC=CC=C2O1 SBB046613 [0,0,0,1,0,0|2,0,0]=3 224 B11R2.10 NC1=NC2=NC=CC=C2O1 SBB072332 [0,0,0,1,0,0|3,0,0]=4 225 B11R2.10 NC1CC2=C(C=CC=C2)C1 SBB003858 [0,0,0,1,0,0|2,0,1]=4 226 B11R2.10 NC1CC2=CC=CC=C2C1 SBB052059 [0,0,0,1,0,0|2,0,1]=4 227 B11R2.10 O=C1CC2=CC=CC=C2N1 SBB004215 [0,0,0,1,0,0|1,0,0]=2 228 B11R2.10 O=C1CN2C=CC=CC2=N1 SBB072140 [0,0,0,1,0,0|2,0,0]=3 229 B11R2.10 O=C1NC2=C(C=CC=C2)N1 SBB000067 [0,0,0,1,0,0|2,0,0]=3 230 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SBB058504 [0,0,0,1,0,0|1,0,0]=2 231 B11R2.10 O=C1NC2=C(C=CC=C2)S1 SBB037873 [0,0,0,1,0,0|1,1,0]=3 232 B11R2.10 OC1=NC2=C(C=CC=C2)N1 SBB004209 [0,0,0,1,0,0|2,0,0]=3 233 B11R2.10 OC1=NC2=C(C=CC=C2)S1 SBB005792 [0,0,0,1,0,0|1,1,0]=3 234 B11R2.10 OC1CC2=C(C=CC=C2)C1 SBB061554 [0,0,0,1,0,0|1,0,1]=3 235 B11R2.10 S=C1NC2=CC=CC=C2S1 SBB037840 [0,0,0,1,0,0|1,2,0]=4 236 B11R2.10 SC1=NC2=C(C=CC=C2)N1 SBB004069 [0,0,0,1,0,0|2,1,0]=4 237 B11R2.10 SC1=NC2=CC=CC=C2O1 SBB055994 [0,0,0,1,0,0|1,1,0]=3 238 B11R2.10 SC1=NC2=NC=CC=C2O1 SBB086858 [0,0,0,1,0,0|2,1,0]=4 239 B9R1.6 C=C(C)C1=CC=CC=C1 SBB060154 [0,0,0,0,1,0|2,0,0]=3 240 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [0,0,0,0,1,0|1,0,0]=2 241 B9R1.6 CC(=O)C1=CC=NC=C1 SBB040256 [0,0,0,0,1,0|2,0,0]=3 242 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [0,0,0,0,1,0|2,0,0]=3 243 B9R1.6 CC(=O)C1=CN=CC=N1 SBB006738 [0,0,0,0,1,0|3,0,0]=4 244 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [0,0,0,0,1,0|2,0,0]=3 245 B9R1.6 CC(=O)C1=NC=CC=N1 SBB055904 [0,0,0,0,1,0|3,0,0]=4 246 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [0,0,0,0,1,0|2,0,1]=4 247 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [0,0,0,0,1,0|2,0,1]=4 248 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [0,0,0,0,1,0|2,0,1]=4 249 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [0,0,0,0,1,0|2,0,1]=4 250 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [0,0,0,0,1,0|1,0,1]=3 251 B9R1.6 CN(C)C1=CC=CC=C1 SBB040814 [0,0,0,0,1,0|3,0,0]=4 252 B9R1.6 CN(N)C1=CC=CC=C1 SBB060814 [0,0,0,0,1,0|3,0,0]=4 253 B9R1.6 C[C@@H](O)C1=CC=NC=C1 SBB065458 [0,0,0,0,1,0|2,0,1]=4 254 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [0,0,0,0,1,0|2,0,1]=4 255 B9R1.6 N=C(N)C1=CC=CC=C1 SBB055093 [0,0,0,0,1,0|2,0,0]=3 256 B9R1.6 N=C(N)C1=CC=CC=N1 SBB087246 [0,0,0,0,1,0|3,0,0]=4 257 B9R1.6 NC(=O)C1=CC=CC=C1 SBB058198 [0,0,0,0,1,0|1,0,0]=2 258 B9R1.6 NC(=O)C1=CC=CC=N1 SBB008128 [0,0,0,0,1,0|2,0,0]=3 259 B9R1.6 NC(=O)C1=CC=CN=C1 SBB004283 [0,0,0,0,1,0|2,0,0]=3 260 B9R1.6 NC(=O)C1=CC=CN=C1 SBB055585 [0,0,0,0,1,0|2,0,0]=3 261 B9R1.6 NC(=O)C1=CN=CC=N1 SBB004276 [0,0,0,0,1,0|3,0,0]=4 262 B9R1.6 NC(=S)C1=CC=CC=C1 SBB041177 [0,0,0,0,1,0|1,1,0]=3 263 B9R1.6 NC(=S)C1=CC=CC=N1 SBB017638 [0,0,0,0,1,0|2,1,0]=4 264 B9R1.6 NC(=S)C1=CC=NC=C1 SBB028258 [0,0,0,0,1,0|2,1,0]=4 265 B9R1.6 NC(=S)C1=CN=CC=C1 SBB028259 [0,0,0,0,1,0|2,1,0]=4 266 B9R1.6 O=C(Cl)C1=CC=CC=C1 SBB059783 [0,0,0,0,1,0|1,0,0]=2 267 B9R1.6 O=C(Cl)C1=CC=CN=C1 SBB005806 [0,0,0,0,1,0|2,0,0]=3 268 B9R1.6 O=C(Cl)C1=CC=NC=C1 SBB000083 [0,0,0,0,1,0|2,0,0]=3 269 B9R1.6 O=C(Cl)C1=CN=CC=N1 SBB010290 [0,0,0,0,1,0|3,0,0]=4 270 B9R1.6 O=C(Cl)C1=NC=CC=C1 SBB053631 [0,0,0,0,1,0|2,0,0]=3 271 B9R1.6 O=C(F)C1=CC=CC=C1 SBB085547 [0,0,0,0,1,0|1,0,0]=2 272 B9R1.6 O=C(O)C1=CC=CC=C1 SBB040515 [0,0,0,0,1,0|0,0,0]=1 273 B9R1.6 O=C(O)C1=CC=CN=C1 SBB004279 [0,0,0,0,1,0|1,0,0]=2 274 B9R1.6 O=C(O)C1=CC=CN=N1 SBB053230 [0,0,0,0,1,0|2,0,0]=3 275 B9R1.6 O=C(O)C1=CC=NC=C1 SBB004278 [0,0,0,0,1,0|1,0,0]=2 276 B9R1.6 O=C(O)C1=CC=NC=N1 SBB018520 [0,0,0,0,1,0|2,0,0]=3 277 B9R1.6 O=C(O)C1=CC=NN=C1 SBB053242 [0,0,0,0,1,0|2,0,0]=3 278 B9R1.6 O=C(O)C1=CN=CN=C1 SBB053218 [0,0,0,0,1,0|2,0,0]=3 279 B9R1.6 O=C(O)C1=NC=CC=C1 SBB004277 [0,0,0,0,1,0|1,0,0]=2 280 B9R1.6 O=C(O)C1=NC=CC=N1 SBB005602 [0,0,0,0,1,0|2,0,0]=3 281 B9R1.6 O=C(O)C1=NC=CN=C1 SBB000051 [0,0,0,0,1,0|2,0,0]=3 282 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 SBB040911 [0,0,0,0,1,0|1,0,1]=3 283 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 SBB065520 [0,0,0,0,1,0|2,0,1]=4 284 B9R1.6 OB(O)C1=CC=NC=C1 SBB004280 [0,0,0,0,1,0|2,0,1]=4 285 B9R1.6 OB(O)C1=CN=CC=C1 SBB025625 [0,0,0,0,1,0|2,0,1]=4 286 B9R1.6 OB(O)C1=NC=CC=C1 SBB052574 [0,0,0,0,1,0|2,0,1]=4 287 B9R1.13 CC(=O)CN1C=CC=N1 SBB002740 [0,0,0,0,1,0|3,0,0]=4 288 B9R1.13 O=C(Cl)CC1=CC=CS1 SBB006705 [0,0,0,0,1,0|2,0,0]=3 289 B9R1.13 O=C(O)CC1=CN=CN1 SBB003940 [0,0,0,0,1,0|2,0,0]=3 290 B9R1.13 O=C(O)CC1=CSC=N1 SBB018908 [0,0,0,0,1,0|2,0,0]=3 291 B9R1.13 O=C(O)CN1C=CC=N1 SBB010248 [0,0,0,0,1,0|2,0,0]=3 292 B9R1.13 O=C(O)CN1C=CN=C1 SBB010182 [0,0,0,0,1,0|2,0,0]=3 293 B9R1.13 O=C(O)CN1C=CN=N1 SBB051579 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.13 O=C(O)CN1C=NC=N1 SBB010156 [0,0,0,0,1,0|3,0,0]=4 295 B9R1.13 OC(=O)CC1=CC=CS1 SBB004145 [0,0,0,0,1,0|1,0,0]=2 296 B9R1.13 OC(=O)CC1=CNC=N1 SBB005448 [0,0,0,0,1,0|2,0,0]=3 297 B9R1.13 OC(=O)CC1=CSC=C1 SBB004147 [0,0,0,0,1,0|1,0,0]=2 298 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SBB015101 [0,0,0,0,0,1|1,0,1]=3 299 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [0,0,0,0,0,1|1,0,0]=2 300 B11R1.91 CC(=O)NNC1=CC=CC=C1 SBB058004 [0,0,0,0,0,1|2,0,0]=3 301 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [0,0,0,0,0,1|1,0,0]=2 302 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 SBB057853 [0,0,0,0,0,1|2,0,0]=3 303 B11R1.91 CC(C)=CCC1=CC=CC=C1 SBB007979 [0,0,0,0,0,1|2,0,0]=3 304 B11R1.91 CC(C)NCC1=CC=CC=C1 SBB048017 [0,0,0,0,0,1|2,0,1]=4 305 B11R1.91 CC(N)CCC1=CC=CC=C1 SBB059846 [0,0,0,0,0,1|2,0,1]=4 306 B11R1.91 CC(N)COC1=CC=CC=C1 SBB084093 [0,0,0,0,0,1|2,0,1]=4 307 B11R1.91 CC(O)C#CC1=CC=CC=C1 SBB015100 [0,0,0,0,0,1|1,0,2]=4 308 B11R1.91 N=C(N)CSC1=CC=CC=C1 SBB055427 [0,0,0,0,0,1|2,0,0]=3 309 B11R1.91 NC(=O)CCC1=CC=CC=C1 SBB058119 [0,0,0,0,0,1|1,0,0]=2 310 B11R1.91 NC(=O)COC1=CC=CC=C1 SBB028296 [0,0,0,0,0,1|1,0,0]=2 311 B11R1.91 NC(=O)CSC1=CC=CC=N1 SBB113001 [0,0,0,0,0,1|2,0,0]=3 312 B11R1.91 NC(=O)NCC1=CC=CC=C1 SBB058548 [0,0,0,0,0,1|1,0,0]=2 313 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [0,0,0,0,0,1|1,0,0]=2 314 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 SBB004096 [0,0,0,0,0,1|1,0,1]=3 315 B11R1.91 NC(=S)CCC1=NC=CC=C1 SBB019122 [0,0,0,0,0,1|2,1,0]=4 316 B11R1.91 NC(=S)COC1=CC=CC=C1 SBB016514 [0,0,0,0,0,1|1,1,0]=3 317 B11R1.91 NC(=S)NCC1=CC=CC=C1 SBB088032 [0,0,0,0,0,1|1,1,0]=3 318 B11R1.91 NC(N)=NCC1=CC=CC=C1 SBB055108 [0,0,0,0,0,1|2,0,0]=3 319 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SBB058859 [0,0,0,0,0,1|1,0,0]=2 320 B11R1.91 O=C(Cl)COC1=CC=CC=C1 SBB040630 [0,0,0,0,0,1|1,0,0]=2 321 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SBB063193 [0,0,0,0,0,1|1,0,0]=2 322 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 SBB040621 [0,0,0,0,0,1|1,0,1]=3 323 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SBB044891 [0,0,0,0,0,1|0,0,1]=2 324 B11R1.91 O=C(O)CCC1=CC=CC=C1 SBB056662 [0,0,0,0,0,1|0,0,0]=1 325 B11R1.91 O=C(O)CCC1=CC=CC=N1 SBB018634 [0,0,0,0,0,1|1,0,0]=2 326 B11R1.91 O=C(O)CCC1=CC=NC=C1 SBB012865 [0,0,0,0,0,1|1,0,0]=2 327 B11R1.91 O=C(O)CCC1=CN=CC=C1 SBB028468 [0,0,0,0,0,1|1,0,0]=2 328 B11R1.91 O=C(O)CNC1=CC=CC=C1 SBB028637 [0,0,0,0,0,1|0,0,0]=1 329 B11R1.91 O=C(O)COC1=CC=CC=C1 SBB040522 [0,0,0,0,0,1|0,0,0]=1 330 B11R1.91 O=C(O)COC1=CC=CC=N1 SBB086897 [0,0,0,0,0,1|1,0,0]=2 331 B11R1.91 O=C(O)COC1=CN=CC=C1 SBB027277 [0,0,0,0,0,1|1,0,0]=2 332 B11R1.91 O=C(O)CSC1=CC=CC=C1 SBB001712 [0,0,0,0,0,1|0,0,0]=1 333 B11R1.91 O=C(O)CSC1=CC=NC=C1 SBB028482 [0,0,0,0,0,1|1,0,0]=2 334 B11R1.91 O=C(O)CSC1=NC=CC=C1 SBB010505 [0,0,0,0,0,1|1,0,0]=2 335 B11R1.91 O=C(O)CSC1=NC=CC=N1 SBB028483 [0,0,0,0,0,1|2,0,0]=3 336 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 SBB028745 [0,0,0,0,0,1|0,0,1]=2 337 B11R1.91 O=C(O)\C=C\C1=CC=CC=N1 SBB059539 [0,0,0,0,0,1|1,0,1]=3 338 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 SBB028466 [0,0,0,0,0,1|1,0,1]=3 339 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 SBB028467 [0,0,0,0,0,1|1,0,1]=3 340 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 SBB072995 [0,0,0,0,0,1|2,0,1]=4 341 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SBB056972 [0,0,0,0,0,1|1,0,2]=4 342 B11R1.91 OB(O)CCC1=CC=CC=C1 SBB071100 [0,0,0,0,0,1|1,0,1]=3 343 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [2,0,0,0,0,0|0,0,2]=4 346 B8R1.2 CCC1=CC=CC=C1 SBB040891 [2,0,0,0,0,0|0,0,1]=3 347 B8R1.2 CCC1=CC=CC=N1 SBB060373 [2,0,0,0,0,0|1,0,1]=4 348 B8R1.2 CCC1=CC=NC=C1 SBB061128 [2,0,0,0,0,0|1,0,1]=4 349 B8R1.2 CCC1=CN=CC=C1 SBB060374 [2,0,0,0,0,0|1,0,1]=4 350 B8R1.2 CNC1=CC=CC=C1 SBB008162 [2,0,0,0,0,0|1,0,1]=4 351 B8R1.2 CNC1=CC=CC=C1 SBB059778 [2,0,0,0,0,0|1,0,1]=4 352 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [2,0,0,0,0,0|1,0,1]=4 355 B8R1.2 NCC1=CC=CC=C1 SBB040473 [2,0,0,0,0,0|1,0,0]=3 356 B8R1.2 NCC1=CC=CN=C1 SBB004351 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.2 NCC1=CC=NC=C1 SBB004350 [2,0,0,0,0,0|2,0,0]=4 358 B8R1.2 NCC1=NC=CC=C1 SBB004352 [2,0,0,0,0,0|2,0,0]=4 359 B8R1.2 NNC1=CC=CC=C1 SBB040886 [2,0,0,0,0,0|2,0,0]=4 360 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [2,0,0,0,0,0|1,0,0]=3 361 B8R1.2 O=CC1=CC=NC=C1 SBB004357 [2,0,0,0,0,0|1,0,0]=3 362 B8R1.2 O=CC1=CN=CN=C1 SBB065690 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [2,0,0,0,0,0|1,0,0]=3 364 B8R1.2 O=CC1=NC=CC=N1 SBB052320 [2,0,0,0,0,0|2,0,0]=4 365 B8R1.2 O=CC1=NC=CN=C1 SBB052318 [2,0,0,0,0,0|2,0,0]=4 366 B8R1.2 OCC1=CC=CC=C1 SBB058558 [2,0,0,0,0,0|0,0,0]=2 367 B8R1.2 OCC1=CC=CN=C1 SBB004344 [2,0,0,0,0,0|1,0,0]=3 368 B8R1.2 OCC1=CC=CN=N1 SBB054829 [2,0,0,0,0,0|2,0,0]=4 369 B8R1.2 OCC1=CC=NC=C1 SBB004347 [2,0,0,0,0,0|1,0,0]=3 370 B8R1.2 OCC1=CN=CN=C1 SBB065691 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.2 OCC1=NC=CC=C1 SBB004348 [2,0,0,0,0,0|1,0,0]=3 372 B8R1.2 OCC1=NC=CN=C1 SBB054824 [2,0,0,0,0,0|2,0,0]=4 373 B8R1.2 OCC1=NC=NC=C1 SBB054828 [2,0,0,0,0,0|2,0,0]=4 374 B8R1.2 ONC1=CC=CC=C1 SBB008413 [2,0,0,0,0,0|1,0,0]=3 375 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [2,0,0,0,0,0|2,0,0]=4 376 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [2,0,0,0,0,0|2,0,0]=4 377 B10R1.1 C=COC1=CC=C(N)C=C1 SBB010266 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.1 CC1=CC=C(CC#N)C=C1 SBB063995 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.1 CC1=CC=C(CC=O)C=C1 SBB052212 [1,1,0,0,0,0|0,0,0]=2 380 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.1 CC1=CC=C(N=C=O)C=C1 SBB061737 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.1 CC1=CC=C(NC=O)C=C1 SBB085897 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [1,1,0,0,0,0|1,0,1]=4 385 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.1 FC1=CC=C(CCCl)C=C1 SBB087329 [1,1,0,0,0,0|1,0,1]=4 390 B10R1.1 FC1=CC=C(C[Zn]Cl)C=C1 SBB094275 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.1 N#CCC1=CC=C(Br)C=C1 SBB055164 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.1 N#CCC1=CC=C(Cl)C=C1 SBB004060 [1,1,0,0,0,0|1,0,1]=4 393 B10R1.1 N#CCC1=CC=C(F)C=C1 SBB063691 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.1 N#CCC1=CC=C(N)C=C1 SBB004218 [1,1,0,0,0,0|1,0,1]=4 395 B10R1.1 N#CCC1=CC=C(O)C=C1 SBB063205 [1,1,0,0,0,0|1,0,1]=4 396 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [1,1,0,0,0,0|0,0,1]=3 397 B10R1.1 NCCC1=CC=C(F)C=C1 SBB003787 [1,1,0,0,0,0|1,0,1]=4 398 B10R1.1 NCCC1=CC=C(F)C=C1 SBB058811 [1,1,0,0,0,0|1,0,1]=4 399 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 SBB058877 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.1 O=C=NC1=CC=C(F)C=C1 SBB032971 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.1 O=CCC1=CC=C(Br)C=C1 SBB052205 [1,1,0,0,0,0|0,0,0]=2 403 B10R1.1 O=CCC1=CC=C(F)C=C1 SBB052206 [1,1,0,0,0,0|0,0,0]=2 404 B10R1.1 OCCC1=CC=C(Br)C=C1 SBB055082 [1,1,0,0,0,0|0,0,1]=3 405 B10R1.1 OCCC1=CC=C(F)C=C1 SBB086156 [1,1,0,0,0,0|0,0,1]=3 406 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [1,1,0,0,0,0|0,0,1]=3 407 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 SBB028657 [1,1,0,0,0,0|1,0,1]=4 408 B10R1.1 O\N=C\C1=CC=C(F)C=C1 SBB061927 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.1 O\N=C\C1=CC=C(I)C=C1 SBB062104 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.1 O\N=C\C1=CC=C(O)C=C1 SBB080079 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.4 C(=O)NC1=CC=CC=C1Cl SBB004025 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.4 C=CCC1=CC=CC=C1O SBB044905 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.4 C=CCN1C=CC=CC1=O SBB007666 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.4 CC1=CC=CC=C1CC#N SBB058333 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.4 CNCC1=C(Br)C=CC=C1 SBB092552 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.4 CNCC1=CC=CC=C1Cl SBB010370 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.4 CNCC1=CC=CC=C1F SBB086087 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [1,1,0,0,0,0|1,0,1]=4 420 B10R1.4 FC1=C(CCBr)C=CC=C1 SBB018050 [1,1,0,0,0,0|1,0,1]=4 421 B10R1.4 N#CCC1=CC=CC=C1Cl SBB063987 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.4 N#CCC1=CC=CC=C1F SBB063693 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.4 N#CCC1=CC=CC=C1N SBB064661 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.4 NNCC1=CC=CC=C1Cl SBB010382 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.4 O=C=NC1=CC=CC=C1Br SBB046942 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.4 O=C=NC1=CC=CC=C1Cl SBB061771 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.4 O=C=NC1=CC=CC=C1F SBB054883 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.4 OCCC1=C(F)C=CC=C1 SBB086155 [1,1,0,0,0,0|0,0,1]=3 429 B10R1.4 O\N=C\C1=C(F)C=CC=C1 SBB086056 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.4 O\N=C\C1=CC=CC=C1Cl SBB061849 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.4 O\N=C\C1=CC=CC=C1O SBB080181 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.10 CC1=CC(N=C=O)=CC=C1 SBB064239 [1,1,0,0,0,0|1,0,1]=4 433 B10R1.10 CC1=CC=CC(CC#N)=C1 SBB068545 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.10 FC1=CC=CC(C[Zn]Cl)=C1 SBB094274 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.10 N#CCC1=CC(Br)=CC=C1 SBB006625 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.10 N#CCC1=CC(Cl)=CC=C1 SBB057203 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.10 N#CCC1=CC=CC(F)=C1 SBB063692 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.10 NNCC1=CC(O)=CC=C1 SBB003436 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.10 O=C=NC1=CC(Br)=CC=C1 SBB046967 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.10 O=C=NC1=CC(Cl)=CC=C1 SBB058900 [1,1,0,0,0,0|1,0,1]=4 442 B10R1.10 O=C=NC1=CC=CC(F)=C1 SBB048876 [1,1,0,0,0,0|1,0,1]=4 443 B10R1.10 OCCC1=CC(F)=CC=C1 SBB055447 [1,1,0,0,0,0|0,0,1]=3 444 B10R1.10 O\N=C\C1=CC(Cl)=CC=C1 SBB087091 [1,1,0,0,0,0|1,0,1]=4 445 B10R1.10 O\N=C\C1=CC(F)=CC=C1 SBB086054 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.10 O\N=C\C1=CC=CC(O)=C1 SBB028669 [1,1,0,0,0,0|1,0,1]=4 447 B10R1.15 BrCC(Br)C1=CC=CC=C1 SBB058656 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.15 C#CC(O)C1=CC=CC=C1 SBB008986 [1,1,0,0,0,0|1,0,1]=4 449 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [1,1,0,0,0,0|0,0,0]=2 450 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [1,1,0,0,0,0|1,0,1]=4 451 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [1,1,0,0,0,0|0,0,1]=3 452 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [1,1,0,0,0,0|1,0,1]=4 453 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [1,1,0,0,0,0|1,0,1]=4 454 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [1,1,0,0,0,0|1,0,1]=4 455 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [1,1,0,0,0,0|1,0,1]=4 456 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [1,1,0,0,0,0|1,0,1]=4 457 B10R1.15 CN(C=O)C1=CC=CC=C1 SBB056830 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SBB085898 [1,1,0,0,0,0|1,0,1]=4 460 B10R1.15 ClCC(Cl)C1=CC=CC=C1 SBB007931 [1,1,0,0,0,0|1,0,1]=4 461 B10R1.15 N#CC(Br)C1=CC=CC=C1 SBB061313 [1,1,0,0,0,0|1,0,1]=4 462 B10R1.15 N#CC(N)C1=CC=CC=C1 SBB003872 [1,1,0,0,0,0|1,0,1]=4 463 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [1,1,0,0,0,0|1,0,1]=4 464 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SBB006667 [1,1,0,0,0,0|0,0,1]=3 465 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB015043 [1,1,0,0,0,0|1,0,1]=4 466 B10R1.15 N\C(=N/O)C1=CC=CC=C1 SBB055109 [1,1,0,0,0,0|1,0,1]=4 467 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [1,1,0,0,0,0|0,0,2]=4 468 B10R1.15 O=C(NO)C1=CC=CC=C1 SBB058405 [1,1,0,0,0,0|1,0,1]=4 469 B10R1.15 O=CC(=O)C1=CC=CC=C1 SBB068905 [1,1,0,0,0,0|0,0,1]=3 470 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [1,1,0,0,0,0|0,0,1]=3 471 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [1,1,0,0,0,0|1,0,1]=4 472 B10R1.17 BrCCOC1=CC=CC=C1 SBB042586 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.17 BrCCSC1=CC=CC=C1 SBB059699 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.17 C#CCNC1=CC=CC=C1 SBB010262 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.17 C#CCOC1=CC=CC=C1 SBB008983 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [1,1,0,0,0,0|0,0,0]=2 477 B10R1.17 C(=O)NNC1=CC=CC=C1 SBB008261 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [1,1,0,0,0,0|1,0,1]=4 480 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [1,1,0,0,0,0|1,0,1]=4 481 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [1,1,0,0,0,0|1,0,1]=4 482 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [1,1,0,0,0,0|1,0,1]=4 483 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [1,1,0,0,0,0|1,0,1]=4 484 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [1,1,0,0,0,0|1,0,1]=4 485 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [1,1,0,0,0,0|1,0,1]=4 486 B10R1.17 ClCSCC1=CC=CC=C1 SBB055458 [1,1,0,0,0,0|1,0,1]=4 487 B10R1.17 ClC\C=C\C1=CC=CC=C1 SBB040602 [1,1,0,0,0,0|1,0,1]=4 488 B10R1.17 N#CCOC1=CC=CC=C1 SBB016774 [1,1,0,0,0,0|1,0,1]=4 489 B10R1.17 N#CSCC1=CC=CC=C1 SBB056767 [1,1,0,0,0,0|1,0,1]=4 490 B10R1.17 N#C\C=C\C1=CC=CC=C1 SBB060940 [1,1,0,0,0,0|1,0,1]=4 491 B10R1.17 N(CC=C)C1=CC=CC=C1 SBB004211 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [1,1,0,0,0,0|1,0,1]=4 493 B10R1.17 NCCNC1=CC=CC=C1 SBB004200 [1,1,0,0,0,0|1,0,1]=4 494 B10R1.17 NCCOC1=CC=CC=C1 SBB085982 [1,1,0,0,0,0|1,0,1]=4 495 B10R1.17 NCCSC1=CC=CC=C1 SBB047720 [1,1,0,0,0,0|1,0,1]=4 496 B10R1.17 O=C=NCC1=CC=CC=C1 SBB048859 [1,1,0,0,0,0|0,0,1]=3 497 B10R1.17 O=COCC1=CC=CC=C1 SBB061238 [1,1,0,0,0,0|0,0,0]=2 498 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [1,1,0,0,0,0|0,0,1]=3 499 B10R1.17 OCC#CC1=CC=CC=C1 SBB015103 [1,1,0,0,0,0|0,0,2]=4 500 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [1,1,0,0,0,0|0,0,1]=3 501 B10R1.17 OCCCC1=CC=NC=C1 SBB072686 [1,1,0,0,0,0|1,0,1]=4 502 B10R1.17 OCCOC1=CC=CC=C1 SBB060485 [1,1,0,0,0,0|0,0,1]=3 503 B10R1.17 OC\C=C\C1=CC=CC=C1 SBB058645 [1,1,0,0,0,0|0,0,1]=3 504 B10R1.17 S=C=NCC1=CC=CC=C1 SBB002731 [1,1,0,0,0,0|0,1,1]=4 505 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 SBB008183 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [0,1,0,0,1,0|1,0,0]=3 507 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SBB055637 [0,1,0,0,1,0|2,0,0]=4 508 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [0,1,0,0,1,0|1,0,0]=3 509 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SBB055610 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [0,1,0,0,1,0|1,0,0]=3 511 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SBB055593 [0,1,0,0,1,0|2,0,0]=4 512 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [0,1,0,0,1,0|1,0,0]=3 513 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [0,1,0,0,1,0|1,0,0]=3 514 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [0,1,0,0,1,0|1,0,0]=3 515 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [0,1,0,0,1,0|1,0,0]=3 516 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SBB063808 [0,1,0,0,1,0|1,0,1]=4 517 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [0,1,0,0,1,0|1,0,1]=4 518 B10R1.13 CC1=CC=C(B(O)O)C=C1 SBB048068 [0,1,0,0,1,0|1,0,1]=4 519 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [0,1,0,0,1,0|2,0,0]=4 520 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 SBB058746 [0,1,0,0,1,0|1,0,0]=3 521 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SBB040516 [0,1,0,0,1,0|0,0,0]=2 522 B10R1.13 CC1=CC=C(C(=O)O)C=N1 SBB006666 [0,1,0,0,1,0|1,0,0]=3 523 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,1,0,0,1,0|1,0,1]=4 524 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [0,1,0,0,1,0|1,0,0]=3 525 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [0,1,0,0,1,0|1,1,0]=4 526 B10R1.13 CC1=CN=C(C(=O)O)C=C1 SBB052876 [0,1,0,0,1,0|1,0,0]=3 527 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SBB053220 [0,1,0,0,1,0|2,0,0]=4 528 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SBB006622 [0,1,0,0,1,0|2,0,0]=4 529 B10R1.13 CC1=NC=C(C(N)=O)C=C1 SBB028251 [0,1,0,0,1,0|2,0,0]=4 530 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SBB064275 [0,1,0,0,1,0|1,0,1]=4 531 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SBB064274 [0,1,0,0,1,0|1,0,1]=4 532 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SBB091235 [0,1,0,0,1,0|2,0,0]=4 533 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB073154 [0,1,0,0,1,0|2,0,0]=4 534 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB088979 [0,1,0,0,1,0|2,0,0]=4 535 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB003838 [0,1,0,0,1,0|2,0,0]=4 536 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB063615 [0,1,0,0,1,0|2,0,0]=4 537 B10R1.13 N=C(\C1=CC=C(N)C=C1)N SBB005770 [0,1,0,0,1,0|2,0,0]=4 538 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [0,1,0,0,1,0|1,0,0]=3 539 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [0,1,0,0,1,0|1,0,0]=3 540 B10R1.13 NC(=O)C1=CC=C(N)N=C1 SBB051875 [0,1,0,0,1,0|2,0,0]=4 541 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [0,1,0,0,1,0|1,0,0]=3 542 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 SBB028323 [0,1,0,0,1,0|2,0,0]=4 543 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 SBB095205 [0,1,0,0,1,0|1,1,0]=4 544 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 SBB016508 [0,1,0,0,1,0|1,1,0]=4 545 B10R1.13 NC(=S)C1=CC=C(F)C=C1 SBB016503 [0,1,0,0,1,0|1,1,0]=4 546 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SBB066605 [0,1,0,0,1,0|1,1,0]=4 547 B10R1.13 NC1=CC=C(B(O)O)C=C1 SBB070184 [0,1,0,0,1,0|1,0,1]=4 548 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SBB058665 [0,1,0,0,1,0|0,0,0]=2 549 B10R1.13 NC1=CC=C(C(=O)O)C=N1 SBB004186 [0,1,0,0,1,0|1,0,0]=3 550 B10R1.13 NC1=CC=C(C(=O)O)N=C1 SBB028257 [0,1,0,0,1,0|1,0,0]=3 551 B10R1.13 NC1=CC=C(C(=O)O)N=N1 SBB053237 [0,1,0,0,1,0|2,0,0]=4 552 B10R1.13 NC1=CC=C(S(=O)O)C=C1 SBB072620 [0,1,0,0,1,0|1,0,0]=3 553 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 SBB059787 [0,1,0,0,1,0|1,0,1]=4 554 B10R1.13 NC1=NC=C(C(=O)O)C=N1 SBB053221 [0,1,0,0,1,0|2,0,0]=4 555 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 SBB058718 [0,1,0,0,1,0|1,0,0]=3 556 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 SBB058751 [0,1,0,0,1,0|1,0,0]=3 557 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 SBB053629 [0,1,0,0,1,0|2,0,0]=4 558 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 SBB040628 [0,1,0,0,1,0|1,0,0]=3 559 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 SBB087392 [0,1,0,0,1,0|2,0,0]=4 560 B10R1.13 O=C(Cl)C1=NC=C(Br)C=C1 SBB069729 [0,1,0,0,1,0|2,0,0]=4 561 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SBB040519 [0,1,0,0,1,0|0,0,0]=2 562 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 SBB028529 [0,1,0,0,1,0|1,0,0]=3 563 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SBB040517 [0,1,0,0,1,0|0,0,0]=2 564 B10R1.13 O=C(O)C1=CC=C(Cl)C=N1 SBB062819 [0,1,0,0,1,0|1,0,0]=3 565 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 SBB004004 [0,1,0,0,1,0|1,0,0]=3 566 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 SBB053231 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SBB008568 [0,1,0,0,1,0|0,0,0]=2 568 B10R1.13 O=C(O)C1=CC=C(F)N=C1 SBB065228 [0,1,0,0,1,0|1,0,0]=3 569 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SBB063146 [0,1,0,0,1,0|0,0,0]=2 570 B10R1.13 O=C(O)C1=CC=C(O)N=C1 SBB004181 [0,1,0,0,1,0|1,0,0]=3 571 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 SBB052968 [0,1,0,0,1,0|1,0,0]=3 572 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 SBB028530 [0,1,0,0,1,0|1,0,0]=3 573 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 SBB053223 [0,1,0,0,1,0|2,0,0]=4 574 B10R1.13 O=C(O)C1=CN=C(S)C=C1 SBB004027 [0,1,0,0,1,0|1,0,0]=3 575 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 SBB065695 [0,1,0,0,1,0|2,0,0]=4 576 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 SBB053217 [0,1,0,0,1,0|2,0,0]=4 577 B10R1.13 O=C(O)C1=NC=C(F)C=C1 SBB065401 [0,1,0,0,1,0|1,0,0]=3 578 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SBB052998 [0,1,0,0,1,0|1,0,0]=3 579 B10R1.13 O=C(O)C1=NC=C(O)N=C1 SBB047806 [0,1,0,0,1,0|2,0,0]=4 580 B10R1.13 O=C1C=CC(C(=O)Cl)=CO1 SBB053673 [0,1,0,0,1,0|2,0,0]=4 581 B10R1.13 O=C1C=CC(C(=O)O)=NN1 SBB007399 [0,1,0,0,1,0|2,0,0]=4 582 B10R1.13 O=C1C=CC(C(=O)O)=NN1 SBB053229 [0,1,0,0,1,0|2,0,0]=4 583 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 SBB060983 [0,1,0,0,1,0|1,0,1]=4 584 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 SBB054149 [0,1,0,0,1,0|1,0,1]=4 585 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 SBB064696 [0,1,0,0,1,0|1,0,1]=4 586 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 SBB040875 [0,1,0,0,1,0|1,0,1]=4 587 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 SBB058973 [0,1,0,0,1,0|1,0,1]=4 588 B10R1.13 OB(O)C1=CC=C(Br)C=C1 SBB092695 [0,1,0,0,1,0|1,0,1]=4 589 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 SBB048060 [0,1,0,0,1,0|1,0,1]=4 590 B10R1.13 OB(O)C1=CC=C(F)C=C1 SBB048067 [0,1,0,0,1,0|1,0,1]=4 591 B10R1.13 OB(O)C1=CC=C(I)C=C1 SBB071088 [0,1,0,0,1,0|1,0,1]=4 592 B10R1.13 OC(=O)C1=COC(=O)C=C1 SBB004170 [0,1,0,0,1,0|1,0,0]=3 593 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 SBB037857 [0,1,0,0,1,0|1,0,1]=4 594 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 SBB058202 [0,1,0,0,1,0|1,0,1]=4 595 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 SBB040880 [0,1,0,0,1,0|1,0,1]=4 596 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 SBB087419 [0,1,0,0,1,0|1,0,1]=4 597 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 SBB058379 [0,1,0,0,1,0|2,0,0]=4 598 B10R1.28 [NH-]S(=O)(=O)C1=CC=CC=C1 SBB087157 [0,1,0,0,1,0|1,0,1]=4 599 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [0,1,0,0,1,0|1,0,0]=3 600 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [0,1,0,0,1,0|1,0,0]=3 601 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [0,1,0,0,1,0|1,0,0]=3 602 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [0,1,0,0,1,0|1,0,0]=3 603 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [0,1,0,0,1,0|1,0,0]=3 604 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [0,1,0,0,1,0|1,0,0]=3 605 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [0,1,0,0,1,0|1,0,0]=3 606 B10R1.61 CC(=O)C1=CC=CN=C1F SBB065563 [0,1,0,0,1,0|2,0,0]=4 607 B10R1.61 CC(=O)C1=CC=NC=C1N SBB051881 [0,1,0,0,1,0|2,0,0]=4 608 B10R1.61 CC(=O)C1=CN=CC=C1C SBB055670 [0,1,0,0,1,0|2,0,0]=4 609 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [0,1,0,0,1,0|1,0,1]=4 610 B10R1.61 CC1=C(C(=O)Cl)C=NC=C1 SBB053632 [0,1,0,0,1,0|2,0,0]=4 611 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SBB040521 [0,1,0,0,1,0|0,0,0]=2 612 B10R1.61 CC1=C(C(=O)O)C=CN=C1 SBB028020 [0,1,0,0,1,0|1,0,0]=3 613 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SBB018540 [0,1,0,0,1,0|1,0,0]=3 614 B10R1.61 CC1=C(C(=O)O)C=NC=N1 SBB085458 [0,1,0,0,1,0|2,0,0]=4 615 B10R1.61 CC1=C(C(N)=O)C=CC=C1 SBB007860 [0,1,0,0,1,0|1,0,0]=3 616 B10R1.61 CC1=CC=CC=C1B(O)O SBB052539 [0,1,0,0,1,0|1,0,1]=4 617 B10R1.61 CC1=CC=CC=C1C(N)=S SBB036004 [0,1,0,0,1,0|1,1,0]=4 618 B10R1.61 CC1=CC=CN=C1C(=O)O SBB052853 [0,1,0,0,1,0|1,0,0]=3 619 B10R1.61 CC1=CC=CN=C1C(N)=O SBB055568 [0,1,0,0,1,0|2,0,0]=4 620 B10R1.61 CC1=CC=NC=C1C(=O)O SBB028489 [0,1,0,0,1,0|1,0,0]=3 621 B10R1.61 CC1=NC=CC=C1C(=O)Cl SBB053635 [0,1,0,0,1,0|2,0,0]=4 622 B10R1.61 CC1=NC=CC=C1C(=O)O SBB004196 [0,1,0,0,1,0|1,0,0]=3 623 B10R1.61 CC1=NC=CC=C1C(N)=O SBB055551 [0,1,0,0,1,0|2,0,0]=4 624 B10R1.61 CS(=O)C1=C(F)C=CC=C1 SBB087301 [0,1,0,0,1,0|2,0,0]=4 625 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [0,1,0,0,1,0|1,0,1]=4 626 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [0,1,0,0,1,0|1,0,1]=4 627 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [0,1,0,0,1,0|1,0,1]=4 628 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 SBB092542 [0,1,0,0,1,0|1,0,0]=3 629 B10R1.61 NC(=O)C1=C(Cl)N=CC=C1 SBB004012 [0,1,0,0,1,0|2,0,0]=4 630 B10R1.61 NC(=O)C1=C(F)C=CC=C1 SBB058361 [0,1,0,0,1,0|1,0,0]=3 631 B10R1.61 NC(=O)C1=C(N)C=CC=C1 SBB007561 [0,1,0,0,1,0|1,0,0]=3 632 B10R1.61 NC(=O)C1=C(O)C=CC=C1 SBB058584 [0,1,0,0,1,0|1,0,0]=3 633 B10R1.61 NC(=O)C1=C(O)C=CC=N1 SBB058310 [0,1,0,0,1,0|2,0,0]=4 634 B10R1.61 NC(=O)C1=CC=CC=C1Cl SBB004023 [0,1,0,0,1,0|1,0,0]=3 635 B10R1.61 NC(=O)C1=CC=CN=C1N SBB055553 [0,1,0,0,1,0|2,0,0]=4 636 B10R1.61 NC(=O)C1=CC=NC=C1N SBB055547 [0,1,0,0,1,0|2,0,0]=4 637 B10R1.61 NC(=O)C1=CN=CC=C1Cl SBB055570 [0,1,0,0,1,0|2,0,0]=4 638 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 SBB095207 [0,1,0,0,1,0|1,1,0]=4 639 B10R1.61 NC(=S)C1=C(F)C=CC=C1 SBB016504 [0,1,0,0,1,0|1,1,0]=4 640 B10R1.61 NC(=S)C1=CC=CC=C1N SBB045972 [0,1,0,0,1,0|1,1,0]=4 641 B10R1.61 NC1=C(C(=O)O)C=CN=C1 SBB002130 [0,1,0,0,1,0|1,0,0]=3 642 B10R1.61 NC1=C(C(=O)O)C=NC=N1 SBB014257 [0,1,0,0,1,0|2,0,0]=4 643 B10R1.61 NC1=C([N+](=O)[O-])C=CC=C1 SBB040877 [0,1,0,0,1,0|1,0,1]=4 644 B10R1.61 NC1=CC=CC=C1B(O)O SBB069893 [0,1,0,0,1,0|1,0,1]=4 645 B10R1.61 NC1=CC=NC=C1C(=O)O SBB028256 [0,1,0,0,1,0|1,0,0]=3 646 B10R1.61 NC1=NC=CC=C1C(=O)O SBB004188 [0,1,0,0,1,0|1,0,0]=3 647 B10R1.61 NC1=NN=CC=C1C(=O)O SBB053241 [0,1,0,0,1,0|2,0,0]=4 648 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 SBB040697 [0,1,0,0,1,0|1,0,0]=3 649 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=C1 SBB058743 [0,1,0,0,1,0|1,0,0]=3 650 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 SBB040627 [0,1,0,0,1,0|1,0,0]=3 651 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl SBB067928 [0,1,0,0,1,0|2,0,0]=4 652 B10R1.61 O=C(Cl)C1=CN=CC=C1Cl SBB053634 [0,1,0,0,1,0|2,0,0]=4 653 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 SBB028474 [0,1,0,0,1,0|1,0,0]=3 654 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 SBB028475 [0,1,0,0,1,0|1,0,0]=3 655 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 SBB017604 [0,1,0,0,1,0|1,0,0]=3 656 B10R1.61 O=C(O)C1=C(F)C=NC=C1 SBB028460 [0,1,0,0,1,0|1,0,0]=3 657 B10R1.61 O=C(O)C1=C(F)C=NC=C1 SBB087340 [0,1,0,0,1,0|1,0,0]=3 658 B10R1.61 O=C(O)C1=C(I)C=NC=C1 SBB065379 [0,1,0,0,1,0|1,0,0]=3 659 B10R1.61 O=C(O)C1=C(O)C=CC=N1 SBB006727 [0,1,0,0,1,0|1,0,0]=3 660 B10R1.61 O=C(O)C1=C(O)C=NC=C1 SBB065382 [0,1,0,0,1,0|1,0,0]=3 661 B10R1.61 O=C(O)C1=CC=CC=C1Br SBB058412 [0,1,0,0,1,0|0,0,0]=2 662 B10R1.61 O=C(O)C1=CC=CC=C1Cl SBB040524 [0,1,0,0,1,0|0,0,0]=2 663 B10R1.61 O=C(O)C1=CC=CC=C1F SBB040569 [0,1,0,0,1,0|0,0,0]=2 664 B10R1.61 O=C(O)C1=CC=CC=C1I SBB063117 [0,1,0,0,1,0|0,0,0]=2 665 B10R1.61 O=C(O)C1=CC=CC=C1O SBB052826 [0,1,0,0,1,0|0,0,0]=2 666 B10R1.61 O=C(O)C1=CC=CN=C1Br SBB038991 [0,1,0,0,1,0|1,0,0]=3 667 B10R1.61 O=C(O)C1=CC=CN=C1Cl SBB004002 [0,1,0,0,1,0|1,0,0]=3 668 B10R1.61 O=C(O)C1=CC=CN=C1F SBB004159 [0,1,0,0,1,0|1,0,0]=3 669 B10R1.61 O=C(O)C1=CC=CN=C1O SBB004180 [0,1,0,0,1,0|1,0,0]=3 670 B10R1.61 O=C(O)C1=CC=CN=C1S SBB000123 [0,1,0,0,1,0|1,0,0]=3 671 B10R1.61 O=C(O)C1=CC=COC1=O SBB086118 [0,1,0,0,1,0|1,0,0]=3 672 B10R1.61 O=C(O)C1=CC=NC=C1Br SBB014291 [0,1,0,0,1,0|1,0,0]=3 673 B10R1.61 O=C(O)C1=CN=CC=C1O SBB052972 [0,1,0,0,1,0|1,0,0]=3 674 B10R1.61 O=C(O)C1=CN=CNC1=O SBB302963 [0,1,0,0,1,0|2,0,0]=4 675 B10R1.61 O=C(O)C1=NC=CC=C1Br SBB053041 [0,1,0,0,1,0|1,0,0]=3 676 B10R1.61 O=C(O)C1=NC=CC=C1F SBB052966 [0,1,0,0,1,0|1,0,0]=3 677 B10R1.61 O=C(O)C1=NC=CN=C1O SBB019213 [0,1,0,0,1,0|2,0,0]=4 678 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 SBB060648 [0,1,0,0,1,0|1,0,1]=4 679 B10R1.61 O=[N+]([O-])C1=CC=CC=C1Br SBB064688 [0,1,0,0,1,0|1,0,1]=4 680 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F SBB063156 [0,1,0,0,1,0|1,0,1]=4 681 B10R1.61 O=[N+]([O-])C1=CC=CC=C1I SBB064692 [0,1,0,0,1,0|1,0,1]=4 682 B10R1.61 OB(O)C1=C(F)C=CC=C1 SBB048079 [0,1,0,0,1,0|1,0,1]=4 683 B10R1.61 OB(O)C1=CC=CC=C1Cl SBB048063 [0,1,0,0,1,0|1,0,1]=4 684 B10R1.61 OB(O)C1=CC=CC=C1O SBB071215 [0,1,0,0,1,0|1,0,1]=4 685 B10R1.61 OC(=O)C1=C(N)N=CC=N1 SBB004179 [0,1,0,0,1,0|2,0,0]=4 686 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 SBB040258 [0,1,0,0,1,0|1,0,0]=3 687 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 SBB055121 [0,1,0,0,1,0|1,0,0]=3 688 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SBB055594 [0,1,0,0,1,0|2,0,0]=4 689 B10R1.113 CC(=O)C1=CC=CC(C)=C1 SBB061772 [0,1,0,0,1,0|1,0,0]=3 690 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SBB068974 [0,1,0,0,1,0|2,0,0]=4 691 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SBB063564 [0,1,0,0,1,0|1,0,0]=3 692 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SBB058713 [0,1,0,0,1,0|1,0,0]=3 693 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SBB040280 [0,1,0,0,1,0|1,0,0]=3 694 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 SBB054319 [0,1,0,0,1,0|2,0,0]=4 695 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 SBB065468 [0,1,0,0,1,0|2,0,0]=4 696 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 SBB055630 [0,1,0,0,1,0|2,0,0]=4 697 B10R1.113 CC(O)C1=CC(N)=CC=C1 SBB008559 [0,1,0,0,1,0|1,0,1]=4 698 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SBB068833 [0,1,0,0,1,0|1,0,1]=4 699 B10R1.113 CC1=CC(B(O)O)=CC=C1 SBB048058 [0,1,0,0,1,0|1,0,1]=4 700 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SBB028459 [0,1,0,0,1,0|1,0,0]=3 701 B10R1.113 CC1=CC(C(=O)O)=NC=C1 SBB053015 [0,1,0,0,1,0|1,0,0]=3 702 B10R1.113 CC1=CC(C(N)=O)=CC=C1 SBB007861 [0,1,0,0,1,0|1,0,0]=3 703 B10R1.113 CC1=CC(C(N)=O)=CN=C1 SBB069884 [0,1,0,0,1,0|2,0,0]=4 704 B10R1.113 CC1=CC(C(N)=O)=NC=C1 SBB055569 [0,1,0,0,1,0|2,0,0]=4 705 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 SBB058758 [0,1,0,0,1,0|1,0,0]=3 706 B10R1.113 CC1=CC=CC(C(=O)O)=C1 SBB040526 [0,1,0,0,1,0|0,0,0]=2 707 B10R1.113 CC1=CC=CC(C(N)=S)=C1 SBB086796 [0,1,0,0,1,0|1,1,0]=4 708 B10R1.113 CC1=NC(C(=O)O)=CC=C1 SBB028458 [0,1,0,0,1,0|1,0,0]=3 709 B10R1.113 CC1=NC=CC(C(=O)O)=C1 SBB052953 [0,1,0,0,1,0|1,0,0]=3 710 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SBB064272 [0,1,0,0,1,0|1,0,1]=4 711 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 SBB086151 [0,1,0,0,1,0|1,0,1]=4 712 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 SBB000182 [0,1,0,0,1,0|1,0,0]=3 713 B10R1.113 C[N+]1=CC(C(=O)[O-])=CC=C1 SBB085963 [0,1,0,0,1,0|1,0,1]=4 714 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 SBB017264 [0,1,0,0,1,0|2,0,0]=4 715 B10R1.113 N=C(N)C1=CC(N)=CC=C1 SBB003839 [0,1,0,0,1,0|2,0,0]=4 716 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 SBB301617 [0,1,0,0,1,0|2,0,0]=4 717 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 SBB016898 [0,1,0,0,1,0|2,0,0]=4 718 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 SBB028413 [0,1,0,0,1,0|2,0,0]=4 719 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 SBB009893 [0,1,0,0,1,0|1,0,0]=3 720 B10R1.113 NC(=O)C1=CC=CC(F)=C1 SBB086055 [0,1,0,0,1,0|1,0,0]=3 721 B10R1.113 NC(=O)C1=CC=CC(N)=C1 SBB028153 [0,1,0,0,1,0|1,0,0]=3 722 B10R1.113 NC(=O)C1=CC=CC(O)=C1 SBB079277 [0,1,0,0,1,0|1,0,0]=3 723 B10R1.113 NC(=O)C1=CC=NC(Cl)=C1 SBB028324 [0,1,0,0,1,0|2,0,0]=4 724 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 SBB070391 [0,1,0,0,1,0|2,0,0]=4 725 B10R1.113 NC(=O)C1=NC(F)=CC=C1 SBB086125 [0,1,0,0,1,0|2,0,0]=4 726 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 SBB055711 [0,1,0,0,1,0|2,0,0]=4 727 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 SBB095206 [0,1,0,0,1,0|1,1,0]=4 728 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 SBB017686 [0,1,0,0,1,0|1,1,0]=4 729 B10R1.113 NC1=CC(C(=O)O)=CC=C1 SBB028148 [0,1,0,0,1,0|0,0,0]=2 730 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SBB019433 [0,1,0,0,1,0|1,0,0]=3 731 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 SBB073008 [0,1,0,0,1,0|1,0,1]=4 732 B10R1.113 NC1=CC=CC(B(O)O)=C1 SBB052525 [0,1,0,0,1,0|1,0,1]=4 733 B10R1.113 NC1=CC=CC(C(=O)O)=C1 SBB017556 [0,1,0,0,1,0|0,0,0]=2 734 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SBB053020 [0,1,0,0,1,0|1,0,0]=3 735 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 SBB058851 [0,1,0,0,1,0|1,0,1]=4 736 B10R1.113 NC1=CN=CC(C(=O)O)=C1 SBB016179 [0,1,0,0,1,0|1,0,0]=3 737 B10R1.113 NC1=NC=CC(C(=O)O)=C1 SBB053016 [0,1,0,0,1,0|1,0,0]=3 738 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 SBB053636 [0,1,0,0,1,0|2,0,0]=4 739 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 SBB040625 [0,1,0,0,1,0|1,0,0]=3 740 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 SBB058871 [0,1,0,0,1,0|1,0,0]=3 741 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 SBB005463 [0,1,0,0,1,0|2,0,0]=4 742 B10R1.113 O=C(Cl)C1=NC(Cl)=CC=C1 SBB053638 [0,1,0,0,1,0|2,0,0]=4 743 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 SBB053627 [0,1,0,0,1,0|2,0,0]=4 744 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 SBB003524 [0,1,0,0,1,0|1,0,0]=3 745 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SBB028531 [0,1,0,0,1,0|1,0,0]=3 746 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 SBB040525 [0,1,0,0,1,0|0,0,0]=2 747 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 SBB027660 [0,1,0,0,1,0|1,0,0]=3 748 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 SBB004003 [0,1,0,0,1,0|1,0,0]=3 749 B10R1.113 O=C(O)C1=CC(F)=CC=C1 SBB052761 [0,1,0,0,1,0|0,0,0]=2 750 B10R1.113 O=C(O)C1=CC(F)=CN=C1 SBB053038 [0,1,0,0,1,0|1,0,0]=3 751 B10R1.113 O=C(O)C1=CC(I)=CC=C1 SBB052819 [0,1,0,0,1,0|0,0,0]=2 752 B10R1.113 O=C(O)C1=CC(I)=CC=N1 SBB042150 [0,1,0,0,1,0|1,0,0]=3 753 B10R1.113 O=C(O)C1=CC(O)=CC=C1 SBB058844 [0,1,0,0,1,0|0,0,0]=2 754 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SBB052870 [0,1,0,0,1,0|1,0,0]=3 755 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 SBB058408 [0,1,0,0,1,0|0,0,0]=2 756 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 SBB003525 [0,1,0,0,1,0|1,0,0]=3 757 B10R1.113 O=C(O)C1=CC=CC(F)=N1 SBB028461 [0,1,0,0,1,0|1,0,0]=3 758 B10R1.113 O=C(O)C1=CC=NC(F)=C1 SBB028462 [0,1,0,0,1,0|1,0,0]=3 759 B10R1.113 O=C(O)C1=CC=NC(I)=C1 SBB065665 [0,1,0,0,1,0|1,0,0]=3 760 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 SBB028476 [0,1,0,0,1,0|1,0,0]=3 761 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SBB010273 [0,1,0,0,1,0|1,0,0]=3 762 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 SBB028473 [0,1,0,0,1,0|1,0,0]=3 763 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 SBB066005 [0,1,0,0,1,0|2,0,0]=4 764 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 SBB065688 [0,1,0,0,1,0|2,0,0]=4 765 B10R1.113 O=C(O)C1=NC(O)=CC=C1 SBB052861 [0,1,0,0,1,0|1,0,0]=3 766 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SBB016176 [0,1,0,0,1,0|1,0,0]=3 767 B10R1.113 O=C(O)C1=NC=CC(O)=C1 SBB016174 [0,1,0,0,1,0|1,0,0]=3 768 B10R1.113 O=C(O)C1=NC=NC(O)=C1 SBB069034 [0,1,0,0,1,0|2,0,0]=4 769 B10R1.113 O=C1C=C(C(=O)O)C=NN1 SBB053238 [0,1,0,0,1,0|2,0,0]=4 770 B10R1.113 O=C1N=CC=C(C(=O)O)N1 SBB067353 [0,1,0,0,1,0|2,0,0]=4 771 B10R1.113 O=[N+]([O-])C1=CC(F)=CC=C1 SBB064196 [0,1,0,0,1,0|1,0,1]=4 772 B10R1.113 O=[N+]([O-])C1=CC(I)=CC=C1 SBB064697 [0,1,0,0,1,0|1,0,1]=4 773 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 SBB061211 [0,1,0,0,1,0|1,0,1]=4 774 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 SBB063141 [0,1,0,0,1,0|1,0,1]=4 775 B10R1.113 OB(O)C1=CC(N)=CC=C1 SBB004197 [0,1,0,0,1,0|1,0,1]=4 776 B10R1.113 OB(O)C1=CC(O)=CC=C1 SBB052523 [0,1,0,0,1,0|1,0,1]=4 777 B10R1.113 OB(O)C1=CC=CC(Br)=C1 SBB092696 [0,1,0,0,1,0|1,0,1]=4 778 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 SBB048059 [0,1,0,0,1,0|1,0,1]=4 779 B10R1.113 OB(O)C1=CC=CC(F)=C1 SBB048069 [0,1,0,0,1,0|1,0,1]=4 780 B10R1.113 OB(O)C1=CC=CC(I)=C1 SBB071105 [0,1,0,0,1,0|1,0,1]=4 781 B10R1.23 CC(C(=O)O)N1C=CC=C1 SBB002490 [0,1,0,0,1,0|1,0,0]=3 782 B10R1.23 CC(C(=O)O)N1C=CC=N1 SBB024832 [0,1,0,0,1,0|2,0,0]=4 783 B10R1.23 CC(C(=O)O)N1C=CN=C1 SBB065949 [0,1,0,0,1,0|2,0,0]=4 784 B10R1.23 NC(C(=O)O)C1=CC=CS1 SBB028327 [0,1,0,0,1,0|1,0,0]=3 785 B10R1.23 O=C(O)C(=O)C1=CC=CO1 SBB058266 [0,1,0,0,1,0|1,0,1]=4 786 B10R1.23 O=C(O)C(=O)C1=CC=CS1 SBB087149 [0,1,0,0,1,0|1,0,1]=4 787 B10R1.27 CCC(=O)CC1=CC=CO1 SBB014951 [0,1,0,0,1,0|2,0,0]=4 788 B10R1.27 COC(=O)CC1=CC=CS1 SBB061973 [0,1,0,0,1,0|1,0,0]=3 789 B10R1.27 COC(=O)CN1C=CC=N1 SBB024150 [0,1,0,0,1,0|2,0,0]=4 790 B10R1.27 COC(=O)CN1C=CN=C1 SBB046474 [0,1,0,0,1,0|2,0,0]=4 791 B10R1.27 NNC(=O)CC1=CC=CS1 SBB021015 [0,1,0,0,1,0|2,0,0]=4 792 B10R1.27 NNC(=O)CC1=CSC=C1 SBB028320 [0,1,0,0,1,0|2,0,0]=4 793 B10R1.54 CC1=CC(CC(=O)O)=NN1 SBB002789 [0,1,0,0,1,0|2,0,0]=4 794 B10R1.54 CC1=CN(CC(=O)O)N=C1 SBB009276 [0,1,0,0,1,0|2,0,0]=4 795 B10R1.54 CC1=NC(CC(=O)O)=CS1 SBB018923 [0,1,0,0,1,0|2,0,0]=4 796 B10R1.54 CC1=NN(CC(=O)O)C=C1 SBB020235 [0,1,0,0,1,0|2,0,0]=4 797 B10R1.54 CC1=NOC(CC(=O)O)=C1 SBB053168 [0,1,0,0,1,0|2,0,0]=4 798 B10R1.54 CN1C=CC(CC(=O)O)=N1 SBB049500 [0,1,0,0,1,0|2,0,0]=4 799 B10R1.54 NC1=CN(CC(=O)O)N=C1 SBB023092 [0,1,0,0,1,0|2,0,0]=4 800 B10R1.54 NC1=NC(CC(=O)O)=CS1 SBB003994 [0,1,0,0,1,0|2,0,0]=4 801 B10R1.54 NC1=NC(CC(=O)O)=CS1 SBB067007 [0,1,0,0,1,0|2,0,0]=4 802 B10R1.54 NC1=NN(CC(=O)O)C=C1 SBB021921 [0,1,0,0,1,0|2,0,0]=4 803 B10R1.54 O=C(O)CC1=CC(=O)NN1 SBB014632 [0,1,0,0,1,0|2,0,0]=4 804 B10R1.54 O=C(O)CN1C=C(Br)C=N1 SBB021723 [0,1,0,0,1,0|2,0,0]=4 805 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 SBB009484 [0,1,0,0,1,0|2,0,0]=4 806 B10R1.54 O=C(O)CN1C=C(I)C=N1 SBB074023 [0,1,0,0,1,0|2,0,0]=4 807 B10R1.54 O=C(O)CN1C=CC(Br)=N1 SBB116199 [0,1,0,0,1,0|2,0,0]=4 808 B10R1.64 CC1=CC=NN1CC(=O)O SBB020425 [0,1,0,0,1,0|2,0,0]=4 809 B10R1.64 CC1=NC=CN1CC(=O)O SBB045914 [0,1,0,0,1,0|2,0,0]=4 810 B10R1.64 CN1N=CC=C1CC(=O)O SBB073468 [0,1,0,0,1,0|2,0,0]=4 811 B10R1.64 N=C1SC=CN1CC(=O)O SBB015511 [0,1,0,0,1,0|2,0,0]=4 812 B10R1.64 O=C(O)CC1=CNN=C1O SBB047809 [0,1,0,0,1,0|2,0,0]=4 813 B10R1.64 O=C(O)CC1=CNNC1=O SBB010288 [0,1,0,0,1,0|2,0,0]=4 814 B12R1.21 C=C(C)COC1=CC=C(N)C=C1 SBB080146 [0,1,0,0,0,1|2,0,0]=4 815 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SBB056768 [0,1,0,0,0,1|1,0,0]=3 816 B12R1.21 CC(=O)COC1=CC=C(Cl)C=C1 SBB072870 [0,1,0,0,0,1|1,0,0]=3 817 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 SBB089710 [0,1,0,0,0,1|1,0,0]=3 818 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 SBB057983 [0,1,0,0,0,1|1,0,0]=3 819 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 SBB090182 [0,1,0,0,0,1|1,0,0]=3 820 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 SBB055227 [0,1,0,0,0,1|1,0,0]=3 821 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 SBB116862 [0,1,0,0,0,1|1,0,0]=3 822 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 SBB017373 [0,1,0,0,0,1|1,0,1]=4 823 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB089732 [0,1,0,0,0,1|1,0,1]=4 824 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 SBB087791 [0,1,0,0,0,1|1,0,1]=4 825 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SBB016295 [0,1,0,0,0,1|0,0,0]=2 826 B12R1.21 CC1=CC=C(CNC(N)=S)C=C1 SBB017712 [0,1,0,0,0,1|1,1,0]=4 827 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 SBB046297 [0,1,0,0,0,1|0,0,0]=2 828 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 SBB004531 [0,1,0,0,0,1|0,0,0]=2 829 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 SBB038335 [0,1,0,0,0,1|0,0,0]=2 830 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SBB015822 [0,1,0,0,0,1|0,0,1]=3 831 B12R1.21 CC1=CC=C(\C=C\C(N)=O)C=C1 SBB113392 [0,1,0,0,0,1|1,0,1]=4 832 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 SBB055295 [0,1,0,0,0,1|2,0,0]=4 833 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 SBB088264 [0,1,0,0,0,1|1,0,0]=3 834 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 SBB006760 [0,1,0,0,0,1|1,0,0]=3 835 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 SBB088171 [0,1,0,0,0,1|1,0,0]=3 836 B12R1.21 NC(=O)NNC1=CC=C(F)C=C1 SBB058365 [0,1,0,0,0,1|2,0,0]=4 837 B12R1.21 NC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB008061 [0,1,0,0,0,1|1,0,1]=4 838 B12R1.21 NC(=S)COC1=CC=C(Cl)C=C1 SBB092833 [0,1,0,0,0,1|1,1,0]=4 839 B12R1.21 NC(=[S+]CC1=CC=C(Cl)C=C1)N SBB003234 [0,1,0,0,0,1|2,0,0]=4 840 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 SBB010089 [0,1,0,0,0,1|0,0,0]=2 841 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 SBB001635 [0,1,0,0,0,1|0,0,0]=2 842 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SBB003553 [0,1,0,0,0,1|0,0,1]=3 843 B12R1.21 O=C(Cl)COC1=CC=C(Cl)C=C1 SBB009959 [0,1,0,0,0,1|1,0,0]=3 844 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 SBB010782 [0,1,0,0,0,1|1,0,0]=3 845 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SBB017617 [0,1,0,0,0,1|0,0,0]=2 846 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SBB010179 [0,1,0,0,0,1|0,0,0]=2 847 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SBB017621 [0,1,0,0,0,1|0,0,0]=2 848 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SBB052832 [0,1,0,0,0,1|0,0,0]=2 849 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SBB064098 [0,1,0,0,0,1|0,0,0]=2 850 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 SBB016740 [0,1,0,0,0,1|0,0,0]=2 851 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 SBB063172 [0,1,0,0,0,1|0,0,0]=2 852 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 SBB003884 [0,1,0,0,0,1|0,0,0]=2 853 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 SBB004535 [0,1,0,0,0,1|0,0,0]=2 854 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 SBB004537 [0,1,0,0,0,1|0,0,0]=2 855 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 SBB030014 [0,1,0,0,0,1|0,0,0]=2 856 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SBB063740 [0,1,0,0,0,1|0,0,0]=2 857 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 SBB052749 [0,1,0,0,0,1|0,0,0]=2 858 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SBB059537 [0,1,0,0,0,1|0,0,1]=3 859 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SBB008203 [0,1,0,0,0,1|0,0,1]=3 860 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 SBB005718 [0,1,0,0,0,1|0,0,1]=3 861 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SBB007613 [0,1,0,0,0,1|0,0,1]=3 862 B12R1.21 OC(=O)CSC1=CC=C(Cl)C=C1 SBB003520 [0,1,0,0,0,1|0,0,0]=2 863 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SBB068279 [0,1,0,0,0,1|1,0,0]=3 864 B12R1.27 CC(CO)NCC1=CC=CC=C1 SBB010465 [0,1,0,0,0,1|1,0,1]=4 865 B12R1.27 CCC(=O)NNC1=CC=CC=C1 SBB007827 [0,1,0,0,0,1|2,0,0]=4 866 B12R1.27 CCC(=O)OCC1=CC=CC=C1 SBB061239 [0,1,0,0,0,1|1,0,0]=3 867 B12R1.27 CNC(=S)NCC1=CC=CC=C1 SBB017711 [0,1,0,0,0,1|1,1,0]=4 868 B12R1.27 COC(=O)CCC1=CN=CC=C1 SBB071440 [0,1,0,0,0,1|1,0,0]=3 869 B12R1.27 COC(=O)CSC1=CC=CC=C1 SBB089934 [0,1,0,0,0,1|0,0,0]=2 870 B12R1.27 COC(=O)NCC1=CC=CC=C1 SBB080563 [0,1,0,0,0,1|0,0,0]=2 871 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 SBB058222 [0,1,0,0,0,1|0,0,1]=3 872 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 SBB079292 [0,1,0,0,0,1|1,0,1]=4 873 B12R1.27 N#CC(=O)OCC1=CC=CC=C1 SBB057332 [0,1,0,0,0,1|1,0,0]=3 874 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SBB063677 [0,1,0,0,0,1|1,0,0]=3 875 B12R1.27 NNC(=O)CCC1=CC=CC=C1 SBB000151 [0,1,0,0,0,1|1,0,0]=3 876 B12R1.27 NNC(=O)CNC1=CC=CC=C1 SBB019864 [0,1,0,0,0,1|1,0,0]=3 877 B12R1.27 NNC(=O)COC1=CC=CC=C1 SBB017408 [0,1,0,0,0,1|1,0,0]=3 878 B12R1.27 NNC(=O)CSC1=CC=CC=C1 SBB072377 [0,1,0,0,0,1|1,0,0]=3 879 B12R1.27 NNC(=O)CSC1=CC=CC=N1 SBB019866 [0,1,0,0,0,1|2,0,0]=4 880 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SBB063031 [0,1,0,0,0,1|1,0,0]=3 881 B12R1.27 NNC(=S)NCC1=CC=CC=C1 SBB038438 [0,1,0,0,0,1|1,1,0]=4 882 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 SBB080035 [0,1,0,0,0,1|1,0,0]=3 883 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SBB006752 [0,1,0,0,0,1|1,0,0]=3 884 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 SBB038576 [0,1,0,0,0,1|1,0,0]=3 885 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 SBB064876 [0,1,0,0,0,1|1,0,0]=3 886 B12R1.27 O=C(CS)OCC1=CC=CC=C1 SBB057444 [0,1,0,0,0,1|0,1,0]=3 887 B12R1.27 OC(CCl)COC1=CC=CC=C1 SBB061224 [0,1,0,0,0,1|1,0,1]=4 888 B12R1.27 OC(COC1=CC=CC=C1)CN SBB010049 [0,1,0,0,0,1|1,0,1]=4 889 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 SBB088177 [0,1,0,0,0,1|0,0,2]=4 890 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 SBB014560 [0,1,0,0,0,1|1,0,0]=3 891 B12R1.43 CC(NC1=NC=CC=N1)C(=O)O SBB085505 [0,1,0,0,0,1|2,0,0]=4 892 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl SBB050579 [0,1,0,0,0,1|1,0,0]=3 893 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O SBB079963 [0,1,0,0,0,1|0,0,0]=2 894 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O SBB017509 [0,1,0,0,0,1|0,0,1]=3 895 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SBB027287 [0,1,0,0,0,1|1,0,0]=3 896 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O SBB058700 [0,1,0,0,0,1|0,0,0]=2 897 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O SBB065646 [0,1,0,0,0,1|1,0,0]=3 898 B12R1.43 N[C@H](CC1=CC=CC=N1)C(=O)O SBB065302 [0,1,0,0,0,1|1,0,0]=3 899 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O SBB065223 [0,1,0,0,0,1|1,0,0]=3 900 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 SBB012361 [0,1,0,0,0,1|0,0,0]=2 901 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SBB012365 [0,1,0,0,0,1|0,0,0]=2 902 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 SBB087976 [0,1,0,0,0,1|0,0,1]=3 903 B12R1.43 O=C(O)\C(S)=C/C1=CC=CC=C1 SBB043389 [0,1,0,0,0,1|0,0,1]=3 904 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [0,1,0,0,0,1|1,0,0]=3 905 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SBB058063 [0,1,0,0,0,1|1,0,0]=3 906 B12R1.107 CC(=O)\C=C(/N)C1=CC=CC=C1 SBB035905 [0,1,0,0,0,1|1,0,1]=4 907 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 SBB051565 [0,1,0,0,0,1|2,0,0]=4 908 B12R1.107 C\C(=C/C(=O)O)C1=CC=CC=C1 SBB052737 [0,1,0,0,0,1|0,0,1]=3 909 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SBB035909 [0,1,0,0,0,1|1,0,0]=3 910 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 SBB057900 [0,1,0,0,0,1|1,0,1]=4 911 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SBB001851 [0,1,0,0,0,1|0,0,0]=2 912 B12R1.107 O=C(C[N+](=O)[O-])C1=CC=CC=C1 SBB032958 [0,1,0,0,0,1|1,0,1]=4 913 B12R1.107 O=C(O)CC(Br)C1=CC=CC=C1 SBB008428 [0,1,0,0,0,1|0,0,0]=2 914 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 SBB063579 [0,1,0,0,0,1|0,0,0]=2 915 B12R1.107 O=[N+]([O-])CC(O)C1=CC=CC=C1 SBB001885 [0,1,0,0,0,1|1,0,1]=4 916 B12R1.125 C=C(C)COC1=CC=CC=C1N SBB080151 [0,1,0,0,0,1|2,0,0]=4 917 B12R1.125 CC(=O)NCC1=C(Br)C=CC=C1 SBB079113 [0,1,0,0,0,1|1,0,0]=3 918 B12R1.125 CC(=O)\C=C\C1=C(O)C=CC=C1 SBB087612 [0,1,0,0,0,1|1,0,1]=4 919 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 SBB004532 [0,1,0,0,0,1|0,0,0]=2 920 B12R1.125 CC1=CC=CC=C1CCC(=O)O SBB067749 [0,1,0,0,0,1|0,0,0]=2 921 B12R1.125 CC1=CC=CC=C1NCC(=O)O SBB016671 [0,1,0,0,0,1|0,0,0]=2 922 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O SBB003946 [0,1,0,0,0,1|0,0,1]=3 923 B12R1.125 N=C(N)COC1=CC=CC=C1Cl SBB055296 [0,1,0,0,0,1|2,0,0]=4 924 B12R1.125 NC(=O)COC1=CC=CC=C1Cl SBB116750 [0,1,0,0,0,1|1,0,0]=3 925 B12R1.125 NC(=S)COC1=CC=CC=C1Cl SBB092832 [0,1,0,0,0,1|1,1,0]=4 926 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SBB064066 [0,1,0,0,0,1|0,0,0]=2 927 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SBB069087 [0,1,0,0,0,1|0,0,0]=2 928 B12R1.125 O=C(O)CCC1=CC=CC=C1F SBB010203 [0,1,0,0,0,1|0,0,0]=2 929 B12R1.125 O=C(O)CCC1=CC=CC=C1O SBB063739 [0,1,0,0,0,1|0,0,0]=2 930 B12R1.125 O=C(O)CCN1C=CC=CC1=O SBB072181 [0,1,0,0,0,1|1,0,0]=3 931 B12R1.125 O=C(O)CNC1=CC=CC=C1Cl SBB063875 [0,1,0,0,0,1|0,0,0]=2 932 B12R1.125 O=C(O)COC1=C(O)C=CC=C1 SBB080750 [0,1,0,0,0,1|0,0,0]=2 933 B12R1.125 O=C(O)COC1=CC=CC=C1Br SBB038788 [0,1,0,0,0,1|0,0,0]=2 934 B12R1.125 O=C(O)COC1=CC=CC=C1Cl SBB004546 [0,1,0,0,0,1|0,0,0]=2 935 B12R1.125 O=C(O)COC1=CC=CC=C1F SBB007049 [0,1,0,0,0,1|0,0,0]=2 936 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 SBB015306 [0,1,0,0,0,1|0,0,1]=3 937 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 SBB061928 [0,1,0,0,0,1|0,0,1]=3 938 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 SBB065726 [0,1,0,0,0,1|0,0,1]=3 939 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br SBB050858 [0,1,0,0,0,1|0,0,1]=3 940 B12R1.226 C=C(C)COC1=CC(N)=CC=C1 SBB080148 [0,1,0,0,0,1|2,0,0]=4 941 B12R1.226 CC(=O)CCC1=CC(Br)=CC=C1 SBB055142 [0,1,0,0,0,1|1,0,0]=3 942 B12R1.226 CC(=O)\C=C\C1=CC=CC(Cl)=C1 SBB057836 [0,1,0,0,0,1|1,0,1]=4 943 B12R1.226 CC1=CC(NCC(=O)O)=CC=C1 SBB046298 [0,1,0,0,0,1|0,0,0]=2 944 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 SBB004530 [0,1,0,0,0,1|0,0,0]=2 945 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SBB006620 [0,1,0,0,0,1|0,0,1]=3 946 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 SBB067747 [0,1,0,0,0,1|0,0,0]=2 947 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 SBB051583 [0,1,0,0,0,1|1,0,1]=4 948 B12R1.226 CC1=NC(SCC(=O)O)=NC=C1 SBB028505 [0,1,0,0,0,1|2,0,0]=4 949 B12R1.226 NC(=O)COC1=CC=CC(Cl)=C1 SBB090331 [0,1,0,0,0,1|1,0,0]=3 950 B12R1.226 NC(=O)NNC1=CC(F)=CC=C1 SBB088267 [0,1,0,0,0,1|2,0,0]=4 951 B12R1.226 NC(=S)COC1=CC(Cl)=CC=C1 SBB092831 [0,1,0,0,0,1|1,1,0]=4 952 B12R1.226 NC1=CC(\C=C\C(=O)O)=CC=C1 SBB043435 [0,1,0,0,0,1|0,0,1]=3 953 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 SBB028355 [0,1,0,0,0,1|0,0,0]=2 954 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 SBB010231 [0,1,0,0,0,1|0,0,0]=2 955 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 SBB057915 [0,1,0,0,0,1|0,0,0]=2 956 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SBB063235 [0,1,0,0,0,1|0,0,0]=2 957 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SBB005906 [0,1,0,0,0,1|0,0,0]=2 958 B12R1.226 O=C(O)COC1=CC(Br)=CC=C1 SBB015442 [0,1,0,0,0,1|0,0,0]=2 959 B12R1.226 O=C(O)COC1=CC=CC(Cl)=C1 SBB043647 [0,1,0,0,0,1|0,0,0]=2 960 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 SBB027407 [0,1,0,0,0,1|0,0,0]=2 961 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 SBB057740 [0,1,0,0,0,1|0,0,1]=3 962 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 SBB042541 [0,1,0,0,0,1|0,0,1]=3 963 B12R1.226 OC(=O)\C=C\C1=CC(Cl)=CC=C1 SBB012383 [0,1,0,0,0,1|0,0,1]=3 964 B12R1.226 OC(=O)\C=C\C1=CC(F)=CC=C1 SBB006621 [0,1,0,0,0,1|0,0,1]=3 965 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 SBB026050 [0,1,0,0,0,1|1,0,1]=4 966 B12R1.891 O=P(O)(O)C#CC1=CC=CC=C1 SBB057375 [0,1,0,0,0,1|1,0,1]=4 967 B12R1.891 O=P(O)(O)CCC1=CC=CC=C1 SBB057482 [0,1,0,0,0,1|1,0,0]=3 968 B12R1.891 O=P(O)(O)\C=C\C1=CC=CC=C1 SBB060111 [0,1,0,0,0,1|1,0,1]=4 969 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 SBB018064 [0,1,0,0,0,1|1,0,1]=4 970 B12R1.891 O=S(=O)(O)CCC1=CC=CC=N1 SBB008555 [0,1,0,0,0,1|2,0,0]=4 971 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 SBB057700 [0,1,0,0,0,1|2,0,0]=4 972 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 SBB072726 [0,1,0,0,0,1|2,0,0]=4 973 B12R1.891 O=S(=O)(O)CCC1=NC=CC=C1 SBB057680 [0,1,0,0,0,1|2,0,0]=4 974 B12R1.4 C(=O)C1=CC=C(OC(C)=O)C=C1 SBB008231 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 SBB058823 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 SBB058345 [0,2,0,0,0,0|0,0,0]=2 977 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 SBB058529 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 SBB057982 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.4 COC1=CC=C(CC(N)=S)C=C1 SBB089824 [0,2,0,0,0,0|1,1,0]=4 980 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 SBB056791 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.4 COC1=CC=C(NC(N)=O)C=C1 SBB062093 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 SBB068771 [0,2,0,0,0,0|0,0,0]=2 983 B12R1.4 CSC1=CC=C(NC(C)=O)C=C1 SBB115654 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.4 N(C(C)=O)C1=CC=C(C#N)C=C1 SBB059552 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 SBB049852 [0,2,0,0,0,0|0,0,0]=2 986 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 SBB063870 [0,2,0,0,0,0|0,0,0]=2 987 B12R1.19 CC(=O)CC1=CC=C(Cl)C(Cl)=C1 SBB005841 [0,2,0,0,0,0|1,0,0]=3 988 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 SBB090087 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.19 CC(=O)NC1=CC(Cl)=C(Cl)C=C1 SBB093225 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.19 CC(=O)NC1=CC(Cl)=C(F)C=C1 SBB090651 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.19 CC(=O)NC1=CC(F)=C(Br)C=C1 SBB097859 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.19 CC(=O)NC1=CC(F)=C(F)C=C1 SBB017328 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.19 CC1=CC(CC(=O)O)=CC=C1F SBB088168 [0,2,0,0,0,0|0,0,0]=2 994 B12R1.19 CC1=CC=C(CC(=O)O)C=C1C SBB017956 [0,2,0,0,0,0|0,0,0]=2 995 B12R1.19 CC1=CC=C(CC(=O)O)C=C1F SBB088167 [0,2,0,0,0,0|0,0,0]=2 996 B12R1.19 NC1=C(O)C=CC(CC(=O)O)=C1 SBB052639 [0,2,0,0,0,0|0,0,0]=2 997 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 SBB003501 [0,2,0,0,0,0|0,0,0]=2 998 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 SBB064497 [0,2,0,0,0,0|0,0,0]=2 999 B12R1.19 O=C(O)CC1=CC=C(F)C(Br)=C1 SBB064034 [0,2,0,0,0,0|0,0,0]=2 1000 B12R1.19 O=C(O)CC1=CC=C(F)C(Cl)=C1 SBB064032 [0,2,0,0,0,0|0,0,0]=2 1001 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 SBB063735 [0,2,0,0,0,0|0,0,0]=2 1002 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 SBB071465 [0,2,0,0,0,0|0,0,0]=2 1003 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 SBB064931 [0,2,0,0,0,0|0,0,0]=2 1004 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 SBB080453 [0,2,0,0,0,0|2,0,0]=4 1005 B12R1.20 CC(=O)N(C)C1=CC=C(O)C=C1 SBB072886 [0,2,0,0,0,0|2,0,0]=4 1006 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 SBB064110 [0,2,0,0,0,0|0,0,0]=2 1007 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 SBB037860 [0,2,0,0,0,0|0,0,0]=2 1008 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 SBB065020 [0,2,0,0,0,0|0,0,0]=2 1009 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 SBB097533 [0,2,0,0,0,0|0,0,0]=2 1010 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 SBB028364 [0,2,0,0,0,0|0,0,0]=2 1011 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 SBB062828 [0,2,0,0,0,0|0,0,0]=2 1012 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 SBB058359 [0,2,0,0,0,0|0,0,0]=2 1013 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 SBB057734 [0,2,0,0,0,0|0,0,0]=2 1014 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 SBB008325 [0,2,0,0,0,0|0,0,0]=2 1015 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 SBB063787 [0,2,0,0,0,0|0,0,0]=2 1016 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 SBB065018 [0,2,0,0,0,0|0,0,0]=2 1017 B12R1.20 OC(=O)C(C)C1=CC=C(O)C=C1 SBB003894 [0,2,0,0,0,0|0,0,0]=2 1018 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 SBB050418 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 SBB004507 [0,2,0,0,0,0|2,0,0]=4 1020 B12R1.49 CC1=CC=C(NC(=O)CN)C=C1 SBB004993 [0,2,0,0,0,0|2,0,0]=4 1021 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 SBB083090 [0,2,0,0,0,0|1,1,0]=4 1022 B12R1.49 CC1=CC=C(OC(=O)CCl)C=C1 SBB060341 [0,2,0,0,0,0|2,0,0]=4 1023 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 SBB080274 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SBB080008 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 SBB080431 [0,2,0,0,0,0|1,0,0]=3 1026 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SBB017032 [0,2,0,0,0,0|0,0,0]=2 1027 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SBB059052 [0,2,0,0,0,0|0,0,0]=2 1028 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 SBB021009 [0,2,0,0,0,0|1,0,0]=3 1029 B12R1.49 NNC(=O)NC1=CC=C(Cl)C=C1 SBB030327 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.49 N\C(CC1=CC=C(Cl)C=C1)=N/O SBB081889 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 SBB051004 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 SBB000881 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 SBB004510 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 SBB002113 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 SBB023446 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.49 O=C(CCl)OC1=CC=C(Cl)C=C1 SBB056714 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.106 CC1=CC=C(C[S+](=O)([O-])Cl)C=C1 SBB027263 [0,2,0,0,0,0|1,0,1]=4 1038 B12R1.106 CP(=O)(O)OC1=CC=C(Cl)C=C1 SBB103202 [0,2,0,0,0,0|2,0,0]=4 1039 B12R1.106 CP(=O)(O)OC1=CC=C(F)C=C1 SBB103195 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Br)C=C1 SBB066483 [0,2,0,0,0,0|1,0,1]=4 1041 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Cl)C=C1 SBB018191 [0,2,0,0,0,0|1,0,1]=4 1042 B12R1.106 O=S(=O)(Cl)CC1=CC=C(F)C=C1 SBB018099 [0,2,0,0,0,0|1,0,1]=4 1043 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 SBB097860 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.233 CC(=O)NC1=C(Cl)C=C(Br)C=C1 SBB100472 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 SBB090652 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 SBB088485 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 SBB050334 [0,2,0,0,0,0|2,0,0]=4 1048 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1F SBB009911 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1C SBB090089 [0,2,0,0,0,0|2,0,0]=4 1050 B12R1.233 CC(=O)NC1=CC=C(N)C=C1C SBB017958 [0,2,0,0,0,0|2,0,0]=4 1051 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 SBB027289 [0,2,0,0,0,0|0,0,0]=2 1052 B12R1.233 CC1=CC(=O)N(CC(=O)O)C=C1 SBB303320 [0,2,0,0,0,0|1,0,0]=3 1053 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 SBB088156 [0,2,0,0,0,0|0,0,0]=2 1054 B12R1.233 CC1=NC(O)=C(CC(=O)O)C=N1 SBB116037 [0,2,0,0,0,0|2,0,0]=4 1055 B12R1.233 N(C(C)=O)C1=C(C)C=C(Br)C=C1 SBB005784 [0,2,0,0,0,0|2,0,0]=4 1056 B12R1.233 N(C(C)=O)C1=C(F)C=C(Cl)C=C1 SBB003684 [0,2,0,0,0,0|2,0,0]=4 1057 B12R1.233 NC(=O)CC1=C(Cl)C=C(F)C=C1 SBB090653 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.233 NC(=O)NC1=C(F)C=C(F)C=C1 SBB088597 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.233 NC1=NC=C(CC(=O)O)C(O)=N1 SBB019065 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 SBB003502 [0,2,0,0,0,0|0,0,0]=2 1061 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 SBB037936 [0,2,0,0,0,0|0,0,0]=2 1062 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1F SBB052731 [0,2,0,0,0,0|0,0,0]=2 1063 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1F SBB064352 [0,2,0,0,0,0|0,0,0]=2 1064 B12R1.233 O=C(O)CC1=CNC(=O)NC1=O SBB019364 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.233 O=C(O)CN1C=CC(=O)NC1=O SBB047784 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.233 OC(=O)CC1=C(Cl)C=C(F)C=C1 SBB003675 [0,2,0,0,0,0|0,0,0]=2 1067 B12R1.34 CCC(=O)N(C)C1=CC=CC=C1 SBB087708 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.34 CN(C(=O)CBr)C1=CC=CC=C1 SBB080042 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 SBB010703 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 SBB053707 [0,2,0,0,0,0|0,0,0]=2 1071 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 SBB007734 [0,2,0,0,0,0|0,0,0]=2 1072 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SBB017485 [0,2,0,0,0,0|0,0,0]=2 1073 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 SBB051444 [0,2,0,0,0,0|0,0,0]=2 1074 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 SBB007729 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 SBB063242 [0,2,0,0,0,0|1,0,1]=4 1076 B12R1.34 O\N=C(/C)C(=O)C1=CC=CC=C1 SBB003926 [0,2,0,0,0,0|1,0,1]=4 1077 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 SBB057682 [0,2,0,0,0,0|0,0,0]=2 1078 B12R1.124 CC1=CC=CC=C1C(=O)C(=O)O SBB063460 [0,2,0,0,0,0|0,0,1]=3 1079 B12R1.124 NC(C(=O)O)C1=CC=CC=C1Cl SBB052787 [0,2,0,0,0,0|0,0,0]=2 1080 B12R1.124 O=C(O)C(Br)C1=CC=CC=C1Cl SBB063226 [0,2,0,0,0,0|0,0,0]=2 1081 B12R1.124 O=C(O)C(O)C1=C(F)C=CC=C1 SBB088383 [0,2,0,0,0,0|0,0,0]=2 1082 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Cl SBB003705 [0,2,0,0,0,0|0,0,0]=2 1083 B12R1.225 CC(=O)N(C)C1=CC=CC(N)=C1 SBB080441 [0,2,0,0,0,0|2,0,0]=4 1084 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 SBB028363 [0,2,0,0,0,0|0,0,0]=2 1085 B12R1.225 O=C(O)C(O)C1=CC=CC(Cl)=C1 SBB065014 [0,2,0,0,0,0|0,0,0]=2 1086 B12R1.253 CC(=O)C(C)(O)C1=CN=CC=C1 SBB013524 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 SBB063153 [0,2,0,0,0,0|0,0,0]=2 1088 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 SBB068832 [0,2,0,0,0,0|0,0,0]=2 1089 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=C1 SBB063248 [0,2,0,0,0,0|0,0,0]=2 1090 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 SBB088489 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.253 O=C(O)C(F)(F)C1=CC=CC=C1 SBB088578 [0,2,0,0,0,0|0,0,0]=2 1092 B12R1.478 CC(=O)C(C#N)C1=CC=CC=C1 SBB001837 [0,2,0,0,0,0|1,0,0]=3 1093 B12R1.478 CCC(C(=O)Cl)C1=CC=CC=C1 SBB067924 [0,2,0,0,0,0|1,0,0]=3 1094 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 SBB042503 [0,2,0,0,0,0|0,0,0]=2 1095 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 SBB058045 [0,2,0,0,0,0|0,0,0]=2 1096 B12R1.564 O=S(=O)(O)C(O)C1=CC=CC=N1 SBB000274 [0,2,0,0,0,0|2,0,0]=4 1097 B12R1.32 CCNC(=O)NC1=CC=CC=C1 SBB008390 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.32 CCOC(=O)CC1=CC=CC=N1 SBB058275 [0,2,0,0,0,0|1,0,0]=3 1099 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SBB053836 [0,2,0,0,0,0|1,0,0]=3 1100 B12R1.32 CCOC(=O)CC1=CN=CC=C1 SBB058276 [0,2,0,0,0,0|1,0,0]=3 1101 B12R1.32 CCOC(=O)NC1=NC=CC=C1 SBB017258 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 SBB072741 [0,2,0,0,0,0|2,0,0]=4 1103 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 SBB053602 [0,2,0,0,0,0|2,0,0]=4 1104 B12R1.50 CC1=CC(NC(=O)CCl)=CC=C1 SBB004509 [0,2,0,0,0,0|2,0,0]=4 1105 B12R1.50 CC1=CC(OC(=O)CCl)=CC=C1 SBB060342 [0,2,0,0,0,0|2,0,0]=4 1106 B12R1.50 CC1=CC=CC(NC(=O)CBr)=C1 SBB050419 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.50 CCC(=O)NC1=CC(N)=CC=C1 SBB027266 [0,2,0,0,0,0|2,0,0]=4 1108 B12R1.50 CCC(=O)NC1=CC(O)=CC=C1 SBB080003 [0,2,0,0,0,0|2,0,0]=4 1109 B12R1.50 NNC(=O)CC1=CC(Cl)=CC=C1 SBB055220 [0,2,0,0,0,0|1,0,0]=3 1110 B12R1.50 N\C(CC1=CC(Cl)=CC=C1)=N/O SBB024503 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.50 O=C(CBr)NC1=CC(Cl)=CC=C1 SBB050436 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.50 O=C(CCl)NC1=CC(Cl)=CC=C1 SBB037894 [0,2,0,0,0,0|2,0,0]=4 1113 B12R1.50 O=C(CCl)NC1=CC(I)=CC=C1 SBB303363 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.50 O=C(CCl)NC1=CC=CC(Br)=C1 SBB016594 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.50 O=C(CCl)NC1=CC=CC(F)=C1 SBB040612 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.50 O=C(CCl)NC1=CC=CC(O)=C1 SBB072813 [0,2,0,0,0,0|2,0,0]=4 1117 B12R1.194 C#CC(C)(O)CC1=CC=CC=C1 SBB002525 [0,2,0,0,0,0|1,0,1]=4 1118 B12R1.194 NNS(=O)(=O)CC1=CC=CC=C1 SBB072378 [0,2,0,0,0,0|1,0,1]=4 1119 B12R1.371 CC1=C(NC(=O)CCl)C=CC=C1 SBB004515 [0,2,0,0,0,0|2,0,0]=4 1120 B12R1.371 CC1=CC=CC=C1OC(=O)CCl SBB060343 [0,2,0,0,0,0|2,0,0]=4 1121 B12R1.371 CCC(=O)NC1=CC=CC=C1O SBB080002 [0,2,0,0,0,0|2,0,0]=4 1122 B12R1.371 NNC(=O)NC1=CC=CC=C1O SBB023488 [0,2,0,0,0,0|2,0,0]=4 1123 B12R1.371 O=C(CBr)NC1=CC=CC=C1F SBB080067 [0,2,0,0,0,0|2,0,0]=4 1124 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 SBB017998 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.371 O=C(CCl)NC1=CC=CC=C1Br SBB046877 [0,2,0,0,0,0|2,0,0]=4 1126 B12R1.371 O=C(CCl)NC1=CC=CC=C1Cl SBB000431 [0,2,0,0,0,0|2,0,0]=4 1127 B12R1.371 O=C(CCl)NC1=CC=CC=C1O SBB072362 [0,2,0,0,0,0|2,0,0]=4 1128 B12R1.371 O=C(CS)NC1=CC=CC=C1Cl SBB000405 [0,2,0,0,0,0|1,1,0]=4 1129 B12R1.75 CC(=O)NC1=CC=CC=C1C#N SBB017250 [0,2,0,0,0,0|2,0,0]=4 1130 B12R1.75 CC(=O)OC1=C(CN)C=CC=C1 SBB051628 [0,2,0,0,0,0|2,0,0]=4 1131 B12R1.75 CCC1=C(NC(C)=O)C=CC=C1 SBB058947 [0,2,0,0,0,0|2,0,0]=4 1132 B12R1.75 CCC1=C(NC(N)=O)C=CC=C1 SBB087812 [0,2,0,0,0,0|2,0,0]=4 1133 B12R1.75 COC1=CC=CC=C1CC(=O)O SBB063364 [0,2,0,0,0,0|0,0,0]=2 1134 B12R1.75 COC1=CC=CC=C1CC(N)=S SBB089825 [0,2,0,0,0,0|1,1,0]=4 1135 B12R1.75 COC1=CC=CC=C1NC(N)=O SBB087990 [0,2,0,0,0,0|2,0,0]=4 1136 B12R1.127 CC(=O)NC1=C(F)C=CC(F)=C1 SBB088486 [0,2,0,0,0,0|2,0,0]=4 1137 B12R1.127 CC(=O)NC1=CC(C)=CC=C1O SBB087919 [0,2,0,0,0,0|2,0,0]=4 1138 B12R1.127 CC(=O)NC1=CC(Cl)=CC=C1C SBB055081 [0,2,0,0,0,0|2,0,0]=4 1139 B12R1.127 CC(=O)NC1=CC(N)=CC=C1C SBB070110 [0,2,0,0,0,0|2,0,0]=4 1140 B12R1.127 CC1=C(CC(=O)O)C=C(F)C=C1 SBB088165 [0,2,0,0,0,0|0,0,0]=2 1141 B12R1.127 CC1=CC(CC(=O)O)=C(F)C=C1 SBB088160 [0,2,0,0,0,0|0,0,0]=2 1142 B12R1.127 CC1=CC=C(Br)C=C1CC(=O)Cl SBB053624 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.127 CC1=CC=C(Br)C=C1CC(=O)O SBB052738 [0,2,0,0,0,0|0,0,0]=2 1144 B12R1.127 CC1=CC=C(C)C(CC(=O)O)=C1 SBB063866 [0,2,0,0,0,0|0,0,0]=2 1145 B12R1.127 CC1=NN(CC(=O)O)C(=O)C=C1 SBB010491 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.127 O=C(O)CC1=C(F)C=CC(Cl)=C1 SBB090850 [0,2,0,0,0,0|0,0,0]=2 1147 B12R1.127 O=C(O)CC1=CC(=O)NNC1=O SBB014337 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.127 O=C(O)CC1=CC(F)=CC=C1Cl SBB064342 [0,2,0,0,0,0|0,0,0]=2 1149 B12R1.127 O=C(O)CN1N=C(O)C=CC1=O SBB028088 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.127 O=C(O)CN1NC(=O)C=CC1=O SBB016548 [0,2,0,0,0,0|2,0,0]=4 1151 B12R1.127 OC(=O)CC1=C(F)C=CC(F)=C1 SBB006659 [0,2,0,0,0,0|0,0,0]=2 1152 B12R1.151 O=S(=O)(Cl)CC1=C(F)C=CC=C1 SBB018101 [0,2,0,0,0,0|1,0,1]=4 1153 B12R1.151 O=S(=O)(Cl)CC1=CC=CC=C1Cl SBB016793 [0,2,0,0,0,0|1,0,1]=4 1154 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 SBB087712 [0,2,0,0,0,0|2,0,0]=4 1155 B12R1.224 CC(=O)NC1=C(F)C(Cl)=CC=C1 SBB090654 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.224 CC(=O)NC1=C(O)C(Cl)=CC=C1 SBB050371 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.224 CC1=C(F)C=CC=C1CC(=O)O SBB088166 [0,2,0,0,0,0|0,0,0]=2 1158 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Cl SBB003500 [0,2,0,0,0,0|0,0,0]=2 1159 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1F SBB065962 [0,2,0,0,0,0|0,0,0]=2 1160 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F SBB052776 [0,2,0,0,0,0|0,0,0]=2 1161 B12R1.1009 CC(=O)NC1=C(C)C=CC=C1C SBB008144 [0,2,0,0,0,0|2,0,0]=4 1162 B12R1.1009 CC(=O)NC1=C(Cl)C=CC=C1Cl SBB006286 [0,2,0,0,0,0|2,0,0]=4 1163 B12R1.1009 CC(=O)NC1=C(F)C=CC=C1F SBB088484 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.1009 N=C(N)CC1=C(Cl)C=CC=C1Cl SBB099135 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.1009 NC(=O)CC1=C(Cl)C=CC=C1Cl SBB057916 [0,2,0,0,0,0|1,0,0]=3 1166 B12R1.1009 NC(=S)CC1=C(Cl)C=CC=C1Cl SBB095889 [0,2,0,0,0,0|1,1,0]=4 1167 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl SBB003503 [0,2,0,0,0,0|0,0,0]=2 1168 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F SBB052835 [0,2,0,0,0,0|0,0,0]=2 1169 B12R1.1009 OC(=O)CC1=C(F)C=CC=C1F SBB006631 [0,2,0,0,0,0|0,0,0]=2 1170 B12R1.101 CC(=O)NC1=CC(F)=CC(F)=C1 SBB088483 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.101 CC1=CC(C)=CC(CC(=O)O)=C1 SBB043953 [0,2,0,0,0,0|0,0,0]=2 1172 B12R1.101 CC1=CC(F)=CC(CC(=O)O)=C1 SBB088155 [0,2,0,0,0,0|0,0,0]=2 1173 B12R1.101 CC1=NC(CC(=O)O)=CC(O)=N1 SBB302967 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.101 O=C(O)CC1=CC(F)=CC(Cl)=C1 SBB064356 [0,2,0,0,0,0|0,0,0]=2 1175 B12R1.101 OC(=O)CC1=CC(F)=CC(F)=C1 SBB006660 [0,2,0,0,0,0|0,0,0]=2 1176 B12R1.119 CC1=CC(CS(=O)(=O)Cl)=CC=C1 SBB016792 [0,2,0,0,0,0|1,0,1]=4 1177 B12R1.119 NC1=CC=CC(CS(N)(=O)=O)=C1 SBB072116 [0,2,0,0,0,0|1,0,1]=4 1178 B12R1.119 O=S(=O)(Cl)CC1=CC=CC(Cl)=C1 SBB018190 [0,2,0,0,0,0|1,0,1]=4 1179 B12R1.119 O=S(=O)(Cl)CC1=CC=CC(F)=C1 SBB094108 [0,2,0,0,0,0|1,0,1]=4 1180 B12R1.438 CC(=O)OC1=CC=CC(C=O)=C1 SBB064213 [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.438 COC1=CC(NC(C)=O)=CC=C1 SBB080674 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 SBB042511 [0,2,0,0,0,0|0,0,0]=2 1183 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 SBB055060 [0,2,0,0,0,0|1,1,0]=4 1184 B12R1.438 COC1=CC=CC(NC(N)=O)=C1 SBB087993 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 SBB115887 [0,2,0,0,0,0|2,0,0]=4 1186 B10R1.66 O=C(O)CCN1C=CC=C1 SBB010274 [0,0,1,1,0,0|1,0,1]=4 1187 B10R1.66 O=C(O)\C=C\C1=COC=C1 SBB004191 [0,0,1,1,0,0|1,0,1]=4 1188 B10R1.66 O=C(O)\C=C\C1=CSC=C1 SBB004033 [0,0,1,1,0,0|1,0,1]=4 1189 B10R1.66 OC(=O)CCC1=CC=CO1 SBB005449 [0,0,1,1,0,0|1,0,1]=4 1190 B10R1.66 OC(=O)\C=C\C1=CC=CO1 SBB004189 [0,0,1,1,0,0|1,0,1]=4 1191 B10R1.66 OC(=O)\C=C\C1=CC=CS1 SBB004032 [0,0,1,1,0,0|1,0,1]=4 1192 B10R2.7 C1=CC2=C(C=C1)CCC2 SBB060083 [1,0,0,1,0,0|1,0,1]=4 1193 B10R2.7 C1=CC2=C(C=C1)OC=C2 SBB060607 [1,0,0,1,0,0|0,0,1]=3 1194 B10R2.7 C1=CC2=C(C=C1)OCO2 SBB059641 [1,0,0,1,0,0|1,0,1]=4 1195 B10R2.7 C1=CC2=C(C=C1)SC=N2 SBB058513 [1,0,0,1,0,0|1,1,0]=4 1196 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [1,0,0,1,0,0|1,0,0]=3 1197 B10R2.7 C1=CC=C2COCC2=C1 SBB068697 [1,0,0,1,0,0|2,0,0]=4 1198 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [1,0,0,1,0,0|1,0,1]=4 1199 B10R2.7 C1=CC=C2OCCC2=C1 SBB056038 [1,0,0,1,0,0|0,0,1]=3 1200 B10R2.7 C1=CC=C2SC=CC2=C1 SBB055961 [1,0,0,1,0,0|0,1,1]=4 1201 B10R2.7 C1=CC=C2[S+]=CSC2=C1 SBB099195 [1,0,0,1,0,0|1,1,0]=4 1202 B10R2.7 N1C=NC2=C1C=CC=C2 SBB004294 [1,0,0,1,0,0|2,0,0]=4 1203 B10R2.7 N1CCC2=C1C=CC=C2 SBB004291 [1,0,0,1,0,0|1,0,1]=4 1204 B12R2.24 CC1CNC2=CC=CC=C2O1 SBB080829 [0,0,0,1,0,1|1,0,1]=4 1205 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 SBB000094 [0,0,0,1,0,1|0,0,1]=3 1206 B12R2.24 O=C1C=CC2=CC=CC=C2N1 SBB004119 [0,0,0,1,0,1|1,0,1]=4 1207 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SBB068599 [0,0,0,1,0,1|1,0,0]=3 1208 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 SBB058834 [0,0,0,1,0,1|0,0,0]=2 1209 B12R2.24 O=C1CCC2=CC=CC=C2N1 SBB056014 [0,0,0,1,0,1|1,0,0]=3 1210 B12R2.24 O=C1CCN2C=CC=CC2=N1 SBB058237 [0,0,0,1,0,1|2,0,0]=4 1211 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SBB017923 [0,0,0,1,0,1|1,0,0]=3 1212 B12R2.24 O=C1COC2=C(N=CC=C2)N1 SBB006815 [0,0,0,1,0,1|2,0,0]=4 1213 B12R2.24 O=C1COC2=CC=CC=C2N1 SBB016409 [0,0,0,1,0,1|1,0,0]=3 1214 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 SBB061807 [0,0,0,1,0,1|1,0,0]=3 1215 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SBB059635 [0,0,0,1,0,1|1,0,1]=4 1216 B12R2.24 OC1=CC2=CC=CC=C2C=C1 SBB040896 [0,0,0,1,0,1|1,0,1]=4 1217 B12R2.24 OC1=NC2=CC=CC=C2N=C1 SBB056025 [0,0,0,1,0,1|1,0,1]=4 1218 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SBB008511 [0,0,0,1,0,1|1,0,1]=4 1219 B12R2.2057 C1=CC=C(OCC2CO2)C=C1 SBB060525 [0,0,0,1,0,1|1,0,1]=4 1220 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 SBB053554 [0,0,0,1,0,1|0,0,0]=2 1221 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 SBB059280 [0,1,0,1,0,0|2,0,0]=4 1222 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 SBB010313 [0,1,0,1,0,0|1,0,1]=4 1223 B12R2.606 CC1=CC=C2OC(=S)NC2=C1 SBB055993 [0,1,0,1,0,0|1,1,0]=4 1224 B12R2.606 CC1=CC=C2OC(N)=NC2=C1 SBB072076 [0,1,0,1,0,0|2,0,0]=4 1225 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 SBB013056 [0,1,0,1,0,0|2,0,0]=4 1226 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 SBB059434 [0,1,0,1,0,0|2,0,0]=4 1227 B12R2.606 CC1=NC2=C(C=CC(F)=C2)O1 SBB059632 [0,1,0,1,0,0|2,0,0]=4 1228 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 SBB051986 [0,1,0,1,0,0|2,0,0]=4 1229 B12R2.606 CC1=NC2=CC=C(O)C=C2O1 SBB072525 [0,1,0,1,0,0|2,0,0]=4 1230 B12R2.606 ClC1=CC=C2OC(Cl)=NC2=C1 SBB018822 [0,1,0,1,0,0|2,0,0]=4 1231 B12R2.606 N1C(=O)OC2=C1C=C(Cl)C=C2 SBB003864 [0,1,0,1,0,0|1,0,0]=3 1232 B12R2.606 N1C(=S)OC2=C1C=CC(Cl)=C2 SBB003708 [0,1,0,1,0,0|1,1,0]=4 1233 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 SBB012801 [0,1,0,1,0,0|2,0,0]=4 1234 B12R2.606 NC1=CC2=C(C=C1)NC(=O)O2 SBB010320 [0,1,0,1,0,0|1,0,0]=3 1235 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 SBB072177 [0,1,0,1,0,0|1,0,0]=3 1236 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 SBB072398 [0,1,0,1,0,0|1,0,0]=3 1237 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 SBB010120 [0,1,0,1,0,0|1,0,0]=3 1238 B12R2.606 NC1=CC=C2NC(=O)SC2=C1 SBB302502 [0,1,0,1,0,0|1,1,0]=4 1239 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)O1 SBB003874 [0,1,0,1,0,0|2,0,0]=4 1240 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SBB058442 [0,1,0,1,0,0|1,0,0]=3 1241 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SBB005897 [0,1,0,1,0,0|1,0,0]=3 1242 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 SBB003879 [0,1,0,1,0,0|1,0,0]=3 1243 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 SBB018719 [0,1,0,1,0,0|1,0,0]=3 1244 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 SBB038172 [0,1,0,1,0,0|0,0,0]=2 1245 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 SBB094871 [0,1,0,1,0,0|1,0,0]=3 1246 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 SBB003865 [0,1,0,1,0,0|1,0,0]=3 1247 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 SBB003866 [0,1,0,1,0,0|1,0,0]=3 1248 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 SBB094734 [0,1,0,1,0,0|2,0,0]=4 1249 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 SBB056005 [0,1,0,1,0,0|2,0,0]=4 1250 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 SBB056008 [0,1,0,1,0,0|2,0,0]=4 1251 B12R2.606 O=C1OC2=CC=C(O)C=C2S1 SBB012368 [0,1,0,1,0,0|1,0,0]=3 1252 B12R2.606 OC1=CC2=C(C=C1)SC(=O)O2 SBB071406 [0,1,0,1,0,0|1,0,0]=3 1253 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)O1 SBB003707 [0,1,0,1,0,0|1,1,0]=4 1254 B12R2.606 SC1=NC2=CC(Cl)=CC=C2O1 SBB046564 [0,1,0,1,0,0|1,1,0]=4 1255 B12R2.606 SC1=NC2=CC=C(Cl)C=C2O1 SBB046570 [0,1,0,1,0,0|1,1,0]=4 1256 B12R2.18 CC1CC2=CC=CC=C2C1=O SBB067570 [0,1,0,1,0,0|1,0,1]=4 1257 B12R2.18 CN1C(=O)CC2=CC=CC=C21 SBB006878 [0,1,0,1,0,0|1,0,0]=3 1258 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 SBB017054 [0,1,0,1,0,0|1,0,0]=3 1259 B12R2.18 CN1C(=O)SC2=C1C=CC=C2 SBB071442 [0,1,0,1,0,0|1,1,0]=4 1260 B12R2.18 CN1C(=S)OC2=C1C=CC=C2 SBB012364 [0,1,0,1,0,0|1,1,0]=4 1261 B12R2.18 NC1C2=CC=CC=C2CC1O SBB052066 [0,1,0,1,0,0|1,0,1]=4 1262 B12R2.18 NC1CC2=CC=CC=C2C1O SBB052067 [0,1,0,1,0,0|1,0,1]=4 1263 B12R2.18 O=C1C2=CC=CC=C2CC1Br SBB054709 [0,1,0,1,0,0|1,0,1]=4 1264 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SBB068426 [0,1,0,1,0,0|0,0,1]=3 1265 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O SBB009100 [0,1,0,1,0,0|1,0,1]=4 1266 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O SBB087795 [0,1,0,1,0,0|0,1,1]=4 1267 B12R2.18 OC1C2=C(C=CC=C2)CC1Br SBB058660 [0,1,0,1,0,0|1,0,1]=4 1268 B12R2.18 O[C@H]1CC2=C(C=CC=C2)[C@H]1N SBB006600 [0,1,0,1,0,0|1,0,1]=4 1269 B12R2.27 OCC1CC1C2=CC=CC=C2 SBB084422 [0,1,0,1,0,0|1,0,1]=4 1270 B12R2.32 CNC1=NC2=C(C=CC=C2)O1 SBB086585 [0,1,0,1,0,0|2,0,0]=4 1271 B12R2.32 ClCC1=NC2=CC=CC=C2O1 SBB054950 [0,1,0,1,0,0|2,0,0]=4 1272 B12R2.32 NCC1=CC2=CC=CC=C2O1 SBB072101 [0,1,0,1,0,0|1,0,1]=4 1273 B12R2.32 NCC1=NC2=CC=CC=C2O1 SBB002785 [0,1,0,1,0,0|2,0,0]=4 1274 B12R2.32 NCC1CC2=CC=CC=C2O1 SBB013722 [0,1,0,1,0,0|1,0,1]=4 1275 B12R2.32 NNC1=NC2=CC=CC=C2O1 SBB015304 [0,1,0,1,0,0|2,0,0]=4 1276 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 SBB010059 [0,1,0,1,0,0|0,0,1]=3 1277 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 SBB068480 [0,1,0,1,0,0|0,1,1]=4 1278 B12R2.32 O=CC1=CC2=CC=CC=C2N1 SBB027648 [0,1,0,1,0,0|1,0,1]=4 1279 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 SBB000095 [0,1,0,1,0,0|2,0,0]=4 1280 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SBB052327 [0,1,0,1,0,0|1,1,0]=4 1281 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 SBB087818 [0,1,0,1,0,0|0,1,1]=4 1282 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 SBB004085 [0,1,0,1,0,0|2,0,0]=4 1283 B12R2.32 OCC1=NC2=CC=CC=C2S1 SBB003908 [0,1,0,1,0,0|1,1,0]=4 1284 B12R2.32 OCC1CC2=C(C=CC=C2)N1 SBB086644 [0,1,0,1,0,0|1,0,1]=4 1285 B12R2.32 OCC1CC2=CC=CC=C2O1 SBB017925 [0,1,0,1,0,0|0,0,2]=4 1286 B12R2.95 CC1(C)CC2=CC=CC=C2O1 SBB049505 [0,1,0,1,0,0|1,0,1]=4 1287 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 SBB010312 [0,1,0,1,0,0|1,0,1]=4 1288 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 SBB072543 [0,1,0,1,0,0|2,0,0]=4 1289 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 SBB054564 [0,1,0,1,0,0|1,0,0]=3 1290 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 SBB086757 [0,1,0,1,0,0|1,0,0]=3 1291 B12R2.202 S=C1NC2=C(O1)C(Cl)=CC=C2 SBB003709 [0,1,0,1,0,0|1,1,0]=4 1292 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 SBB015052 [0,1,0,1,0,0|1,1,0]=4 1293 B8R1.8 OCCC1=CC=CS1 SBB062831 [1,0,0,0,1,0|1,0,1]=4 1294 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [0,0,0,0,2,0|2,0,0]=4 1295 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [0,0,0,0,2,0|2,0,0]=4 1296 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [0,0,0,0,2,0|2,0,0]=4 1297 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [0,0,0,0,2,0|2,0,0]=4 1298 B8R1.7 NC(=O)C1=CC=CO1 SBB028188 [0,0,0,0,2,0|2,0,0]=4 1299 B8R1.7 NC(=O)C1=CC=CS1 SBB028227 [0,0,0,0,2,0|2,0,0]=4 1300 B8R1.7 O=C(Cl)C1=CC=CO1 SBB004224 [0,0,0,0,2,0|2,0,0]=4 1301 B8R1.7 O=C(Cl)C1=CC=CS1 SBB004099 [0,0,0,0,2,0|2,0,0]=4 1302 B8R1.7 O=C(Cl)C1=CSC=C1 SBB053641 [0,0,0,0,2,0|2,0,0]=4 1303 B8R1.7 O=C(O)C1=CC=CN1 SBB004332 [0,0,0,0,2,0|1,0,0]=3 1304 B8R1.7 O=C(O)C1=CC=CO1 SBB004324 [0,0,0,0,2,0|1,0,0]=3 1305 B8R1.7 O=C(O)C1=CC=CS1 SBB004241 [0,0,0,0,2,0|1,0,0]=3 1306 B8R1.7 O=C(O)C1=CC=NO1 SBB004319 [0,0,0,0,2,0|2,0,0]=4 1307 B8R1.7 O=C(O)C1=CC=NS1 SBB013118 [0,0,0,0,2,0|2,0,0]=4 1308 B8R1.7 O=C(O)C1=CN=CN1 SBB004323 [0,0,0,0,2,0|2,0,0]=4 1309 B8R1.7 O=C(O)C1=CN=CO1 SBB053191 [0,0,0,0,2,0|2,0,0]=4 1310 B8R1.7 O=C(O)C1=CN=CS1 SBB065748 [0,0,0,0,2,0|2,0,0]=4 1311 B8R1.7 O=C(O)C1=CNN=C1 SBB017552 [0,0,0,0,2,0|2,0,0]=4 1312 B8R1.7 O=C(O)C1=COC=C1 SBB004325 [0,0,0,0,2,0|1,0,0]=3 1313 B8R1.7 O=C(O)C1=COC=N1 SBB053171 [0,0,0,0,2,0|2,0,0]=4 1314 B8R1.7 O=C(O)C1=CON=C1 SBB053165 [0,0,0,0,2,0|2,0,0]=4 1315 B8R1.7 O=C(O)C1=CSC=C1 SBB004240 [0,0,0,0,2,0|1,0,0]=3 1316 B8R1.7 O=C(O)C1=CSC=N1 SBB010166 [0,0,0,0,2,0|2,0,0]=4 1317 B8R1.7 O=C(O)C1=NC=CN1 SBB010014 [0,0,0,0,2,0|2,0,0]=4 1318 B8R1.7 O=C(O)C1=NC=CS1 SBB053122 [0,0,0,0,2,0|2,0,0]=4 1319 B8R1.7 O=C(O)C1=NNC=C1 SBB000005 [0,0,0,0,2,0|2,0,0]=4 1320 B8R1.7 O=C(O)C1=NOC=C1 SBB065956 [0,0,0,0,2,0|2,0,0]=4 1321 B12R1.252 CC(=O)CCCC1=CC=CC=N1 SBB018700 [0,0,0,0,0,2|2,0,0]=4 1322 B12R1.252 CC(=O)CSCC1=CC=CC=C1 SBB058580 [0,0,0,0,0,2|1,0,0]=3 1323 B12R1.252 CC(=O)NCCC1=CC=CC=C1 SBB058213 [0,0,0,0,0,2|1,0,0]=3 1324 B12R1.252 CC(=O)OCCC1=CC=CC=C1 SBB061194 [0,0,0,0,0,2|1,0,0]=3 1325 B12R1.252 CC(=O)\C=N\NC1=CC=CC=C1 SBB056716 [0,0,0,0,0,2|1,0,1]=4 1326 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SBB102430 [0,0,0,0,0,2|2,0,0]=4 1327 B12R1.252 NC(=O)CCCC1=CC=CC=C1 SBB051450 [0,0,0,0,0,2|1,0,0]=3 1328 B12R1.252 NC(=O)N\N=C\C1=CC=CC=C1 SBB087692 [0,0,0,0,0,2|1,0,1]=4 1329 B12R1.252 NC(=S)NCCC1=CC=CC=C1 SBB017394 [0,0,0,0,0,2|1,1,0]=4 1330 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SBB040702 [0,0,0,0,0,2|1,0,0]=3 1331 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SBB063195 [0,0,0,0,0,2|1,0,0]=3 1332 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SBB008452 [0,0,0,0,0,2|0,0,0]=2 1333 B12R1.252 O=C(O)CCCC1=CC=CC=N1 SBB014662 [0,0,0,0,0,2|1,0,0]=3 1334 B12R1.252 O=C(O)CCCC1=CC=NC=C1 SBB014669 [0,0,0,0,0,2|1,0,0]=3 1335 B12R1.252 O=C(O)CCSC1=CC=CC=C1 SBB049906 [0,0,0,0,0,2|0,0,0]=2 1336 B12R1.252 O=C(O)CCSC1=CC=CC=N1 SBB103611 [0,0,0,0,0,2|1,0,0]=3 1337 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SBB003529 [0,0,0,0,0,2|0,0,0]=2 1338 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SBB063075 [0,0,0,0,0,2|0,0,0]=2 1339 B12R1.252 O=C(O)COCC1=CC=CC=C1 SBB048109 [0,0,0,0,0,2|0,0,0]=2 1340 B12R1.252 O=C(O)CSCC1=CC=CC=C1 SBB042552 [0,0,0,0,0,2|0,0,0]=2 1341 B12R1.252 OC(=O)CCOC1=CC=CC=C1 SBB003895 [0,0,0,0,0,2|0,0,0]=2