0 B10R1.16 CC1=CC=C(CCC=O)O1 SBB017913 [0,0,0,0,0,0|0,0,2]=2 1 B9R1.7 CC1=CC=C(\C=N\O)O1 SBB085593 [1,0,0,0,0,0|1,0,1]=3 2 B9R1.7 CC1=CC=C(\C=N\O)S1 SBB086199 [1,0,0,0,0,0|1,1,1]=4 3 B9R1.7 CNCC1=CC=C(C)O1 SBB085300 [1,0,0,0,0,0|1,0,2]=4 4 B9R1.12 C(=O)\C=C\C1=CC=CO1 SBB004286 [1,0,0,0,0,0|0,0,0]=1 5 B11R1.75 CC1=CC=C(CCC(=O)O)O1 SBB007451 [0,1,0,0,0,0|0,0,2]=3 6 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 SBB005723 [0,1,0,0,0,0|0,0,0]=1 7 B11R1.75 CC1=CC=C(\C=C\C(N)=O)O1 SBB113445 [0,1,0,0,0,0|0,0,0]=1 8 B11R1.75 CN1C=C(\C=C\C(=O)Cl)C=N1 SBB020285 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.75 CN1C=C(\C=C\C(=O)O)C=N1 SBB019498 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.75 CN1C=CC(\C=C\C(=O)O)=N1 SBB024756 [0,1,0,0,0,0|2,0,0]=3 11 B11R2.1 CC1=CNC2=CC=CC=C12 SBB055975 [0,0,0,1,0,0|3,0,0]=4 12 B11R2.1 CC1=CSC2=CC=CC=C12 SBB086600 [0,0,0,1,0,0|3,0,0]=4 13 B11R2.10 CC1=CC2=C(C=CC=C2)N1 SBB058480 [0,0,0,1,0,0|2,0,0]=3 14 B11R2.10 CC1=CN2C=CC=CC2=N1 SBB056298 [0,0,0,1,0,0|3,0,0]=4 15 B11R2.10 CC1=NC2=C(C=CC=C2)S1 SBB059092 [0,0,0,1,0,0|2,1,0]=4 16 B11R2.10 CC1=NC2=C(C=CC=C2)[Se]1 SBB059124 [0,0,0,1,0,0|2,1,0]=4 17 B11R2.10 CC1=NC2=CC=CC=C2N1 SBB046157 [0,0,0,1,0,0|3,0,0]=4 18 B11R2.10 CC1=NC2=CC=CC=C2O1 SBB108741 [0,0,0,1,0,0|2,0,0]=3 19 B11R2.10 CC1=NC2=CC=CN=C2N1 SBB111724 [0,0,0,1,0,0|3,0,0]=4 20 B11R2.10 CC1=NC2=NC=CC=C2O1 SBB056403 [0,0,0,1,0,0|2,0,0]=3 21 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 SBB080914 [0,0,0,1,0,0|3,0,0]=4 22 B11R2.10 NC1=NC2=CC=CC=C2O1 SBB046613 [0,0,0,1,0,0|3,0,0]=4 23 B11R2.10 NC1=NC2=NC=CC=C2O1 SBB072332 [0,0,0,1,0,0|3,0,0]=4 24 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SBB058504 [0,0,0,1,0,0|3,0,0]=4 25 B11R2.10 SC1=NC2=CC=CC=C2O1 SBB055994 [0,0,0,1,0,0|3,0,0]=4 26 B11R2.10 SC1=NC2=NC=CC=C2O1 SBB086858 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.1 C(=O)NNC1=CC=C(C)C=C1 SBB008283 [0,0,0,0,0,1|3,0,0]=4 28 B8R1.1 C(=O)C1=CC=C(C)S1 SBB004249 [2,0,0,0,0,0|0,1,0]=3 29 B8R1.1 C(=O)C1=CC=C(Cl)O1 SBB004223 [2,0,0,0,0,0|1,0,0]=3 30 B8R1.1 C(=O)C1=CC=C(Cl)S1 SBB004100 [2,0,0,0,0,0|1,1,0]=4 31 B8R1.1 C(=O)C1=CC=C(F)S1 SBB027017 [2,0,0,0,0,0|1,1,0]=4 32 B8R1.1 CC1=CC=C(C=O)O1 SBB040222 [2,0,0,0,0,0|0,0,0]=2 33 B8R1.1 CC1=CC=C(CN)O1 SBB047770 [2,0,0,0,0,0|1,0,1]=4 34 B8R1.1 CC1=CN=C(C=O)S1 SBB052287 [2,0,0,0,0,0|1,1,0]=4 35 B8R1.1 CC1=NC(C=O)=CN1 SBB052314 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.1 CC1=NC(C=O)=CS1 SBB085686 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.1 CC1=NC=C(C=O)S1 SBB018895 [2,0,0,0,0,0|1,1,0]=4 38 B8R1.1 CN1C=CC(C=O)=N1 SBB020577 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.1 O=CC1=CC=C(Br)O1 SBB047477 [2,0,0,0,0,0|1,0,0]=3 40 B8R1.1 O=CC1=CC=C(Br)S1 SBB000294 [2,0,0,0,0,0|1,1,0]=4 41 B8R1.1 O=CC1=CC=C(I)O1 SBB039297 [2,0,0,0,0,0|1,0,0]=3 42 B10R1.27 C\C(C=O)=C\C1=CC=CO1 SBB040268 [1,1,0,0,0,0|0,0,0]=2 43 B10R1.66 CC(=O)OCC1=CC=CO1 SBB055767 [1,1,0,0,0,0|1,0,1]=4 44 B10R1.66 CC(=O)SCC1=CC=CO1 SBB057323 [1,1,0,0,0,0|1,0,1]=4 45 B10R1.66 CC(=O)\C=C\C1=CC=CO1 SBB056697 [1,1,0,0,0,0|0,0,0]=2 46 B10R1.66 CC(=O)\C=C\C1=CC=CS1 SBB056771 [1,1,0,0,0,0|0,1,0]=3 47 B10R1.66 NC(=O)\C=C\C1=CC=CO1 SBB085962 [1,1,0,0,0,0|0,0,0]=2 48 B10R1.66 O=C(O)\C=C\C1=CNC=N1 SBB006702 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.66 O=C(O)\C=C\C1=COC=C1 SBB004191 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.66 O=C(O)\C=C\C1=CSC=C1 SBB004033 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CO1 SBB000076 [1,1,0,0,0,0|1,0,0]=3 52 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CS1 SBB000122 [1,1,0,0,0,0|1,1,0]=4 53 B10R1.66 OC(=O)CCC1=CC=CO1 SBB005449 [1,1,0,0,0,0|0,0,2]=4 54 B10R1.66 OC(=O)\C=C\C1=CC=CO1 SBB004189 [1,1,0,0,0,0|0,0,0]=2 55 B10R1.66 OC(=O)\C=C\C1=CC=CS1 SBB004032 [1,1,0,0,0,0|0,1,0]=3 56 B12R1.21 CC(=O)\C=C\C1=CC=C(Br)C=C1 SBB017373 [0,1,0,0,0,1|2,0,0]=4 57 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB089732 [0,1,0,0,0,1|2,0,0]=4 58 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 SBB087791 [0,1,0,0,0,1|2,0,0]=4 59 B12R1.21 CC1=CC=C(\C=C/[N+](=O)[O-])C=C1 SBB000144 [0,1,0,0,0,1|2,0,0]=4 60 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SBB015822 [0,1,0,0,0,1|1,0,0]=3 61 B12R1.21 CC1=CC=C(\C=C\C(N)=O)C=C1 SBB113392 [0,1,0,0,0,1|1,0,0]=3 62 B12R1.21 NC(=O)\C=C\C1=CC=C(Cl)C=C1 SBB008061 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 SBB003553 [0,1,0,0,0,1|2,0,0]=4 64 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SBB059537 [0,1,0,0,0,1|2,0,0]=4 65 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 SBB008203 [0,1,0,0,0,1|2,0,0]=4 66 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 SBB005718 [0,1,0,0,0,1|2,0,0]=4 67 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SBB007613 [0,1,0,0,0,1|2,0,0]=4 68 B12R1.226 CC(=O)\C=C\C1=CC=CC(Cl)=C1 SBB057836 [0,1,0,0,0,1|2,0,0]=4 69 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SBB006620 [0,1,0,0,0,1|1,0,0]=3 70 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 SBB051583 [0,1,0,0,0,1|1,0,0]=3 71 B12R1.226 NC1=CC(\C=C\C(=O)O)=CC=C1 SBB043435 [0,1,0,0,0,1|2,0,0]=4 72 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 SBB057740 [0,1,0,0,0,1|2,0,0]=4 73 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 SBB042541 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.226 OC(=O)\C=C\C1=CC(Cl)=CC=C1 SBB012383 [0,1,0,0,0,1|2,0,0]=4 75 B12R1.226 OC(=O)\C=C\C1=CC(F)=CC=C1 SBB006621 [0,1,0,0,0,1|2,0,0]=4 76 B12R1.105 CC1=CC=C(\C=N/NC(N)=S)O1 SBB112876 [0,2,0,0,0,0|1,1,0]=4 77 B12R1.105 CC1=CC=C(\C=N\NC(N)=O)O1 SBB080710 [0,2,0,0,0,0|1,0,0]=3 78 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 SBB040857 [0,0,1,1,0,0|1,0,1]=4 79 B10R1.61 CC(=O)C1=C(N)C=CC=C1 SBB058825 [0,0,1,1,0,0|1,0,1]=4 80 B10R1.61 CC(=O)C1=CC=CC=C1C SBB063140 [0,0,1,1,0,0|1,0,1]=4 81 B10R1.61 CC(=O)C1=CC=CC=C1Cl SBB040259 [0,0,1,1,0,0|1,0,1]=4 82 B10R1.61 CC(=O)C1=CC=CC=C1F SBB058458 [0,0,1,1,0,0|1,0,1]=4 83 B10R1.61 CC(=O)C1=CC=CC=C1I SBB064803 [0,0,1,1,0,0|1,0,1]=4 84 B10R1.61 CC(=O)C1=CC=CC=C1O SBB040261 [0,0,1,1,0,0|0,0,2]=4 85 B10R1.61 CC(O)C1=CC=CC=C1N SBB072985 [0,0,1,1,0,0|1,0,1]=4 86 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SBB040521 [0,0,1,1,0,0|2,0,0]=4 87 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 SBB086152 [0,0,1,1,0,0|1,0,1]=4 88 B10R1.61 C[C@H](O)C1=CC=CC=C1Br SBB064753 [0,0,1,1,0,0|1,0,1]=4 89 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SBB064728 [0,0,1,1,0,0|1,0,1]=4 90 B10R1.61 O=C(O)C1=CC=CC=C1Br SBB058412 [0,0,1,1,0,0|2,0,0]=4 91 B10R1.61 O=C(O)C1=CC=CC=C1Cl SBB040524 [0,0,1,1,0,0|2,0,0]=4 92 B10R1.61 O=C(O)C1=CC=CC=C1F SBB040569 [0,0,1,1,0,0|2,0,0]=4 93 B10R1.61 O=C(O)C1=CC=CC=C1I SBB063117 [0,0,1,1,0,0|2,0,0]=4 94 B10R1.61 O=C(O)C1=CC=CC=C1O SBB052826 [0,0,1,1,0,0|1,0,1]=4 95 B10R1.61 O=C(O)C1=CC=COC1=O SBB086118 [0,0,1,1,0,0|2,0,0]=4 96 B10R1.8 CC1=CC(C)=CC(C=O)=C1 SBB063352 [0,0,1,1,0,0|1,0,1]=4 97 B10R1.8 CC1=CC(F)=CC(C=O)=C1 SBB064351 [0,0,1,1,0,0|2,0,0]=4 98 B10R1.4 C\C=C\C1=C(O)C=CC=C1 SBB071429 [0,0,1,1,0,0|1,0,0]=3 99 B10R1.17 O=C\C=C\C1=CC=CC=C1 SBB028652 [0,0,1,1,0,0|1,0,1]=4 100 B10R1.30 C(=O)C1=C(C)C=CC(C)=C1 SBB008435 [0,0,1,1,0,0|1,0,0]=3 101 B10R1.30 C(=O)C1=C(Cl)C=CC(Cl)=C1 SBB003793 [0,0,1,1,0,0|2,0,0]=4 102 B10R1.30 C(=O)C1=C(F)C=CC(F)=C1 SBB006570 [0,0,1,1,0,0|2,0,0]=4 103 B10R1.30 CC1=CC=C(F)C(C=O)=C1 SBB063764 [0,0,1,1,0,0|2,0,0]=4 104 B10R1.30 CC1=CC=C(F)C=C1C=O SBB064371 [0,0,1,1,0,0|1,0,0]=3 105 B10R1.30 CC1=CC=C(O)C(C=O)=C1 SBB063013 [0,0,1,1,0,0|2,0,0]=4 106 B10R1.30 NC1=CC=C(Br)C=C1C=O SBB092543 [0,0,1,1,0,0|2,0,0]=4 107 B10R1.30 NC1=CC=C(Cl)C=C1C=O SBB063929 [0,0,1,1,0,0|2,0,0]=4 108 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 SBB040272 [0,0,1,1,0,0|2,0,0]=4 109 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 SBB016339 [0,0,1,1,0,0|2,0,0]=4 110 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 SBB004013 [0,0,1,1,0,0|2,0,0]=4 111 B10R1.30 O=CC1=C(O)C=CC(I)=C1 SBB035854 [0,0,1,1,0,0|2,0,0]=4 112 B10R1.30 O=CC1=CC(Br)=CC=C1Br SBB063082 [0,0,1,1,0,0|2,0,0]=4 113 B10R1.30 O=CC1=CC(Cl)=CC=C1F SBB063766 [0,0,1,1,0,0|2,0,0]=4 114 B10R1.30 O=CC1=CC(F)=CC=C1Br SBB052173 [0,0,1,1,0,0|2,0,0]=4 115 B10R1.30 O=CC1=CC(F)=CC=C1Cl SBB063392 [0,0,1,1,0,0|2,0,0]=4 116 B10R1.30 O=CC1=CC(F)=CC=C1O SBB064409 [0,0,1,1,0,0|2,0,0]=4 117 B10R1.30 O=CC1=CC(I)=CC=C1F SBB063108 [0,0,1,1,0,0|2,0,0]=4 118 B10R1.30 O=CC1=CC(O)=CC=C1Br SBB063077 [0,0,1,1,0,0|1,0,0]=3 119 B10R1.30 O=CC1=CC(O)=CC=C1O SBB052127 [0,0,1,1,0,0|1,0,0]=3 120 B10R1.1 C=COC1=CC=C(N)C=C1 SBB010266 [0,0,1,1,0,0|1,0,1]=4 121 B10R1.1 CCOC1=CC=C(Br)C=C1 SBB059353 [0,0,1,1,0,0|1,0,1]=4 122 B10R1.1 CCOC1=CC=C(C)C=C1 SBB060988 [0,0,1,1,0,0|1,0,1]=4 123 B10R1.1 CCOC1=CC=C(Cl)C=C1 SBB040853 [0,0,1,1,0,0|1,0,1]=4 124 B10R1.1 CCOC1=CC=C(F)C=C1 SBB086157 [0,0,1,1,0,0|1,0,1]=4 125 B10R1.1 CCOC1=CC=C(N)C=C1 SBB040442 [0,0,1,1,0,0|1,0,1]=4 126 B10R1.1 CCOC1=CC=C(N)C=C1 SBB073014 [0,0,1,1,0,0|1,0,1]=4 127 B10R1.1 CCOC1=CC=C(O)C=C1 SBB043810 [0,0,1,1,0,0|0,0,2]=4 128 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB060150 [0,0,1,1,0,0|1,0,1]=4 129 B10R1.2 CC1=C(C)C(C=O)=CC=C1 SBB062996 [0,0,1,1,0,0|1,0,1]=4 130 B10R1.2 CC1=C(F)C(C=O)=CC=C1 SBB064504 [0,0,1,1,0,0|2,0,0]=4 131 B10R1.2 CC1=C(O)C(C=O)=CC=C1 SBB068759 [0,0,1,1,0,0|2,0,0]=4 132 B10R2.7 C1=CC2=C(C=C1)OC=C2 SBB060607 [1,0,0,1,0,0|1,0,0]=3 133 B10R2.7 C1=CC=C2CC=CC2=C1 SBB040862 [1,0,0,1,0,0|2,0,0]=4 134 B10R2.7 C1=CC=C2NC=CC2=C1 SBB055980 [1,0,0,1,0,0|2,0,0]=4 135 B10R2.7 C1=CC=C2SC=CC2=C1 SBB055961 [1,0,0,1,0,0|1,1,0]=4 136 B12R2.24 CC1=CC2=C(C=CC=N2)C=C1 SBB059301 [0,0,0,1,0,1|2,0,0]=4 137 B12R2.24 CC1=CC=C2C=CC=CC2=C1 SBB060085 [0,0,0,1,0,1|2,0,0]=4 138 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 SBB008939 [0,0,0,1,0,1|2,0,0]=4 139 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SBB042157 [0,0,0,1,0,1|2,0,0]=4 140 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 SBB000094 [0,0,0,1,0,1|2,0,0]=4 141 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 SBB060401 [0,0,0,1,0,1|2,0,0]=4 142 B12R2.1081 CC1=CC=CC2=CC=CN=C12 SBB080579 [0,0,0,1,0,1|2,0,0]=4 143 B12R2.1081 CC1=CC=NC2=C1C=CC=C2 SBB058784 [0,0,0,1,0,1|2,0,0]=4 144 B12R2.1081 CC1=NC=CC2=CC=CC=C21 SBB056020 [0,0,0,1,0,1|2,0,0]=4 145 B12R2.202 CC1=CC2=C(N=CNC2=O)S1 SBB016135 [0,1,0,1,0,0|1,1,0]=4 146 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 SBB010312 [0,1,0,1,0,0|1,0,0]=3 147 B12R2.606 CC1=CC2=C(C=CC(N)=C2)N1 SBB028277 [0,1,0,1,0,0|2,0,0]=4 148 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 SBB010313 [0,1,0,1,0,0|1,0,0]=3 149 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 SBB013056 [0,1,0,1,0,0|2,0,0]=4 150 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 SBB059434 [0,1,0,1,0,0|2,0,0]=4 151 B12R2.606 CC1=NC2=C(C=CC(F)=C2)O1 SBB059632 [0,1,0,1,0,0|2,0,0]=4 152 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 SBB051986 [0,1,0,1,0,0|2,0,0]=4 153 B12R2.606 CC1=NC2=CC=C(O)C=C2O1 SBB072525 [0,1,0,1,0,0|2,0,0]=4 154 B12R2.606 N1C(C)=CC2=C1C=CC(Cl)=C2 SBB003903 [0,1,0,1,0,0|2,0,0]=4 155 B12R2.32 CNC1=NC2=C(C=CC=C2)O1 SBB086585 [0,1,0,1,0,0|2,0,0]=4 156 B12R2.32 ClCC1=NC2=CC=CC=C2O1 SBB054950 [0,1,0,1,0,0|2,0,0]=4 157 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 SBB021214 [0,1,0,1,0,0|2,0,0]=4 158 B12R2.32 NCC1=CC2=CC=CC=C2O1 SBB072101 [0,1,0,1,0,0|1,0,0]=3 159 B12R2.32 NCC1=NC2=CC=CC=C2O1 SBB002785 [0,1,0,1,0,0|2,0,0]=4 160 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 SBB010059 [0,1,0,1,0,0|1,0,1]=4 161 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 SBB087818 [0,1,0,1,0,0|1,1,0]=4