0 B10R1.18 CC(=O)CC1=CC=NC=C1 SBB055597 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 CC(=O)NC1=CC=CC=C1 SBB040833 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.18 CC(=O)NC1=CC=CC=N1 SBB085932 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.18 CC(=O)NC1=CC=NC=C1 SBB085931 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.18 CC(=O)OC1=CC=CC=C1 SBB058747 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.18 CC(=S)NC1=CC=CC=C1 SBB086797 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.18 CC(N)CC1=CN=CC=N1 SBB025636 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.18 C\[N+]([O-])=C/C1=CC=CC=C1 SBB085895 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.18 FC(F)OC1=CC=CC=C1 SBB070688 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.18 N=C(N)CC1=CC=CC=N1 SBB019209 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.18 N=C(N)CC1=CC=CN=C1 SBB019447 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.18 NC(=O)CC1=CC=CC=C1 SBB017634 [0,0,0,0,0,0|1,0,1]=2 15 B10R1.18 NC(=O)NC1=CC=CC=C1 SBB058197 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.18 NC(=S)CC1=CC=CC=C1 SBB016517 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.18 NC(=S)NC1=CC=CC=C1 SBB036022 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.18 NC(=S)NC1=CC=NC=C1 SBB028308 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.18 NC(=S)NC1=CN=CC=C1 SBB028309 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.18 NC(=S)NC1=NC=CC=C1 SBB017620 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.18 NC(N)=NC1=CC=CC=C1 SBB055106 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.18 O=C(Cl)CC1=CC=CC=C1 SBB040622 [0,0,0,0,0,0|2,0,1]=3 23 B10R1.18 O=C(Cl)OC1=CC=CC=C1 SBB060851 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.18 O=C(O)CC1=CC=CN=C1 SBB003812 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.18 O=C(O)CC1=NC=CC=C1 SBB003810 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.18 OB(O)CC1=CC=CC=C1 SBB052526 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.18 OC(=O)CC1=CC=NC=C1 SBB005759 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.18 [NH2+](C(=O)Cl)C1=CC=CC=C1 SBB060746 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.8 BrCCC1=CC=CC=C1 SBB059945 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.8 BrCCC1=NC=CC=C1 SBB014931 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 CCCC1=CC=CC=C1 SBB061210 [1,0,0,0,0,0|0,0,0]=1 32 B9R1.8 CCNC1=CC=CC=C1 SBB058818 [1,0,0,0,0,0|1,0,0]=2 33 B9R1.8 CNCC1=CC=CC=C1 SBB073015 [1,0,0,0,0,0|1,0,0]=2 34 B9R1.8 CNCC1=CC=CN=C1 SBB052430 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 CNCC1=CC=NC=C1 SBB047816 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.8 CNCC1=NC=CC=C1 SBB052457 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 CNCC1=NC=CN=C1 SBB014431 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 COCC1=CC=CC=C1 SBB063549 [1,0,0,0,0,0|1,0,0]=2 39 B9R1.8 ClCCC1=NC=CC=C1 SBB014886 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.8 N#CCC1=CC=CC=C1 SBB058386 [1,0,0,0,0,0|0,0,2]=3 41 B9R1.8 N#CCC1=CC=CN=C1 SBB027148 [1,0,0,0,0,0|1,0,2]=4 42 B9R1.8 N#CCC1=CC=NC=C1 SBB066966 [1,0,0,0,0,0|1,0,2]=4 43 B9R1.8 N#CCC1=NC=CC=C1 SBB049639 [1,0,0,0,0,0|1,0,2]=4 44 B9R1.8 N#CSC1=CC=CC=C1 SBB060831 [1,0,0,0,0,0|1,0,2]=4 45 B9R1.8 NCCC1=CC=CC=C1 SBB058801 [1,0,0,0,0,0|0,0,0]=1 46 B9R1.8 NCCC1=CC=CN=C1 SBB028204 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.8 NCCC1=CC=CN=C1 SBB052465 [1,0,0,0,0,0|1,0,0]=2 48 B9R1.8 NCCC1=CC=NC=C1 SBB014221 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.8 NCCC1=NC=CC=C1 SBB028206 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.8 NCCC1=NC=CN=C1 SBB010197 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.8 NNCC1=CC=CC=C1 SBB063024 [1,0,0,0,0,0|1,0,0]=2 52 B9R1.8 NOCC1=CC=CC=C1 SBB003971 [1,0,0,0,0,0|1,0,0]=2 53 B9R1.8 NOCC1=CC=CC=C1 SBB032957 [1,0,0,0,0,0|1,0,0]=2 54 B9R1.8 O=CCC1=CC=CC=C1 SBB061710 [1,0,0,0,0,0|1,0,1]=3 55 B9R1.8 O=CNC1=CC=CC=C1 SBB058769 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.8 O=S=NC1=CC=CC=C1 SBB007761 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.8 OCCC1=CC=CC=C1 SBB040879 [1,0,0,0,0,0|1,0,0]=2 58 B9R1.8 S=C=NC1=CC=CC=C1 SBB040940 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 SCCC1=CC=NC=C1 SBB065275 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.8 SCCC1=NC=CN=C1 SBB067078 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SBB058424 [0,1,0,0,0,0|1,0,1]=3 62 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SBB086853 [0,1,0,0,0,0|1,0,1]=3 63 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SBB054161 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SBB059339 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 SBB058218 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 SBB086906 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB028292 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 SBB090514 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SBB043758 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 SBB060032 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SBB086983 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 SBB047818 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.20 CC(C)OC1=CC=C(N)C=C1 SBB010330 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.20 CC(N)CC1=CC=C(Cl)C=C1 SBB000454 [0,1,0,0,0,0|0,0,0]=1 75 B11R1.20 CC(N)CC1=CC=C(F)C=C1 SBB052387 [0,1,0,0,0,0|0,0,0]=1 76 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SBB063734 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 SBB087944 [0,1,0,0,0,0|1,0,1]=3 78 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 SBB028290 [0,1,0,0,0,0|2,0,1]=4 79 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 SBB061970 [0,1,0,0,0,0|2,0,1]=4 80 B11R1.20 CC1=CC=C(OC(F)F)C=C1 SBB087277 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 SBB109890 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.20 FC(F)OC1=CC=C(Br)C=C1 SBB096413 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SBB028300 [0,1,0,0,0,0|1,0,1]=3 84 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 SBB062099 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 SBB055187 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 SBB055366 [0,1,0,0,0,0|1,0,1]=3 87 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 SBB041175 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 SBB041176 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 SBB038551 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 SBB055107 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SBB028301 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.20 NC1=CC=C(OC(F)F)C=C1 SBB003981 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.20 NC1=CC=C(SC(F)F)C=C1 SBB073004 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 SBB005859 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 SBB067909 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SBB042842 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 SBB008374 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SBB052671 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SBB052672 [0,1,0,0,0,0|2,0,1]=4 100 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SBB059600 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.20 SC1=CC=C(NC(C)=O)C=C1 SBB003881 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SBB064017 [0,1,0,0,0,0|1,0,2]=4 103 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 SBB055478 [0,1,0,0,0,0|1,0,1]=3 104 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SBB086654 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.36 CC(=O)N(O)C1=CC=CC=C1 SBB058639 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 SBB058576 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SBB007855 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 SBB055419 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.36 CN(C)C(=O)C1=CC=CC=C1 SBB058219 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 SBB017231 [0,1,0,0,0,0|1,0,1]=3 111 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 SBB028298 [0,1,0,0,0,0|1,0,1]=3 112 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SBB056598 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.36 O=C(C1=CC=CC=C1)C(F)F SBB087123 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 SBB007783 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 SBB007654 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 SBB086979 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 SBB007730 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 SBB017395 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.40 C1=CC=C(NC(=S)NC)C=C1 SBB003887 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.40 CC(CN)OC1=CC=CC=C1 SBB028307 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.40 CCC(=O)CC1=CC=CC=C1 SBB060892 [0,1,0,0,0,0|1,0,1]=3 122 B11R1.40 CNC(=O)NC1=CC=CC=C1 SBB008334 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.40 CNC(C)CC1=CC=CC=N1 SBB025630 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.40 CNC(C)CC1=CN=CC=N1 SBB025635 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 SBB040229 [0,1,0,0,0,0|1,0,2]=4 126 B11R1.40 NCC(=O)NC1=CC=CC=C1 SBB004992 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.40 NNC(=O)CC1=CC=CC=C1 SBB046750 [0,1,0,0,0,0|1,0,1]=3 128 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 SBB040738 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.40 NNC(=O)NC1=CC=CC=C1 SBB028305 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.40 NNC(=S)NC1=CC=CC=C1 SBB007538 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.40 N\C(CC1=CC=CC=C1)=N/O SBB055188 [0,1,0,0,0,0|1,0,1]=3 132 B11R1.40 O=C(CBr)NC1=CC=CC=C1 SBB051003 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.40 O=C(CC1=CC=CC=C1)NO SBB086771 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.40 O=C(CCl)NC1=CC=CC=C1 SBB030441 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.40 O=C(CCl)OC1=CC=CC=C1 SBB060340 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.40 O=C(CS)NC1=CC=CC=C1 SBB008339 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.86 CC(=O)CC1=CC=CC=C1Cl SBB054187 [0,1,0,0,0,0|1,0,1]=3 138 B11R1.86 CC(=O)CC1=CC=CC=C1F SBB086844 [0,1,0,0,0,0|1,0,1]=3 139 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 SBB084427 [0,1,0,0,0,0|2,0,1]=4 140 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 SBB048028 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SBB080001 [0,1,0,0,0,0|2,0,1]=4 142 B11R1.86 CC(=O)NC1=CC=CC=C1Br SBB094902 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.86 CC(=O)NC1=CC=CC=C1C SBB058208 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.86 CC(=O)NC1=CC=CC=C1F SBB055359 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 SBB060700 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.86 CC(=O)OC1=CC=CC=C1F SBB086981 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.86 CC(C)OC1=CC=CC=C1N SBB010329 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.86 CC1=C(NC(N)=O)C=CC=C1 SBB028293 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.86 CC1=CC=CC=C1CC(=O)O SBB063148 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.86 CC1=CC=CC=C1NC(N)=S SBB038580 [0,1,0,0,0,0|2,0,1]=4 151 B11R1.86 CC1=CC=CC=C1OC(C)C SBB079028 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 SBB109891 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB080144 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.86 CN(C)CC1=C(O)C=CC=C1 SBB111386 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 SBB096418 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.86 NC(=O)CC1=CC=CC=C1O SBB072925 [0,1,0,0,0,0|1,0,1]=3 157 B11R1.86 NC(=O)NC1=CC=CC=C1Cl SBB023415 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.86 NC(=O)NC1=CC=CC=C1F SBB057912 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 SBB062100 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 SBB003697 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.86 NC(=S)NC1=CC=CC=C1F SBB038591 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.86 NC1=CC=CC=C1OC(F)F SBB003980 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 SBB006626 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 SBB057750 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 SBB057963 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 SBB057742 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.86 O=C(O)CC1=CC=CC=C1I SBB063206 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.157 C(F)(F)OC1=CC=CC(N)=C1 SBB073340 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.157 CC(=O)CC1=CC(C)=CC=N1 SBB025632 [0,1,0,0,0,0|2,0,1]=4 170 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 SBB086850 [0,1,0,0,0,0|1,0,1]=3 171 B11R1.157 CC(=O)C[N+]1=CC(C)=CC=C1 SBB002639 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 SBB051044 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 SBB059218 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 SBB088343 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 SBB086915 [0,1,0,0,0,0|2,0,1]=4 176 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 SBB008515 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.157 CC(=O)NC1=CC(O)=CC=C1 SBB055395 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 SBB060031 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SBB086985 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.157 CC(C)OC1=CC=CC(N)=C1 SBB010221 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.157 CC1=CC(NC(N)=O)=CC=C1 SBB028291 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.157 CC1=CC(NC(N)=S)=CC=C1 SBB017678 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 SBB068547 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.157 CC1=NC(CC(C)O)=CC=C1 SBB025634 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.157 CN(C)CC1=CC(Br)=CC=C1 SBB109591 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 SBB096417 [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|2,0,1]=4 188 B11R1.157 NC(=S)NC1=CC(Cl)=CC=C1 SBB041173 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 SBB055209 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 SBB062112 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 SBB068772 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 SBB088714 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 SBB037935 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SBB063159 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SBB063367 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SBB064349 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SBB063147 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.509 CC(C)(O)CC1=CC=CC=C1 SBB071444 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 SBB059072 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 SBB008328 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB055074 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB059062 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060274 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 SBB060930 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.509 FC(F)(F)OC1=CC=CC=C1 SBB087565 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.509 O=P(O)(O)CC1=CC=CC=C1 SBB057481 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 SBB016732 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 SBB088900 [0,1,0,0,0,0|3,0,0]=4 209 B11R2.10 BrC1=NC2=CC=CC=C2N1 SBB054573 [0,0,0,1,0,0|2,0,1]=4 210 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SBB058480 [0,0,0,1,0,0|0,0,2]=3 211 B11R2.10 CC1=NC2=C(C=CC=C2)S1 SBB059092 [0,0,0,1,0,0|1,0,2]=4 212 B11R2.10 CC1=NC2=C(C=CC=C2)[Se]1 SBB059124 [0,0,0,1,0,0|1,0,2]=4 213 B11R2.10 CC1=NC2=CC=CC=C2N1 SBB046157 [0,0,0,1,0,0|1,0,1]=3 214 B11R2.10 CC1=NC2=CC=CC=C2O1 SBB108741 [0,0,0,1,0,0|1,0,2]=4 215 B11R2.10 CC1=NC2=CC=CN=C2N1 SBB111724 [0,0,0,1,0,0|2,0,1]=4 216 B11R2.10 CC1CC2=C(C=CC=C2)N1 SBB058847 [0,0,0,1,0,0|0,0,0]=1 217 B11R2.10 ClC1=NC2=CC=CC=C2N1 SBB006585 [0,0,0,1,0,0|2,0,1]=4 218 B11R2.10 NC1=NC2=C(C=CC=C2)N1 SBB028244 [0,0,0,1,0,0|2,0,1]=4 219 B11R2.10 NC1=NC2=C(C=CC=C2)S1 SBB004071 [0,0,0,1,0,0|2,0,1]=4 220 B11R2.10 NC1=NC2=CC=CC=C2O1 SBB046613 [0,0,0,1,0,0|2,0,1]=4 221 B11R2.10 NC1CC2=C(C=CC=C2)C1 SBB003858 [0,0,0,1,0,0|0,0,0]=1 222 B11R2.10 NC1CC2=CC=CC=C2C1 SBB052059 [0,0,0,1,0,0|0,0,0]=1 223 B11R2.10 O=C1CC2=CC=CC=C2N1 SBB004215 [0,0,0,1,0,0|1,0,1]=3 224 B11R2.10 O=C1NC2=C(C=CC=C2)N1 SBB000067 [0,0,0,1,0,0|2,0,1]=4 225 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SBB058504 [0,0,0,1,0,0|2,0,1]=4 226 B11R2.10 O=C1NC2=C(C=CC=C2)S1 SBB037873 [0,0,0,1,0,0|2,0,1]=4 227 B11R2.10 OC1=NC2=C(C=CC=C2)N1 SBB004209 [0,0,0,1,0,0|2,0,1]=4 228 B11R2.10 OC1CC2=C(C=CC=C2)C1 SBB061554 [0,0,0,1,0,0|1,0,0]=2 229 B11R2.10 S=C1NC2=CC=CC=C2S1 SBB037840 [0,0,0,1,0,0|2,0,1]=4 230 B11R2.10 SC1=NC2=C(C=CC=C2)N1 SBB004069 [0,0,0,1,0,0|2,0,1]=4 231 B9R1.6 C=C(C)C1=CC=CC=C1 SBB060154 [0,0,0,0,1,0|1,0,1]=3 232 B9R1.6 CC(=O)C1=CC=CC=C1 SBB040241 [0,0,0,0,1,0|1,0,1]=3 233 B9R1.6 CC(=O)C1=CC=NC=C1 SBB040256 [0,0,0,0,1,0|2,0,1]=4 234 B9R1.6 CC(=O)C1=CN=CC=C1 SBB040255 [0,0,0,0,1,0|2,0,1]=4 235 B9R1.6 CC(=O)C1=NC=CC=C1 SBB058824 [0,0,0,0,1,0|2,0,1]=4 236 B9R1.6 CC(Br)C1=CC=CC=C1 SBB040667 [0,0,0,0,1,0|1,0,0]=2 237 B9R1.6 CC(C)C1=CC=CC=C1 SBB040817 [0,0,0,0,1,0|1,0,0]=2 238 B9R1.6 CC(Cl)C1=CC=CC=C1 SBB007671 [0,0,0,0,1,0|1,0,0]=2 239 B9R1.6 CC(N)C1=CC=CC=C1 SBB040514 [0,0,0,0,1,0|0,0,0]=1 240 B9R1.6 CC(N)C1=CC=NC=C1 SBB007016 [0,0,0,0,1,0|1,0,0]=2 241 B9R1.6 CC(N)C1=CN=CC=C1 SBB027288 [0,0,0,0,1,0|1,0,0]=2 242 B9R1.6 CC(N)C1=NC=CC=C1 SBB018707 [0,0,0,0,1,0|1,0,0]=2 243 B9R1.6 CC(O)C1=CC=CC=C1 SBB058702 [0,0,0,0,1,0|1,0,0]=2 244 B9R1.6 CN(C)C1=CC=CC=C1 SBB040814 [0,0,0,0,1,0|2,0,0]=3 245 B9R1.6 CN(C)C1=CC=NC=C1 SBB008765 [0,0,0,0,1,0|3,0,0]=4 246 B9R1.6 CN(N)C1=CC=CC=C1 SBB060814 [0,0,0,0,1,0|1,0,0]=2 247 B9R1.6 C[C@@H](O)C1=CC=NC=C1 SBB065458 [0,0,0,0,1,0|2,0,0]=3 248 B9R1.6 C[C@H](N)C1=CC=CC=C1 SBB051709 [0,0,0,0,1,0|0,0,0]=1 249 B9R1.6 N=C(N)C1=CC=CC=C1 SBB055093 [0,0,0,0,1,0|1,0,1]=3 250 B9R1.6 N=C(N)C1=CC=CC=N1 SBB087246 [0,0,0,0,1,0|2,0,1]=4 251 B9R1.6 NC(=O)C1=CC=CC=C1 SBB058198 [0,0,0,0,1,0|1,0,1]=3 252 B9R1.6 NC(=O)C1=CC=CC=N1 SBB008128 [0,0,0,0,1,0|2,0,1]=4 253 B9R1.6 NC(=O)C1=CC=CN=C1 SBB004283 [0,0,0,0,1,0|2,0,1]=4 254 B9R1.6 NC(=O)C1=CC=CN=C1 SBB055585 [0,0,0,0,1,0|2,0,1]=4 255 B9R1.6 NC(=S)C1=CC=CC=C1 SBB041177 [0,0,0,0,1,0|1,0,1]=3 256 B9R1.6 NC(=S)C1=CC=CC=N1 SBB017638 [0,0,0,0,1,0|2,0,1]=4 257 B9R1.6 NC(=S)C1=CC=NC=C1 SBB028258 [0,0,0,0,1,0|2,0,1]=4 258 B9R1.6 NC(=S)C1=CN=CC=C1 SBB028259 [0,0,0,0,1,0|2,0,1]=4 259 B9R1.6 O=C(Cl)C1=CC=CC=C1 SBB059783 [0,0,0,0,1,0|2,0,1]=4 260 B9R1.6 O=C(F)C1=CC=CC=C1 SBB085547 [0,0,0,0,1,0|2,0,1]=4 261 B9R1.6 O=C(O)C1=CC=CC=C1 SBB040515 [0,0,0,0,1,0|2,0,1]=4 262 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 SBB040911 [0,0,0,0,1,0|3,0,0]=4 263 B9R1.13 CC(C)CC1=NC=CS1 SBB086212 [0,0,0,0,1,0|3,0,0]=4 264 B9R1.13 CC(C)CN1C=CC=N1 SBB024504 [0,0,0,0,1,0|3,0,0]=4 265 B9R1.13 CC(N)CC1=CC=CO1 SBB010238 [0,0,0,0,1,0|1,0,0]=2 266 B9R1.13 CC(N)CC1=CC=CS1 SBB010287 [0,0,0,0,1,0|1,0,0]=2 267 B9R1.13 CC(N)CN1C=CC=N1 SBB009552 [0,0,0,0,1,0|2,0,0]=3 268 B9R1.13 CC(N)CN1C=CN=C1 SBB013768 [0,0,0,0,1,0|2,0,0]=3 269 B9R1.13 CC(N)CN1C=NC=N1 SBB014434 [0,0,0,0,1,0|3,0,0]=4 270 B9R1.13 CC(O)CN1C=CC=N1 SBB022477 [0,0,0,0,1,0|3,0,0]=4 271 B9R1.13 CN(C)CC1=CC=CN1 SBB049515 [0,0,0,0,1,0|3,0,0]=4 272 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SBB015101 [0,0,0,0,0,1|1,0,2]=4 273 B11R1.91 CC(=O)CCC1=CC=CC=C1 SBB058827 [0,0,0,0,0,1|1,0,1]=3 274 B11R1.91 CC(=O)NNC1=CC=CC=C1 SBB058004 [0,0,0,0,0,1|2,0,1]=4 275 B11R1.91 CC(=O)OCC1=CC=CC=C1 SBB058375 [0,0,0,0,0,1|1,0,1]=3 276 B11R1.91 CC(=O)O[I+]C1=CC=CC=C1 SBB057853 [0,0,0,0,0,1|2,0,1]=4 277 B11R1.91 CC(C)=CCC1=CC=CC=C1 SBB007979 [0,0,0,0,0,1|1,0,1]=3 278 B11R1.91 CC(C)NCC1=CC=CC=C1 SBB048017 [0,0,0,0,0,1|1,0,0]=2 279 B11R1.91 CC(N)CCC1=CC=CC=C1 SBB059846 [0,0,0,0,0,1|0,0,0]=1 280 B11R1.91 CC(N)COC1=CC=CC=C1 SBB084093 [0,0,0,0,0,1|0,0,0]=1 281 B11R1.91 CC(O)C#CC1=CC=CC=C1 SBB015100 [0,0,0,0,0,1|1,0,1]=3 282 B11R1.91 CN(C)CCC1=NC=CC=C1 SBB086734 [0,0,0,0,0,1|3,0,0]=4 283 B11R1.91 CN(C)\C=N\C1=CC=CC=C1 SBB007927 [0,0,0,0,0,1|2,0,1]=4 284 B11R1.91 N=C(N)CSC1=CC=CC=C1 SBB055427 [0,0,0,0,0,1|1,0,1]=3 285 B11R1.91 NC(=O)CCC1=CC=CC=C1 SBB058119 [0,0,0,0,0,1|1,0,1]=3 286 B11R1.91 NC(=O)COC1=CC=CC=C1 SBB028296 [0,0,0,0,0,1|1,0,1]=3 287 B11R1.91 NC(=O)CSC1=CC=CC=N1 SBB113001 [0,0,0,0,0,1|2,0,1]=4 288 B11R1.91 NC(=O)NCC1=CC=CC=C1 SBB058548 [0,0,0,0,0,1|1,0,1]=3 289 B11R1.91 NC(=O)OCC1=CC=CC=C1 SBB058407 [0,0,0,0,0,1|1,0,1]=3 290 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 SBB004096 [0,0,0,0,0,1|1,0,2]=4 291 B11R1.91 NC(=S)CCC1=NC=CC=C1 SBB019122 [0,0,0,0,0,1|2,0,1]=4 292 B11R1.91 NC(=S)COC1=CC=CC=C1 SBB016514 [0,0,0,0,0,1|1,0,1]=3 293 B11R1.91 NC(=S)NCC1=CC=CC=C1 SBB088032 [0,0,0,0,0,1|1,0,1]=3 294 B11R1.91 NC(N)=NCC1=CC=CC=C1 SBB055108 [0,0,0,0,0,1|1,0,1]=3 295 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SBB058859 [0,0,0,0,0,1|2,0,1]=4 296 B11R1.91 O=C(Cl)COC1=CC=CC=C1 SBB040630 [0,0,0,0,0,1|2,0,1]=4 297 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 SBB063193 [0,0,0,0,0,1|2,0,1]=4 298 B11R1.91 O=C(O)CCC1=CC=CC=C1 SBB056662 [0,0,0,0,0,1|2,0,1]=4 299 B11R1.91 O=C(O)CNC1=CC=CC=C1 SBB028637 [0,0,0,0,0,1|2,0,1]=4 300 B11R1.91 O=C(O)COC1=CC=CC=C1 SBB040522 [0,0,0,0,0,1|2,0,1]=4 301 B11R1.91 O=C(O)CSC1=CC=CC=C1 SBB001712 [0,0,0,0,0,1|2,0,1]=4 302 B11R1.91 OB(O)CCC1=CC=CC=C1 SBB071100 [0,0,0,0,0,1|3,0,0]=4 303 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [2,0,0,0,0,0|2,0,0]=4 304 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [2,0,0,0,0,0|0,0,2]=4 306 B8R1.2 CCC1=CC=CC=C1 SBB040891 [2,0,0,0,0,0|0,0,0]=2 307 B8R1.2 CCC1=CC=CC=N1 SBB060373 [2,0,0,0,0,0|1,0,0]=3 308 B8R1.2 CCC1=CC=NC=C1 SBB061128 [2,0,0,0,0,0|1,0,0]=3 309 B8R1.2 CCC1=CN=CC=C1 SBB060374 [2,0,0,0,0,0|1,0,0]=3 310 B8R1.2 CNC1=CC=CC=C1 SBB008162 [2,0,0,0,0,0|1,0,0]=3 311 B8R1.2 CNC1=CC=CC=C1 SBB059778 [2,0,0,0,0,0|1,0,0]=3 312 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [2,0,0,0,0,0|0,0,2]=4 315 B8R1.2 NCC1=CC=CC=C1 SBB040473 [2,0,0,0,0,0|0,0,0]=2 316 B8R1.2 NCC1=CC=CN=C1 SBB004351 [2,0,0,0,0,0|1,0,0]=3 317 B8R1.2 NCC1=CC=NC=C1 SBB004350 [2,0,0,0,0,0|1,0,0]=3 318 B8R1.2 NCC1=NC=CC=C1 SBB004352 [2,0,0,0,0,0|1,0,0]=3 319 B8R1.2 NCC1=NC=CN=C1 SBB014584 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.2 NCC1=NC=NC=C1 SBB086444 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.2 NNC1=CC=CC=C1 SBB040886 [2,0,0,0,0,0|1,0,0]=3 322 B8R1.2 NNC1=CC=NC=C1 SBB018987 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.2 OCC1=CC=CC=C1 SBB058558 [2,0,0,0,0,0|1,0,0]=3 324 B8R1.2 OCC1=CC=CN=C1 SBB004344 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.2 OCC1=CC=NC=C1 SBB004347 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 OCC1=NC=CC=C1 SBB004348 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.2 ONC1=CC=CC=C1 SBB008413 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [2,0,0,0,0,0|1,0,1]=4 330 B10R1.1 CC1=CC=C(CC#N)C=C1 SBB063995 [1,1,0,0,0,0|0,0,2]=4 331 B10R1.1 CC1=CC=C(CC=O)C=C1 SBB052212 [1,1,0,0,0,0|1,0,1]=4 332 B10R1.1 CC1=CC=C(CON)C=C1 SBB021738 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.1 CCCC1=CC=C(N)C=C1 SBB008337 [1,1,0,0,0,0|0,0,0]=2 334 B10R1.1 CCCC1=CC=C(O)C=C1 SBB055506 [1,1,0,0,0,0|0,0,0]=2 335 B10R1.1 CCCC1=CN=C(Cl)N=C1 SBB054517 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.1 CCCC1=CN=C(S)N=C1 SBB066482 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [1,1,0,0,0,0|1,0,0]=3 340 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [1,1,0,0,0,0|1,0,0]=3 341 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [1,1,0,0,0,0|1,0,0]=3 342 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.1 CCOC1=NC=C(Br)C=C1 SBB054264 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.1 CCSC1=CC=C(N)C=C1 SBB071614 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.1 CNCC1=CC=C(C)C=C1 SBB079252 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.1 CNCC1=CC=C(Cl)C=C1 SBB010371 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.1 CNCC1=CC=C(F)C=C1 SBB005902 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.1 CNCC1=CC=C(O)C=C1 SBB046545 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.1 FC1=CC=C(CCCl)C=C1 SBB087329 [1,1,0,0,0,0|1,0,0]=3 351 B10R1.1 FC1=CC=C(C[Zn]Cl)C=C1 SBB094275 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.1 N#CCC1=CC=C(Br)C=C1 SBB055164 [1,1,0,0,0,0|0,0,2]=4 353 B10R1.1 N#CCC1=CC=C(Cl)C=C1 SBB004060 [1,1,0,0,0,0|0,0,2]=4 354 B10R1.1 N#CCC1=CC=C(F)C=C1 SBB063691 [1,1,0,0,0,0|0,0,2]=4 355 B10R1.1 N#CCC1=CC=C(N)C=C1 SBB004218 [1,1,0,0,0,0|0,0,2]=4 356 B10R1.1 N#CCC1=CC=C(O)C=C1 SBB063205 [1,1,0,0,0,0|0,0,2]=4 357 B10R1.1 NC1=CC=C(CCO)C=C1 SBB042772 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.1 NCCC1=CC=C(F)C=C1 SBB003787 [1,1,0,0,0,0|0,0,0]=2 359 B10R1.1 NCCC1=CC=C(F)C=C1 SBB058811 [1,1,0,0,0,0|0,0,0]=2 360 B10R1.1 NCCC1=CC=C(O)C=C1 SBB003808 [1,1,0,0,0,0|0,0,0]=2 361 B10R1.1 O=CCC1=CC=C(Br)C=C1 SBB052205 [1,1,0,0,0,0|1,0,1]=4 362 B10R1.1 O=CCC1=CC=C(F)C=C1 SBB052206 [1,1,0,0,0,0|1,0,1]=4 363 B10R1.1 OCCC1=CC=C(Br)C=C1 SBB055082 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.1 OCCC1=CC=C(F)C=C1 SBB086156 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.1 OCCC1=CC=C(O)C=C1 SBB086008 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.4 C=CCC1=CC=CC=C1O SBB044905 [1,1,0,0,0,0|0,0,2]=4 367 B10R1.4 CC1=CC=CC=C1CC#N SBB058333 [1,1,0,0,0,0|0,0,2]=4 368 B10R1.4 CCCC1=CC=CC=C1N SBB085906 [1,1,0,0,0,0|0,0,0]=2 369 B10R1.4 CCCN1C=CC=CC1=O SBB008029 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.4 CCNC1=CC=CC=C1N SBB111820 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.4 CCOC1=C(F)C=CC=C1 SBB086154 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.4 CCOC1=C(N)N=CC=C1 SBB014971 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.4 CCOC1=CC=CC=C1C SBB060978 [1,1,0,0,0,0|1,0,0]=3 374 B10R1.4 CCOC1=CC=CC=C1Cl SBB061024 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.4 CCOC1=CC=CC=C1O SBB060424 [1,1,0,0,0,0|1,0,0]=3 376 B10R1.4 CNCC1=C(Br)C=CC=C1 SBB092552 [1,1,0,0,0,0|1,0,0]=3 377 B10R1.4 CNCC1=CC=CC=C1Cl SBB010370 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.4 CNCC1=CC=CC=C1F SBB086087 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [1,1,0,0,0,0|0,0,2]=4 380 B10R1.4 FC1=C(CCBr)C=CC=C1 SBB018050 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.4 N#CCC1=CC=CC=C1Cl SBB063987 [1,1,0,0,0,0|0,0,2]=4 382 B10R1.4 N#CCC1=CC=CC=C1F SBB063693 [1,1,0,0,0,0|0,0,2]=4 383 B10R1.4 N#CCC1=CC=CC=C1N SBB064661 [1,1,0,0,0,0|0,0,2]=4 384 B10R1.4 NC1=C(OCC)C=CC=C1 SBB006726 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.4 NNCC1=CC=CC=C1Cl SBB010382 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.4 OCCC1=C(F)C=CC=C1 SBB086155 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.10 CC1=CC=CC(CC#N)=C1 SBB068545 [1,1,0,0,0,0|0,0,2]=4 388 B10R1.10 CCOC1=CC(N)=CC=C1 SBB059860 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.10 CCOC1=CC=CC(C)=C1 SBB060989 [1,1,0,0,0,0|1,0,0]=3 390 B10R1.10 CCOC1=CC=CC(O)=C1 SBB005788 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.10 CNCC1=CC(O)=CC=C1 SBB046532 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.10 CNCC1=NC(C)=CC=C1 SBB110044 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.10 FC1=CC=CC(C[Zn]Cl)=C1 SBB094274 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.10 N#CCC1=CC(Br)=CC=C1 SBB006625 [1,1,0,0,0,0|0,0,2]=4 395 B10R1.10 N#CCC1=CC(Cl)=CC=C1 SBB057203 [1,1,0,0,0,0|0,0,2]=4 396 B10R1.10 N#CCC1=CC=CC(F)=C1 SBB063692 [1,1,0,0,0,0|0,0,2]=4 397 B10R1.10 NNCC1=CC(O)=CC=C1 SBB003436 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.10 OCCC1=CC(F)=CC=C1 SBB055447 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.15 BrCC(Br)C1=CC=CC=C1 SBB058656 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.15 C#CC(O)C1=CC=CC=C1 SBB008986 [1,1,0,0,0,0|0,0,2]=4 401 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [1,1,0,0,0,0|0,0,0]=2 403 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.15 CCC(=O)C1=CC=CC=C1 SBB058853 [1,1,0,0,0,0|0,0,1]=3 405 B10R1.15 CCC(=O)C1=CC=NC=C1 SBB068976 [1,1,0,0,0,0|1,0,1]=4 406 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [1,1,0,0,0,0|0,0,0]=2 407 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [1,1,0,0,0,0|0,0,0]=2 408 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [1,1,0,0,0,0|0,0,0]=2 411 B10R1.15 CNC(=O)C1=CC=CC=C1 SBB051421 [1,1,0,0,0,0|1,0,1]=4 412 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [1,1,0,0,0,0|1,0,1]=4 414 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [1,1,0,0,0,0|0,0,0]=2 415 B10R1.15 C\C(=N/N)C1=CC=CC=C1 SBB069878 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.15 ClCC(Cl)C1=CC=CC=C1 SBB007931 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.15 N#CC(Br)C1=CC=CC=C1 SBB061313 [1,1,0,0,0,0|0,0,2]=4 418 B10R1.15 N#CC(N)C1=CC=CC=C1 SBB003872 [1,1,0,0,0,0|0,0,2]=4 419 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB063139 [1,1,0,0,0,0|0,0,1]=3 420 B10R1.15 NCC(=O)C1=CC=CC=C1 SBB066026 [1,1,0,0,0,0|0,0,1]=3 421 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [1,1,0,0,0,0|0,0,0]=2 422 B10R1.15 NNC(=O)C1=CC=CC=C1 SBB040976 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SBB006667 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.15 O=C(CO)C1=CC=CC=C1 SBB085926 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.15 [NH3+]CC(=O)C1=CC=CC=C1 SBB061439 [1,1,0,0,0,0|0,0,2]=4 428 B10R1.17 BrCCCC1=CN=CC=C1 SBB014930 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.17 BrCCOC1=CC=CC=C1 SBB042586 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.17 BrCCSC1=CC=CC=C1 SBB059699 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.17 C#CCNC1=CC=CC=C1 SBB010262 [1,1,0,0,0,0|0,0,2]=4 432 B10R1.17 C#CCOC1=CC=CC=C1 SBB008983 [1,1,0,0,0,0|0,0,2]=4 433 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [1,1,0,0,0,0|0,0,1]=3 434 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [1,1,0,0,0,0|0,0,1]=3 435 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [1,1,0,0,0,0|0,0,0]=2 436 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [1,1,0,0,0,0|0,0,0]=2 437 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [1,1,0,0,0,0|0,0,0]=2 438 B10R1.17 CCNCC1=CC=NC=C1 SBB058813 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [1,1,0,0,0,0|0,0,0]=2 440 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [1,1,0,0,0,0|0,0,0]=2 441 B10R1.17 CNCCC1=NC=CC=C1 SBB017551 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.17 CNCCC1=NC=CC=C1 SBB040053 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [1,1,0,0,0,0|0,0,0]=2 444 B10R1.17 ClCOCC1=CC=CC=C1 SBB064207 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.17 ClCSCC1=CC=CC=C1 SBB055458 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.17 ClC\C=C\C1=CC=CC=C1 SBB040602 [1,1,0,0,0,0|0,0,2]=4 447 B10R1.17 N#CCCC1=NC=CC=C1 SBB018592 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.17 N#CCOC1=CC=CC=C1 SBB016774 [1,1,0,0,0,0|0,0,2]=4 449 B10R1.17 N#CSCC1=CC=CC=C1 SBB056767 [1,1,0,0,0,0|0,0,2]=4 450 B10R1.17 N(CC=C)C1=CC=CC=C1 SBB004211 [1,1,0,0,0,0|0,0,2]=4 451 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [1,1,0,0,0,0|0,0,0]=2 452 B10R1.17 NCCCC1=CC=CC=N1 SBB012768 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.17 NCCNC1=CC=CC=C1 SBB004200 [1,1,0,0,0,0|0,0,0]=2 454 B10R1.17 NCCOC1=CC=CC=C1 SBB085982 [1,1,0,0,0,0|0,0,0]=2 455 B10R1.17 NCCSC1=CC=CC=C1 SBB047720 [1,1,0,0,0,0|0,0,0]=2 456 B10R1.17 NCCSC1=NC=CC=C1 SBB050976 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.17 O=C=NCC1=CC=CC=C1 SBB048859 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.17 O=COCC1=CC=CC=C1 SBB061238 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.17 OCC#CC1=CC=CC=C1 SBB015103 [1,1,0,0,0,0|0,0,2]=4 460 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [1,1,0,0,0,0|0,0,0]=2 461 B10R1.17 OCCCC1=CC=NC=C1 SBB072686 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.17 OCCOC1=CC=CC=C1 SBB060485 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.17 OC\C=C\C1=CC=CC=C1 SBB058645 [1,1,0,0,0,0|0,0,2]=4 464 B10R1.17 S=C=NCC1=CC=CC=C1 SBB002731 [1,1,0,0,0,0|1,0,1]=4 465 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 SBB008183 [1,1,0,0,0,0|1,0,1]=4 466 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SBB040244 [0,1,0,0,1,0|1,0,1]=4 467 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SBB058845 [0,1,0,0,1,0|1,0,1]=4 468 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 SBB040243 [0,1,0,0,1,0|1,0,1]=4 469 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SBB040257 [0,1,0,0,1,0|1,0,1]=4 470 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SBB058956 [0,1,0,0,1,0|1,0,1]=4 471 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SBB040278 [0,1,0,0,1,0|1,0,1]=4 472 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SBB040251 [0,1,0,0,1,0|1,0,1]=4 473 B10R1.13 CC(C)C1=CC=C(N)C=C1 SBB040447 [0,1,0,0,1,0|1,0,0]=3 474 B10R1.13 CC(N)C1=CC=C(F)C=C1 SBB046789 [0,1,0,0,1,0|0,0,0]=2 475 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB008453 [0,1,0,0,1,0|0,0,0]=2 476 B10R1.13 CC(N)C1=CC=C(O)C=C1 SBB080372 [0,1,0,0,1,0|0,0,0]=2 477 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SBB063808 [0,1,0,0,1,0|1,0,0]=3 478 B10R1.13 CC(O)C1=CC=C(N)C=C1 SBB048111 [0,1,0,0,1,0|1,0,0]=3 479 B10R1.13 CC1=CC=C(C(=N)N)C=C1 SBB088463 [0,1,0,0,1,0|1,0,1]=4 480 B10R1.13 CC1=CC=C(C(C)C)C=C1 SBB060399 [0,1,0,0,1,0|1,0,0]=3 481 B10R1.13 CC1=CC=C(C(C)N)C=C1 SBB010017 [0,1,0,0,1,0|0,0,0]=2 482 B10R1.13 CC1=CC=C(C(C)O)C=C1 SBB061733 [0,1,0,0,1,0|1,0,0]=3 483 B10R1.13 CC1=CC=C(C(N)=O)C=C1 SBB007862 [0,1,0,0,1,0|1,0,1]=4 484 B10R1.13 CC1=CC=C(C(N)=S)C=C1 SBB016502 [0,1,0,0,1,0|1,0,1]=4 485 B10R1.13 CN(C)C1=CC=C(Br)C=C1 SBB058575 [0,1,0,0,1,0|2,0,0]=4 486 B10R1.13 CN(C)C1=CC=C(N)C=C1 SBB058715 [0,1,0,0,1,0|2,0,0]=4 487 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SBB064275 [0,1,0,0,1,0|1,0,0]=3 488 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SBB064274 [0,1,0,0,1,0|1,0,0]=3 489 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 SBB089501 [0,1,0,0,1,0|2,0,0]=4 490 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SBB091235 [0,1,0,0,1,0|1,0,1]=4 491 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB073154 [0,1,0,0,1,0|1,0,1]=4 492 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SBB088979 [0,1,0,0,1,0|1,0,1]=4 493 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB003838 [0,1,0,0,1,0|1,0,1]=4 494 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SBB063615 [0,1,0,0,1,0|1,0,1]=4 495 B10R1.13 N=C(\C1=CC=C(N)C=C1)N SBB005770 [0,1,0,0,1,0|1,0,1]=4 496 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SBB086057 [0,1,0,0,1,0|1,0,1]=4 497 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SBB028159 [0,1,0,0,1,0|1,0,1]=4 498 B10R1.13 NC(=O)C1=CC=C(O)C=C1 SBB058350 [0,1,0,0,1,0|1,0,1]=4 499 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 SBB095205 [0,1,0,0,1,0|1,0,1]=4 500 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 SBB016508 [0,1,0,0,1,0|1,0,1]=4 501 B10R1.13 NC(=S)C1=CC=C(F)C=C1 SBB016503 [0,1,0,0,1,0|1,0,1]=4 502 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SBB066605 [0,1,0,0,1,0|1,0,1]=4 503 B10R1.13 NC(C)C1=CC=C(Br)C=C1 SBB006746 [0,1,0,0,1,0|0,0,0]=2 504 B10R1.13 NC(C)C1=CC=C(Cl)C=C1 SBB004019 [0,1,0,0,1,0|0,0,0]=2 505 B10R1.13 [NH3+]C1=CC=C(N(C)C)C=C1 SBB059799 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.28 CC(C)(C)C1=CC=CC=C1 SBB040882 [0,1,0,0,1,0|1,0,0]=3 507 B10R1.28 CC(C)(C)C1=CC=CC=N1 SBB085909 [0,1,0,0,1,0|2,0,0]=4 508 B10R1.28 CC(C)(N)C1=CC=CC=C1 SBB028249 [0,1,0,0,1,0|0,0,0]=2 509 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 SBB037857 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 SBB058202 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [0,1,0,0,1,0|1,0,1]=4 512 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [0,1,0,0,1,0|1,0,1]=4 513 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [0,1,0,0,1,0|1,0,1]=4 514 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [0,1,0,0,1,0|1,0,1]=4 515 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [0,1,0,0,1,0|1,0,1]=4 516 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [0,1,0,0,1,0|1,0,1]=4 517 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [0,1,0,0,1,0|1,0,1]=4 518 B10R1.61 CC(C)C1=C(Br)C=CC=C1 SBB092412 [0,1,0,0,1,0|1,0,0]=3 519 B10R1.61 CC(C)C1=C(N)C=CC=C1 SBB040455 [0,1,0,0,1,0|1,0,0]=3 520 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 SBB046790 [0,1,0,0,1,0|0,0,0]=2 521 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [0,1,0,0,1,0|1,0,0]=3 522 B10R1.61 CC1=C(C(N)=O)C=CC=C1 SBB007860 [0,1,0,0,1,0|1,0,1]=4 523 B10R1.61 CC1=CC=CC=C1C(N)=S SBB036004 [0,1,0,0,1,0|1,0,1]=4 524 B10R1.61 CS(=O)C1=C(F)C=CC=C1 SBB087301 [0,1,0,0,1,0|2,0,0]=4 525 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [0,1,0,0,1,0|1,0,0]=3 526 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [0,1,0,0,1,0|1,0,0]=3 527 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [0,1,0,0,1,0|1,0,0]=3 528 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 SBB092542 [0,1,0,0,1,0|1,0,1]=4 529 B10R1.61 NC(=O)C1=C(F)C=CC=C1 SBB058361 [0,1,0,0,1,0|1,0,1]=4 530 B10R1.61 NC(=O)C1=C(N)C=CC=C1 SBB007561 [0,1,0,0,1,0|1,0,1]=4 531 B10R1.61 NC(=O)C1=C(O)C=CC=C1 SBB058584 [0,1,0,0,1,0|1,0,1]=4 532 B10R1.61 NC(=O)C1=CC=CC=C1Cl SBB004023 [0,1,0,0,1,0|1,0,1]=4 533 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 SBB095207 [0,1,0,0,1,0|1,0,1]=4 534 B10R1.61 NC(=S)C1=C(F)C=CC=C1 SBB016504 [0,1,0,0,1,0|1,0,1]=4 535 B10R1.61 NC(=S)C1=CC=CC=C1N SBB045972 [0,1,0,0,1,0|1,0,1]=4 536 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 SBB040258 [0,1,0,0,1,0|1,0,1]=4 537 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 SBB055121 [0,1,0,0,1,0|1,0,1]=4 538 B10R1.113 CC(=O)C1=CC=CC(C)=C1 SBB061772 [0,1,0,0,1,0|1,0,1]=4 539 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SBB063564 [0,1,0,0,1,0|1,0,1]=4 540 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SBB058713 [0,1,0,0,1,0|1,0,1]=4 541 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SBB040280 [0,1,0,0,1,0|1,0,1]=4 542 B10R1.113 CC(N)C1=CC(Br)=CC=C1 SBB047651 [0,1,0,0,1,0|0,0,0]=2 543 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 SBB046822 [0,1,0,0,1,0|0,0,0]=2 544 B10R1.113 CC(N)C1=CC=CC(O)=C1 SBB080427 [0,1,0,0,1,0|0,0,0]=2 545 B10R1.113 CC(O)C1=CC(N)=CC=C1 SBB008559 [0,1,0,0,1,0|1,0,0]=3 546 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SBB068833 [0,1,0,0,1,0|1,0,0]=3 547 B10R1.113 CC(O)C1=CC=C[N+]([O-])=C1 SBB086069 [0,1,0,0,1,0|2,0,0]=4 548 B10R1.113 CC1=CC(C(Br)Br)=CC=C1 SBB061660 [0,1,0,0,1,0|2,0,0]=4 549 B10R1.113 CC1=CC(C(N)=O)=CC=C1 SBB007861 [0,1,0,0,1,0|1,0,1]=4 550 B10R1.113 CC1=CC(N(C)C)=CC=C1 SBB008276 [0,1,0,0,1,0|2,0,0]=4 551 B10R1.113 CC1=CC=CC(C(C)C)=C1 SBB061535 [0,1,0,0,1,0|1,0,0]=3 552 B10R1.113 CC1=CC=CC(C(C)N)=C1 SBB046820 [0,1,0,0,1,0|0,0,0]=2 553 B10R1.113 CC1=CC=CC(C(N)=S)=C1 SBB086796 [0,1,0,0,1,0|1,0,1]=4 554 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 SBB008273 [0,1,0,0,1,0|2,0,0]=4 555 B10R1.113 CN(C)C1=CC=CC(F)=C1 SBB086090 [0,1,0,0,1,0|2,0,0]=4 556 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SBB064272 [0,1,0,0,1,0|1,0,0]=3 557 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 SBB086151 [0,1,0,0,1,0|1,0,0]=3 558 B10R1.113 N=C(N)C1=CC(N)=CC=C1 SBB003839 [0,1,0,0,1,0|1,0,1]=4 559 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 SBB301617 [0,1,0,0,1,0|1,0,1]=4 560 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 SBB009893 [0,1,0,0,1,0|1,0,1]=4 561 B10R1.113 NC(=O)C1=CC=CC(F)=C1 SBB086055 [0,1,0,0,1,0|1,0,1]=4 562 B10R1.113 NC(=O)C1=CC=CC(N)=C1 SBB028153 [0,1,0,0,1,0|1,0,1]=4 563 B10R1.113 NC(=O)C1=CC=CC(O)=C1 SBB079277 [0,1,0,0,1,0|1,0,1]=4 564 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 SBB095206 [0,1,0,0,1,0|1,0,1]=4 565 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 SBB017686 [0,1,0,0,1,0|1,0,1]=4 566 B10R1.23 CC(C)C(N)C1=CC=CS1 SBB010369 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.27 CC(CN)CN1C=CC=N1 SBB022892 [0,1,0,0,1,0|2,0,0]=4 568 B10R1.27 CCC(N)CN1C=CN=C1 SBB013254 [0,1,0,0,1,0|2,0,0]=4 569 B10R1.27 OC[C@H](CC1=CNC=N1)N SBB005769 [0,1,0,0,1,0|2,0,0]=4 570 B10R1.54 CC(N)CC1=CN(C)N=C1 SBB116397 [0,1,0,0,1,0|2,0,0]=4 571 B10R1.54 CC1=CC(CC(C)N)=NN1 SBB013355 [0,1,0,0,1,0|2,0,0]=4 572 B10R1.54 CC1=CN(CC(C)N)N=C1 SBB022351 [0,1,0,0,1,0|2,0,0]=4 573 B10R1.54 CC1=NN(CC(C)N)C=C1 SBB009551 [0,1,0,0,1,0|2,0,0]=4 574 B10R1.64 CC(N)CC1=CC=NN1C SBB116396 [0,1,0,0,1,0|2,0,0]=4 575 B12R1.21 C=C(C)COC1=CC=C(N)C=C1 SBB080146 [0,1,0,0,0,1|1,0,1]=4 576 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SBB056768 [0,1,0,0,0,1|1,0,1]=4 577 B12R1.21 CC(=O)COC1=CC=C(Cl)C=C1 SBB072870 [0,1,0,0,0,1|1,0,1]=4 578 B12R1.21 CC(=O)CSC1=CC=C(C)C=C1 SBB089710 [0,1,0,0,0,1|1,0,1]=4 579 B12R1.21 CC(=O)CSC1=CC=C(Cl)C=C1 SBB057983 [0,1,0,0,0,1|1,0,1]=4 580 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 SBB090182 [0,1,0,0,0,1|1,0,1]=4 581 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 SBB055227 [0,1,0,0,0,1|1,0,1]=4 582 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 SBB116862 [0,1,0,0,0,1|1,0,1]=4 583 B12R1.21 CC(C)COC1=CC=C(N)C=C1 SBB079898 [0,1,0,0,0,1|1,0,0]=3 584 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 SBB109028 [0,1,0,0,0,1|1,0,0]=3 585 B12R1.21 CC(N)CCC1=CC=C(Cl)C=C1 SBB010707 [0,1,0,0,0,1|0,0,0]=2 586 B12R1.21 CC(N)CCC1=CC=C(F)C=C1 SBB010486 [0,1,0,0,0,1|0,0,0]=2 587 B12R1.21 CC(N)COC1=CC=C(Cl)C=C1 SBB010732 [0,1,0,0,0,1|0,0,0]=2 588 B12R1.21 CC1=CC=C(CNC(N)=S)C=C1 SBB017712 [0,1,0,0,0,1|1,0,1]=4 589 B12R1.21 CC1=CC=C(NCC(F)F)C=C1 SBB046684 [0,1,0,0,0,1|2,0,0]=4 590 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 SBB055295 [0,1,0,0,0,1|1,0,1]=4 591 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 SBB088264 [0,1,0,0,0,1|1,0,1]=4 592 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 SBB006760 [0,1,0,0,0,1|1,0,1]=4 593 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 SBB088171 [0,1,0,0,0,1|1,0,1]=4 594 B12R1.21 NC(=S)COC1=CC=C(Cl)C=C1 SBB092833 [0,1,0,0,0,1|1,0,1]=4 595 B12R1.21 NC(=[S+]CC1=CC=C(Cl)C=C1)N SBB003234 [0,1,0,0,0,1|1,0,1]=4 596 B12R1.21 NC1=CC=C(OCC(F)F)C=C1 SBB024495 [0,1,0,0,0,1|2,0,0]=4 597 B12R1.27 CC(CO)NCC1=CC=CC=C1 SBB010465 [0,1,0,0,0,1|1,0,0]=3 598 B12R1.27 CCC(=O)OCC1=CC=CC=C1 SBB061239 [0,1,0,0,0,1|1,0,1]=4 599 B12R1.27 CCC(O)C#CC1=CC=CC=C1 SBB008984 [0,1,0,0,0,1|1,0,1]=4 600 B12R1.27 CNC(=S)NCC1=CC=CC=C1 SBB017711 [0,1,0,0,0,1|1,0,1]=4 601 B12R1.27 COC(=O)CSC1=CC=CC=C1 SBB089934 [0,1,0,0,0,1|1,0,1]=4 602 B12R1.27 COC(=O)NCC1=CC=CC=C1 SBB080563 [0,1,0,0,0,1|1,0,1]=4 603 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SBB063677 [0,1,0,0,0,1|1,0,1]=4 604 B12R1.27 NNC(=O)CCC1=CC=CC=C1 SBB000151 [0,1,0,0,0,1|1,0,1]=4 605 B12R1.27 NNC(=O)CNC1=CC=CC=C1 SBB019864 [0,1,0,0,0,1|1,0,1]=4 606 B12R1.27 NNC(=O)COC1=CC=CC=C1 SBB017408 [0,1,0,0,0,1|1,0,1]=4 607 B12R1.27 NNC(=O)CSC1=CC=CC=C1 SBB072377 [0,1,0,0,0,1|1,0,1]=4 608 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SBB063031 [0,1,0,0,0,1|1,0,1]=4 609 B12R1.27 NNC(=S)NCC1=CC=CC=C1 SBB038438 [0,1,0,0,0,1|1,0,1]=4 610 B12R1.27 O=C(CBr)NCC1=CC=CC=C1 SBB080035 [0,1,0,0,0,1|1,0,1]=4 611 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SBB006752 [0,1,0,0,0,1|1,0,1]=4 612 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 SBB038576 [0,1,0,0,0,1|1,0,1]=4 613 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 SBB064876 [0,1,0,0,0,1|1,0,1]=4 614 B12R1.27 O=C(CS)OCC1=CC=CC=C1 SBB057444 [0,1,0,0,0,1|1,0,1]=4 615 B12R1.27 OC(CCl)COC1=CC=CC=C1 SBB061224 [0,1,0,0,0,1|1,0,0]=3 616 B12R1.27 OC(COC1=CC=CC=C1)CN SBB010049 [0,1,0,0,0,1|1,0,0]=3 617 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 SBB088177 [0,1,0,0,0,1|1,0,0]=3 618 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 SBB014560 [0,1,0,0,0,1|1,0,1]=4 619 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SBB027287 [0,1,0,0,0,1|1,0,1]=4 620 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SBB040798 [0,1,0,0,0,1|1,0,1]=4 621 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SBB058063 [0,1,0,0,0,1|1,0,1]=4 622 B12R1.107 CC(C)NC(=O)C1=CC=CC=C1 SBB058207 [0,1,0,0,0,1|1,0,1]=4 623 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 SBB051565 [0,1,0,0,0,1|1,0,1]=4 624 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 SBB063237 [0,1,0,0,0,1|2,0,0]=4 625 B12R1.107 N(C(C)C)[C@H](C)C1=CC=CC=C1 SBB059587 [0,1,0,0,0,1|1,0,0]=3 626 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 SBB035909 [0,1,0,0,0,1|1,0,1]=4 627 B12R1.125 C=C(C)COC1=CC=CC=C1N SBB080151 [0,1,0,0,0,1|1,0,1]=4 628 B12R1.125 CC(=O)NCC1=C(Br)C=CC=C1 SBB079113 [0,1,0,0,0,1|1,0,1]=4 629 B12R1.125 CC(C)COC1=C(N)C=CC=C1 SBB080113 [0,1,0,0,0,1|1,0,0]=3 630 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 SBB109026 [0,1,0,0,0,1|1,0,0]=3 631 B12R1.125 N=C(N)COC1=CC=CC=C1Cl SBB055296 [0,1,0,0,0,1|1,0,1]=4 632 B12R1.125 NC(=O)COC1=CC=CC=C1Cl SBB116750 [0,1,0,0,0,1|1,0,1]=4 633 B12R1.125 NC(=S)COC1=CC=CC=C1Cl SBB092832 [0,1,0,0,0,1|1,0,1]=4 634 B12R1.125 NC1=CC=CC=C1OCC(F)F SBB024497 [0,1,0,0,0,1|2,0,0]=4 635 B12R1.125 NC1=CC=CC=C1SCC(F)F SBB025035 [0,1,0,0,0,1|2,0,0]=4 636 B12R1.226 C=C(C)COC1=CC(N)=CC=C1 SBB080148 [0,1,0,0,0,1|1,0,1]=4 637 B12R1.226 CC(=O)CCC1=CC(Br)=CC=C1 SBB055142 [0,1,0,0,0,1|1,0,1]=4 638 B12R1.226 CC(C)COC1=CC(N)=CC=C1 SBB027489 [0,1,0,0,0,1|1,0,0]=3 639 B12R1.226 CC(C)NCC1=CC(F)=CC=C1 SBB109027 [0,1,0,0,0,1|1,0,0]=3 640 B12R1.226 NC(=O)COC1=CC=CC(Cl)=C1 SBB090331 [0,1,0,0,0,1|1,0,1]=4 641 B12R1.226 NC(=S)COC1=CC(Cl)=CC=C1 SBB092831 [0,1,0,0,0,1|1,0,1]=4 642 B12R1.226 NC1=CC=CC(OCC(F)F)=C1 SBB036329 [0,1,0,0,0,1|2,0,0]=4 643 B12R1.891 CC(C)(C)NCC1=CC=CC=C1 SBB072754 [0,1,0,0,0,1|1,0,0]=3 644 B12R1.891 CC(C)(C)\N=C\C1=CC=CC=C1 SBB008132 [0,1,0,0,0,1|1,0,1]=4 645 B12R1.891 CC(C)(O)C#CC1=CC=CC=C1 SBB008964 [0,1,0,0,0,1|1,0,1]=4 646 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 SBB026050 [0,1,0,0,0,1|2,0,0]=4 647 B12R1.4 C=CC1=CC=C(CN(C)C)C=C1 SBB116892 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.4 CC(C)OC1=CC=C(C=O)C=C1 SBB019521 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 SBB010165 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 SBB080381 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.4 CN(C)CC1=CC=C(C=O)C=C1 SBB108985 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 SBB058529 [0,2,0,0,0,0|1,0,1]=4 653 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 SBB057982 [0,2,0,0,0,0|1,0,1]=4 654 B12R1.4 COC1=CC=C(CC(N)=S)C=C1 SBB089824 [0,2,0,0,0,0|1,0,1]=4 655 B12R1.19 CC(=O)CC1=CC=C(Cl)C(Cl)=C1 SBB005841 [0,2,0,0,0,0|1,0,1]=4 656 B12R1.19 CC(C)OC1=CC(F)=C(F)C=C1 SBB088621 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.20 CC(C)C(=O)C1=CC=C(F)C=C1 SBB088008 [0,2,0,0,0,0|1,0,1]=4 658 B12R1.20 CC(C)C(N)C1=CC=C(F)C=C1 SBB085363 [0,2,0,0,0,0|1,0,0]=3 659 B12R1.20 CC(Cl)C(=O)C1=CC=C(F)C=C1 SBB064057 [0,2,0,0,0,0|1,0,1]=4 660 B12R1.20 [NH3+]C(C)C(O)C1=CC=C(O)C=C1 SBB056907 [0,2,0,0,0,0|0,0,1]=3 661 B12R1.49 CC1=CC=C(OC(C)CN)C=C1 SBB027665 [0,2,0,0,0,0|1,0,0]=3 662 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 SBB080431 [0,2,0,0,0,0|1,0,1]=4 663 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SBB017032 [0,2,0,0,0,0|1,0,1]=4 664 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SBB059052 [0,2,0,0,0,0|1,0,1]=4 665 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 SBB021009 [0,2,0,0,0,0|1,0,1]=4 666 B12R1.49 N\C(CC1=CC=C(Cl)C=C1)=N/O SBB081889 [0,2,0,0,0,0|1,0,1]=4 667 B12R1.106 CC(C)(C)OC1=CC=C(Br)C=C1 SBB097405 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.106 CC(C)(C)OC1=CC=C(O)C=C1 SBB116866 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 SBB052383 [0,2,0,0,0,0|0,0,0]=2 670 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 SBB093201 [0,2,0,0,0,0|0,0,0]=2 671 B12R1.106 CC(C)(N)CC1=CC=C(O)C=C1 SBB072113 [0,2,0,0,0,0|0,0,0]=2 672 B12R1.233 CC(C)OC1=C(Cl)C=C(F)C=C1 SBB090862 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.233 CC(C)OC1=C(Cl)C=C(N)C=C1 SBB085428 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.233 CC(C)OC1=C(F)C=C(F)C=C1 SBB088618 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.233 NC(=O)CC1=C(Cl)C=C(F)C=C1 SBB090653 [0,2,0,0,0,0|1,0,1]=4 676 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 SBB053707 [0,2,0,0,0,0|1,0,1]=4 677 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 SBB007734 [0,2,0,0,0,0|1,0,1]=4 678 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SBB017485 [0,2,0,0,0,0|1,0,1]=4 679 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 SBB051444 [0,2,0,0,0,0|1,0,1]=4 680 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 SBB007729 [0,2,0,0,0,0|1,0,1]=4 681 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 SBB063242 [0,2,0,0,0,0|0,0,0]=2 682 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 SBB057682 [0,2,0,0,0,0|1,0,1]=4 683 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 SBB088489 [0,2,0,0,0,0|1,0,1]=4 684 B12R1.478 CC(=O)C(C#N)C1=CC=CC=C1 SBB001837 [0,2,0,0,0,0|1,0,1]=4 685 B12R1.478 CC(C)C(C#N)C1=CC=CC=C1 SBB008509 [0,2,0,0,0,0|1,0,0]=3 686 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 SBB007705 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.478 CN(C)C(CN)C1=CC=CC=C1 SBB028352 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.564 CC(C)(C)C(O)C1=CC=CC=C1 SBB087836 [0,2,0,0,0,0|1,0,0]=3 689 B12R1.564 OC(C1=CC=CC=C1)C(Cl)(Cl)Cl SBB008085 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.564 OC(C1=CC=CC=C1)C(F)(F)F SBB072680 [0,2,0,0,0,0|2,0,0]=4 691 B12R1.32 C#CCN(C)CC1=CC=CC=C1 SBB037855 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.50 CNC(C)CC1=CC(C)=CC=N1 SBB025633 [0,2,0,0,0,0|1,0,0]=3 693 B12R1.50 NNC(=O)CC1=CC(Cl)=CC=C1 SBB055220 [0,2,0,0,0,0|1,0,1]=4 694 B12R1.50 N\C(CC1=CC(Cl)=CC=C1)=N/O SBB024503 [0,2,0,0,0,0|1,0,1]=4 695 B12R1.194 C#CC(C)(O)CC1=CC=CC=C1 SBB002525 [0,2,0,0,0,0|1,0,0]=3 696 B12R1.194 CC(C)(C#N)NC1=CC=CC=C1 SBB017951 [0,2,0,0,0,0|1,0,1]=4 697 B12R1.194 CC(C)(C=O)SC1=CC=CC=C1 SBB052358 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.194 CNC(C)(C)CC1=CC=CC=C1 SBB015072 [0,2,0,0,0,0|0,0,0]=2 699 B12R1.194 NNS(=O)(=O)CC1=CC=CC=C1 SBB072378 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.371 CC(CN)OC1=CC=CC=C1Cl SBB027666 [0,2,0,0,0,0|1,0,0]=3 701 B12R1.75 CC(C)OC1=C(C=O)C=CC=C1 SBB017957 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.75 CN(C)CC1=C(CN)C=CC=C1 SBB108986 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.75 COC1=CC=CC=C1CC(N)=S SBB089825 [0,2,0,0,0,0|1,0,1]=4 704 B12R1.127 CN(C)CC1=C(O)C=CC(F)=C1 SBB088301 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.1009 N=C(N)CC1=C(Cl)C=CC=C1Cl SBB099135 [0,2,0,0,0,0|1,0,1]=4 706 B12R1.1009 NC(=O)CC1=C(Cl)C=CC=C1Cl SBB057916 [0,2,0,0,0,0|1,0,1]=4 707 B12R1.1009 NC(=S)CC1=C(Cl)C=CC=C1Cl SBB095889 [0,2,0,0,0,0|1,0,1]=4 708 B12R1.119 NC1=CC=CC(CS(N)(=O)=O)=C1 SBB072116 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.438 CC(C)OC1=CC(CN)=CC=C1 SBB010164 [0,2,0,0,0,0|2,0,0]=4 710 B12R1.438 CC(C)OC1=CC=CC(C=O)=C1 SBB009948 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 SBB055060 [0,2,0,0,0,0|1,0,1]=4 712 B10R1.66 CC(N)CCC1=CC=CO1 SBB007120 [0,0,1,1,0,0|1,0,1]=4 713 B10R2.7 C1=CC2=C(C=C1)CCC2 SBB060083 [1,0,0,1,0,0|0,0,0]=2 714 B10R2.7 C1=CC2=C(C=C1)NN=N2 SBB060070 [1,0,0,1,0,0|2,0,0]=4 715 B10R2.7 C1=CC2=C(C=C1)OCO2 SBB059641 [1,0,0,1,0,0|2,0,0]=4 716 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [1,0,0,1,0,0|0,0,2]=4 717 B10R2.7 C1=CC=C2COCC2=C1 SBB068697 [1,0,0,1,0,0|1,0,0]=3 718 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [1,0,0,1,0,0|0,0,2]=4 719 B10R2.7 C1=CC=C2NN=CC2=C1 SBB040063 [1,0,0,1,0,0|1,0,1]=4 720 B10R2.7 C1=CC=C2OCCC2=C1 SBB056038 [1,0,0,1,0,0|1,0,0]=3 721 B10R2.7 C1=CC=C2SCNC2=C1 SBB017116 [1,0,0,1,0,0|1,0,0]=3 722 B10R2.7 N1C=NC2=C1C=CC=C2 SBB004294 [1,0,0,1,0,0|1,0,1]=4 723 B10R2.7 N1CCC2=C1C=CC=C2 SBB004291 [1,0,0,1,0,0|0,0,0]=2 724 B12R2.24 CC1CCC2=CC=CC=C2N1 SBB039108 [0,0,0,1,0,1|0,0,0]=2 725 B12R2.24 CC1CNC2=C(C=CC=C2)S1 SBB048277 [0,0,0,1,0,1|1,0,0]=3 726 B12R2.24 CC1CNC2=CC=CC=C2O1 SBB080829 [0,0,0,1,0,1|1,0,0]=3 727 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SBB072624 [0,0,0,1,0,1|0,0,0]=2 728 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SBB068599 [0,0,0,1,0,1|1,0,1]=4 729 B12R2.24 O=C1CCC2=CC=CC=C2N1 SBB056014 [0,0,0,1,0,1|1,0,1]=4 730 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SBB017923 [0,0,0,1,0,1|1,0,1]=4 731 B12R2.24 O=C1COC2=CC=CC=C2N1 SBB016409 [0,0,0,1,0,1|1,0,1]=4 732 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 SBB061807 [0,0,0,1,0,1|1,0,1]=4 733 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SBB008511 [0,0,0,1,0,1|1,0,0]=3 734 B12R2.2057 C1=CC(CNC2CC2)=CC=N1 SBB085367 [0,0,0,1,0,1|2,0,0]=4 735 B12R2.2057 C1=CC(CNC2CC2)=CN=C1 SBB085360 [0,0,0,1,0,1|2,0,0]=4 736 B12R2.2057 C1=CC=C(OCC2CO2)C=C1 SBB060525 [0,0,0,1,0,1|1,0,0]=3 737 B12R2.2057 C1=CN=C(CNC2CC2)C=C1 SBB046556 [0,0,0,1,0,1|2,0,0]=4 738 B12R2.606 CC1=CC2=C(C=C1)NC(C)=N2 SBB045895 [0,1,0,1,0,0|1,0,1]=4 739 B12R2.606 CC1=CC2=C(C=CC(N)=C2)N1 SBB028277 [0,1,0,1,0,0|0,0,2]=4 740 B12R2.606 CC1=NC2=C(C=CC(N)=C2)N1 SBB000098 [0,1,0,1,0,0|1,0,1]=4 741 B12R2.606 N1C(C)=CC2=C1C=CC(Cl)=C2 SBB003903 [0,1,0,1,0,0|0,0,2]=4 742 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 SBB072398 [0,1,0,1,0,0|1,0,1]=4 743 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 SBB010120 [0,1,0,1,0,0|1,0,1]=4 744 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SBB058442 [0,1,0,1,0,0|1,0,1]=4 745 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SBB005897 [0,1,0,1,0,0|1,0,1]=4 746 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 SBB003879 [0,1,0,1,0,0|1,0,1]=4 747 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 SBB018719 [0,1,0,1,0,0|1,0,1]=4 748 B12R2.606 [NH+]1=C(C)NC2=CC([NH3+])=CC=C21 SBB111712 [0,1,0,1,0,0|1,0,1]=4 749 B12R2.18 CC1CC2=CC=CC=C2C1=O SBB067570 [0,1,0,1,0,0|1,0,0]=3 750 B12R2.18 CN1C(=O)CC2=CC=CC=C21 SBB006878 [0,1,0,1,0,0|1,0,1]=4 751 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 SBB004092 [0,1,0,1,0,0|1,0,1]=4 752 B12R2.18 NC1C2=CC=CC=C2CC1O SBB052066 [0,1,0,1,0,0|1,0,0]=3 753 B12R2.18 NC1CC2=CC=CC=C2C1O SBB052067 [0,1,0,1,0,0|0,0,0]=2 754 B12R2.18 O=C1C2=CC=CC=C2CC1Br SBB054709 [0,1,0,1,0,0|1,0,1]=4 755 B12R2.18 OC1C2=C(C=CC=C2)CC1Br SBB058660 [0,1,0,1,0,0|1,0,0]=3 756 B12R2.18 O[C@H]1CC2=C(C=CC=C2)[C@H]1N SBB006600 [0,1,0,1,0,0|1,0,0]=3 757 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 SBB065028 [0,1,0,1,0,0|1,0,1]=4 758 B12R2.27 OCC1CC1C2=CC=CC=C2 SBB084422 [0,1,0,1,0,0|1,0,0]=3 759 B12R2.32 CCC1=NC2=CC=CC=C2N1 SBB017222 [0,1,0,1,0,0|1,0,1]=4 760 B12R2.32 CSC1=NC2=CC=CC=C2N1 SBB045189 [0,1,0,1,0,0|1,0,1]=4 761 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 SBB001845 [0,1,0,1,0,0|1,0,1]=4 762 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 SBB021214 [0,1,0,1,0,0|0,0,2]=4 763 B12R2.32 NCC1=NC2=CC=CC=C2N1 SBB002735 [0,1,0,1,0,0|1,0,1]=4 764 B12R2.32 NCC1CC2=CC=CC=C2O1 SBB013722 [0,1,0,1,0,0|1,0,0]=3 765 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 SBB004085 [0,1,0,1,0,0|1,0,1]=4 766 B12R2.32 OCC1CC2=C(C=CC=C2)N1 SBB086644 [0,1,0,1,0,0|0,0,0]=2 767 B12R2.32 OCC1CC2=CC=CC=C2O1 SBB017925 [0,1,0,1,0,0|1,0,0]=3 768 B12R2.32 SCC1=NC2=CC=CC=C2N1 SBB039214 [0,1,0,1,0,0|1,0,1]=4 769 B12R2.95 CC1(C)CC2=CC=CC=C2O1 SBB049505 [0,1,0,1,0,0|1,0,0]=3 770 B12R2.202 CC1=NC2=C(C=CC=C2N)N1 SBB013180 [0,1,0,1,0,0|1,0,1]=4 771 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 SBB054564 [0,1,0,1,0,0|1,0,1]=4 772 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 SBB086757 [0,1,0,1,0,0|1,0,1]=4 773 B8R1.8 CCCC1=CC=CS1 SBB073407 [1,0,0,0,1,0|1,0,0]=3 774 B8R1.8 CCCC1=NC=CS1 SBB055797 [1,0,0,0,1,0|2,0,0]=4 775 B8R1.8 CCCN1C=CC=N1 SBB024228 [1,0,0,0,1,0|2,0,0]=4 776 B8R1.8 CCCN1C=CN=C1 SBB073424 [1,0,0,0,1,0|2,0,0]=4 777 B8R1.8 CNCC1=CC=CO1 SBB079004 [1,0,0,0,1,0|2,0,0]=4 778 B8R1.8 NCCC1=CC=CO1 SBB013333 [1,0,0,0,1,0|1,0,0]=3 779 B8R1.8 NCCC1=CC=CS1 SBB013250 [1,0,0,0,1,0|1,0,0]=3 780 B8R1.8 NCCC1=CC=CS1 SBB013650 [1,0,0,0,1,0|1,0,0]=3 781 B8R1.8 NCCC1=CNC=N1 SBB003722 [1,0,0,0,1,0|2,0,0]=4 782 B8R1.8 NCCC1=CNC=N1 SBB012708 [1,0,0,0,1,0|2,0,0]=4 783 B8R1.8 NCCC1=CNN=C1 SBB018789 [1,0,0,0,1,0|2,0,0]=4 784 B8R1.8 NCCC1=CSC=C1 SBB109999 [1,0,0,0,1,0|1,0,0]=3 785 B8R1.8 NCCC1=NC=CS1 SBB046047 [1,0,0,0,1,0|2,0,0]=4 786 B8R1.8 NCCN1C=CC=N1 SBB007087 [1,0,0,0,1,0|2,0,0]=4 787 B8R1.8 NCCN1C=CN=C1 SBB026490 [1,0,0,0,1,0|2,0,0]=4 788 B8R1.8 OCCC1=CC=CS1 SBB062831 [1,0,0,0,1,0|2,0,0]=4 789 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [0,0,0,0,2,0|1,0,0]=3 790 B8R1.7 CC(N)C1=CC=CS1 SBB028228 [0,0,0,0,2,0|1,0,0]=3 791 B12R1.252 CC(=O)CSCC1=CC=CC=C1 SBB058580 [0,0,0,0,0,2|1,0,1]=4 792 B12R1.252 CC(=O)NCCC1=CC=CC=C1 SBB058213 [0,0,0,0,0,2|1,0,1]=4 793 B12R1.252 CC(=O)OCCC1=CC=CC=C1 SBB061194 [0,0,0,0,0,2|1,0,1]=4 794 B12R1.252 CC(C)NCCC1=CC=CC=C1 SBB080102 [0,0,0,0,0,2|1,0,0]=3 795 B12R1.252 CC(N)CCCC1=CC=CC=C1 SBB010444 [0,0,0,0,0,2|0,0,0]=2 796 B12R1.252 FC(F)CNCC1=CC=CC=C1 SBB046667 [0,0,0,0,0,2|2,0,0]=4 797 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SBB102430 [0,0,0,0,0,2|1,0,1]=4 798 B12R1.252 NC(=O)CCCC1=CC=CC=C1 SBB051450 [0,0,0,0,0,2|1,0,1]=4 799 B12R1.252 NC(=S)NCCC1=CC=CC=C1 SBB017394 [0,0,0,0,0,2|1,0,1]=4