0 B10R1.15 BrCC(Br)C1=CC=CC=C1 OR4708 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 OR470119 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 OR470118 [0,0,0,0,0,0|0,0,2]=2 3 B10R1.15 CN(C=O)C1=CC=CC=C1 OR315726 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.15 CNC(C)C1=CC=NC=N1 OR322569 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.15 COC(=N)C1=CC=CC=C1 OR300905 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 OR471318 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.15 C[C@H](C=O)C1=CC=CC=C1 OR471313 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.15 C\C=C(/F)C1=CC=CC=C1 PC450040 [0,0,0,0,0,0|1,0,2]=3 9 B10R1.15 FC(CBr)C1=CC=CC=C1 PC400563 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.15 N#CC(=O)C1=CC=CC=C1 OR322167 [0,0,0,0,0,0|1,0,3]=4 11 B10R1.15 NNC(=O)C1=CC=CC=C1 OR4341 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.15 O=C(CF)C1=CC=CC=C1 PC7958 [0,0,0,0,0,0|1,0,2]=3 13 B9R1.6 C=C(F)C1=CC=CC=C1 PC400564 [1,0,0,0,0,0|1,0,2]=4 14 B9R1.6 CN(C)C1=CC=CN=C1 OR27549 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.6 C[C@H](O)C1=CC=CC=C1 OR315315 [1,0,0,0,0,0|0,0,0]=1 16 B9R1.6 FC(Cl)C1=CC=CC=C1 PC0684 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.6 FC(F)C1=CC=CC=C1 PC0683 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.6 FC(F)C1=CC=NC=C1 PC49146 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.6 FC(F)C1=CN=CC=C1 PC520604 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.6 FC(F)C1=NC=CC=C1 PC49143 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.6 N=C(N)C1=CC=CC=C1 OR30454 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.6 O=C(F)C1=CC=CC=C1 PC1200 [1,0,0,0,0,0|1,0,2]=4 23 B9R1.6 OB(O)C1=CC=NC=C1 OR361571 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.6 OB(O)C1=CN=CC=C1 OR360313 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.8 BrCCC1=CC=CC=N1 OR322454 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.8 Br[Mg]CC1=CC=CC=C1 OR320064 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.8 Br[Mg]CC1=CC=CC=C1 OR320065 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.8 Br\C=C\C1=CC=CC=C1 OR70303 [1,0,0,0,0,0|1,0,2]=4 29 B9R1.8 CCCC1=NC=CC=C1 OR310652 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.8 CCOC1=CN=CC=C1 OR345538 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 CCOC1=NC=CN=C1 OR350173 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320068 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320069 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 Cl[Mg]CC1=CC=CC=C1 OR320071 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 N#COC1=CC=CC=C1 OR315259 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.8 NNCC1=CC=CC=C1 OR315732 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 NNCC1=CC=CC=N1 OR306156 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 NNCC1=CC=CN=C1 OR306139 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.8 NNCC1=CC=NC=C1 OR306205 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.8 NOCC1=CC=CN=C1 OR471001 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 O=CCC1=CC=CN=C1 OR311265 [1,0,0,0,0,0|2,0,1]=4 42 B9R1.8 O=CCC1=CC=NC=C1 OR311262 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.8 SCCC1=CC=CN=C1 OR305415 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.8 SCCC1=CC=NC=C1 OR322470 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.7 CC(O)(CN)C1=CC=CC=C1 OR309430 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.7 CCC(F)(F)C1=CC=CC=C1 PC450049 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.7 CCC(F)(F)C1=CN=CC=C1 PC520637 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 OR303370 [0,1,0,0,0,0|2,1,0]=4 49 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 PC2359 [0,1,0,0,0,0|2,0,0]=3 50 B11R1.7 FC(F)(CCl)C1=CC=CC=C1 PC520695 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.7 N#CC(Cl)(Cl)C1=CC=CC=C1 OR3472 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.7 N#CC(F)(Cl)C1=CC=CC=C1 PC7151 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.7 N#CC(F)(F)C1=CC=CC=C1 PC9863 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.7 NCC(F)(F)C1=CC=CC=C1 PC510155 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 OR322095 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.7 OCC(F)(F)C1=NC=CC=C1 PC5565 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.12 CNC(C#N)C1=CC=CC=C1 OR300787 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.12 CNC(C#N)C1=CC=CC=C1 OR300796 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.12 COC(OC)C1=CC=NC=N1 OR300147 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.12 N#CC(C=O)C1=CC=CC=C1 OR322124 [0,1,0,0,0,0|1,0,2]=4 61 B11R1.12 N#C\C(=N/O)C1=CC=CC=C1 OR27083 [0,1,0,0,0,0|1,0,2]=4 62 B11R1.16 CC(CCN)C1=CC=CC=C1 OR471278 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.16 CCCC(N)C1=NC=CC=C1 OR470276 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.16 CNCC(O)C1=CC=CC=C1 OR13980 [0,1,0,0,0,0|0,0,0]=1 65 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 OR316003 [0,1,0,0,0,0|1,0,0]=2 66 B11R1.16 NCCC(O)C1=CC=CC=C1 OR302404 [0,1,0,0,0,0|0,0,0]=1 67 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 PC4190 [0,1,0,0,0,0|0,0,2]=3 68 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 OR11062 [0,1,0,0,0,0|0,0,2]=3 69 B11R1.22 CCC(N)C1=CC=C(F)C=C1 PC5885 [0,1,0,0,0,0|1,0,0]=2 70 B11R1.22 CCC(O)C1=CC=C(F)C=C1 PC6642 [0,1,0,0,0,0|0,0,0]=1 71 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 PC48538 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 PC48539 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.22 CNC(C)C1=CC=C(F)C=C1 PC6293 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 PC7545 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.22 CN[C@H](C)C1=CC=C(F)C=C1 PC2461 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.22 COC(=N)C1=CC=C(Cl)C=C1 OR300716 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.22 COC(=O)C1=CC=C(F)C=C1 PC5089 [0,1,0,0,0,0|1,0,2]=4 78 B11R1.22 COC(=O)C1=CC=C(N)C=C1 OR30151 [0,1,0,0,0,0|1,0,2]=4 79 B11R1.22 COC(=O)C1=CC=C(S)C=C1 OR311187 [0,1,0,0,0,0|1,0,2]=4 80 B11R1.22 N#CC(N)C1=CC=C(F)C=C1 PC2032 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.22 N#CC(N)C1=CC=C(F)C=C1 PC57027 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 OR301371 [0,1,0,0,0,0|1,0,2]=4 83 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 PC4576 [0,1,0,0,0,0|1,0,2]=4 84 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 PC7601 [0,1,0,0,0,0|1,0,2]=4 85 B11R1.22 NCC(O)C1=CC=C(F)C=C1 PC6964 [0,1,0,0,0,0|1,0,0]=2 86 B11R1.22 NCC(O)C1=CC=C(F)C=C1 PC6965 [0,1,0,0,0,0|1,0,0]=2 87 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 PC201202 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 PC4060 [0,1,0,0,0,0|1,0,2]=4 89 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 PC1463 [0,1,0,0,0,0|1,0,2]=4 90 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 OR11061 [0,1,0,0,0,0|1,0,2]=4 91 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 PC1458 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 PC4189 [0,1,0,0,0,0|0,0,2]=3 93 B11R1.23 CCC(N)C1=CC=CC(F)=C1 PC3484 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.23 CCC(O)C1=CC(F)=CC=C1 PC6641 [0,1,0,0,0,0|0,0,0]=1 95 B11R1.23 CNC(C)C1=CC=CC(F)=C1 PC2543 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 PC5854 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.23 CN[C@H](C)C1=CC=CC(F)=C1 PC1561 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.23 COC(=N)C1=CC=CC(Br)=C1 OR470983 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.23 COC(=O)C1=CC(F)=CC=C1 PC5734 [0,1,0,0,0,0|1,0,2]=4 100 B11R1.23 NC(CO)C1=CC=CC(F)=C1 PC53313 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 PC4574 [0,1,0,0,0,0|1,0,2]=4 102 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 PC4059W [0,1,0,0,0,0|1,0,2]=4 103 B11R1.36 CC(C)C(N)C1=CC=CN=C1 OR470262 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.36 CC(C)C(N)C1=CC=NC=C1 OR470263 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.36 CN(N)C(=O)C1=CC=CC=C1 OR322621 [0,1,0,0,0,0|1,0,2]=4 106 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 OR304085 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 OR304086 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.36 C[C@H](C1=CC=CC=C1)N(C)C OR322173 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.36 O=C(C1=CC=CC=C1)C(F)F PC6686 [0,1,0,0,0,0|1,0,2]=4 110 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 PC4119 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.36 OC(C1=CC=CC=C1)C(F)F PC51088 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 PC4188 [0,1,0,0,0,0|0,0,2]=3 113 B11R1.222 CCC(=O)C1=CC=CC=C1Cl OR350082 [0,1,0,0,0,0|0,0,2]=3 114 B11R1.222 CCC(N)C1=CC=CC=C1F PC5883 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.222 CCC(O)C1=C(F)C=CC=C1 PC450219 [0,1,0,0,0,0|0,0,0]=1 116 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 OR54613 [0,1,0,0,0,0|1,0,2]=4 117 B11R1.222 CNC(C)C1=C(F)C=CC=C1 PC6296 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.222 CN[C@@H](C)C1=C(F)C=CC=C1 PC5853 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.222 CN[C@H](C)C1=C(F)C=CC=C1 PC1386 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.222 COC(=N)C1=CC=CC=C1Br OR470984 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.222 COC(=O)C1=C(F)C=CC=C1 PC5088 [0,1,0,0,0,0|1,0,2]=4 122 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 OR2791 [0,1,0,0,0,0|1,0,2]=4 123 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 PC4573 [0,1,0,0,0,0|1,0,2]=4 124 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 PC7603 [0,1,0,0,0,0|1,0,2]=4 125 B11R1.222 N[C@H](CO)C1=CC=CC=C1F PC201109 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 PC4747 [0,1,0,0,0,0|1,0,2]=4 127 B11R1.222 O=C(CBr)C1=C(I)C=CC=C1 OR400132 [0,1,0,0,0,0|1,0,2]=4 128 B11R1.222 O=C(CF)C1=CC=CC=C1F PC201134 [0,1,0,0,0,0|1,0,2]=4 129 B11R2.1 C=C1CCC2=C1C=CC=C2 OR471093 [0,0,0,1,0,0|1,0,1]=3 130 B11R2.1 NC1CCC2=C1N=CC=C2 OR315310 [0,0,0,1,0,0|2,0,0]=3 131 B11R2.40 CC1(C2=CC=CC=C2)CN1 OR340188 [0,0,0,1,0,0|2,0,0]=3 132 B11R2.40 CC1(C2=CN=NC=C2)CC1 OR480094 [0,0,0,1,0,0|3,0,0]=4 133 B11R2.40 NC1(C2=CC=CC=N2)CC1 OR302707 [0,0,0,1,0,0|2,0,0]=3 134 B11R2.40 NC1(C2=CC=CN=C2)CC1 OR480082 [0,0,0,1,0,0|2,0,0]=3 135 B11R2.40 NC1(C2=CN=CN=C2)CC1 OR480092 [0,0,0,1,0,0|3,0,0]=4 136 B11R2.40 NC1(C2=NC=CC=N2)CC1 OR306346 [0,0,0,1,0,0|3,0,0]=4 137 B11R2.40 NC1(C2=NN=CC=C2)CC1 OR302663 [0,0,0,1,0,0|3,0,0]=4 138 B11R2.239 C1=CC=C(C2CCN2)C=C1 OR309016 [0,0,0,1,0,0|1,0,0]=2 139 B11R2.239 C1=CC=C(C2CCO2)C=C1 OR309062 [0,0,0,1,0,0|0,0,0]=1 140 B11R2.239 C1=CC=C(C2CNC2)C=C1 OR451026 [0,0,0,1,0,0|2,0,0]=3 141 B11R2.239 C1=CC=C(C2COC2)C=C1 OR309047 [0,0,0,1,0,0|2,0,0]=3 142 B11R2.988 N#CC1CC2=C1C=CC=C2 OR21855 [0,0,0,1,0,0|2,0,1]=4 143 B9R1.11 CCC(=O)C1=CC=CS1 OR23928 [0,0,0,0,1,0|1,0,2]=4 144 B11R1.40 CC(C#N)NC1=CC=CC=C1 OR470798 [0,0,0,0,0,1|2,0,1]=4 145 B11R1.40 CC(CN)OC1=CC=CN=C1 OR12730 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.40 NCC(O)CC1=CC=CC=C1 OR323295 [0,0,0,0,0,1|1,0,0]=2 147 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 OR5852 [0,0,0,0,0,1|2,0,0]=3 148 B11R1.40 O=C(CBr)NC1=CC=CC=C1 OR346345 [0,0,0,0,0,1|1,0,2]=4 149 B11R1.40 O=C(CCl)OC1=CC=CC=C1 OR25299 [0,0,0,0,0,1|1,0,2]=4 150 B11R1.40 O[C@@H](CCl)CC1=CC=CC=C1 OR304091 [0,0,0,0,0,1|1,0,0]=2 151 B11R1.40 O[C@H](CCl)CC1=CC=CC=C1 OR304092 [0,0,0,0,0,1|1,0,0]=2 152 B8R1.2 BrCC1=CC=NC=C1 OR315149 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.2 BrCC1=NC=CC=C1 OR322016 [2,0,0,0,0,0|2,0,0]=4 154 B8R1.2 Br[Mg]C1=CC=CC=C1 OR320048 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.2 Br[Mg]C1=CC=CC=C1 OR320051 [2,0,0,0,0,0|2,0,0]=4 156 B8R1.2 CCC1=CC=CN=C1 OR322379 [2,0,0,0,0,0|1,0,0]=3 157 B8R1.2 CNC1=CC=CC=N1 OR30078 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.2 ClCC1=CC=CN=C1 OR3146 [2,0,0,0,0,0|2,0,0]=4 159 B8R1.2 Cl[Mg]C1=CC=CC=C1 OR320054 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.2 Cl[Mg]C1=CC=CC=C1 OR320055 [2,0,0,0,0,0|2,0,0]=4 161 B8R1.2 FCC1=CC=CC=C1 PC0680 [2,0,0,0,0,0|1,0,0]=3 162 B8R1.2 ICC1=CC=CN=C1 OR470780 [2,0,0,0,0,0|2,0,0]=4 163 B8R1.2 SCC1=CC=NC=C1 OR305435 [2,0,0,0,0,0|1,1,0]=4 164 B8R1.2 SCC1=NC=CC=C1 OR305407 [2,0,0,0,0,0|1,1,0]=4 165 B10R1.13 C=C(C)C1=CC=C(C)C=C1 OR315711 [1,1,0,0,0,0|1,0,1]=4 166 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 OR315710 [1,1,0,0,0,0|1,0,1]=4 167 B10R1.13 C=C(C)C1=CC=C(F)C=C1 PC3828 [1,1,0,0,0,0|1,0,1]=4 168 B10R1.13 CC(=O)C1=CC=C(F)C=C1 PC2887 [1,1,0,0,0,0|0,0,2]=4 169 B10R1.13 CC(=O)C1=CC=C(F)C=C1 PC3380 [1,1,0,0,0,0|0,0,2]=4 170 B10R1.13 CC(Br)C1=CC=C(F)C=C1 PC51144 [1,1,0,0,0,0|1,0,0]=3 171 B10R1.13 CC(C)C1=CC=C(N)C=N1 OR345336 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.13 CC(C)C1=CN=C(N)C=C1 OR323123 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 PC408016 [1,1,0,0,0,0|1,0,0]=3 174 B10R1.13 CC(N)C1=CC=C(Br)C=C1 OR345056 [1,1,0,0,0,0|1,0,0]=3 175 B10R1.13 CC(N)C1=CC=C(F)C=C1 PC3823CM [1,1,0,0,0,0|1,0,0]=3 176 B10R1.13 CC(O)C1=CC=C(F)C=C1 PC4173 [1,1,0,0,0,0|0,0,0]=2 177 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 OR322115 [1,1,0,0,0,0|1,0,0]=3 178 B10R1.13 CN(C)C1=CC=C(F)C=C1 PC501467 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 PC3962 [1,1,0,0,0,0|1,0,0]=3 180 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 OR460032 [1,1,0,0,0,0|0,0,0]=2 181 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 PC0609 [1,1,0,0,0,0|0,0,0]=2 182 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 PC0613 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 OR52303 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 OR480238 [1,1,0,0,0,0|0,0,0]=2 185 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 PC0610 [1,1,0,0,0,0|0,0,0]=2 186 B10R1.13 FC(F)C1=CC=C(Br)C=C1 PC49528 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 PC3444C [1,1,0,0,0,0|2,0,0]=4 188 B10R1.13 FC1=CC=C(C(F)F)C=C1 PC520555 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.13 NC1=CC=C(C(F)F)C=C1 PC57048 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.13 O=C(O)C1=CC=C(F)C=C1 PC3520 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.13 OB(O)C1=CC=C(F)C=C1 PC3482 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.13 OB(O)C1=CC=C(S)C=C1 OR315062 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.13 OC1=CC=C(C(F)F)C=C1 PC201250 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.28 CC(F)(F)C1=CC=CC=C1 PC450090 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.28 CC(F)(F)C1=CC=NC=C1 PC520687 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.28 CC(F)(F)C1=CN=CC=C1 PC520688 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.28 C[Si](Cl)(Cl)C1=CC=CC=C1 OR315169 [1,1,0,0,0,0|1,1,0]=4 198 B10R1.28 FC(Cl)(Cl)C1=CC=CC=C1 PC0692 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.28 FC(F)(Cl)C1=CC=CC=C1 PC0690 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.28 FC(F)(F)C1=CC=CC=C1 PC1190 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.61 CC(=O)C1=C(F)C=CC=C1 PC3360 [1,1,0,0,0,0|0,0,2]=4 202 B10R1.61 CC(N)C1=C(F)C=CC=C1 PC5780 [1,1,0,0,0,0|1,0,0]=3 203 B10R1.61 CC(O)C1=C(F)C=CC=C1 PC4171 [1,1,0,0,0,0|0,0,0]=2 204 B10R1.61 CC1=C(C(F)F)C=CC=C1 PC520309 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.61 CN(C)C1=C(Br)C=CC=C1 OR4343 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.61 CN(C)C1=CC=CC=C1F PC5007 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.61 CS(=O)C1=C(F)C=CC=C1 PC2794 [1,1,0,0,0,0|1,0,1]=4 208 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 PC0611 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 PC0603 [1,1,0,0,0,0|0,0,0]=2 210 B10R1.61 C[C@H](N)C1=CC=CC=C1F PC0612 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 PC0605 [1,1,0,0,0,0|0,0,0]=2 212 B10R1.61 FC(F)C1=C(Br)C=CC=C1 PC01660 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.61 FC1=C(C(Br)Br)C=CC=C1 PC3471 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.61 FC1=C(C(Cl)Cl)C=CC=C1 PC3444A [1,1,0,0,0,0|2,0,0]=4 215 B10R1.61 FC1=CC=CC=C1C(F)F PC520545 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.61 NC1=C(C(F)F)C=CC=C1 PC57056 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.61 O=C(O)C1=C(F)C=CC=C1 PC3500 [1,1,0,0,0,0|1,0,1]=4 218 B10R1.61 OB(O)C1=C(F)C=CC=C1 PC0073 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.61 OB(O)C1=C(S)C=CC=C1 OR360041 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.113 CC(=O)C1=CC(F)=CC=C1 PC3370 [1,1,0,0,0,0|0,0,2]=4 221 B10R1.113 CC(N)C1=CC(F)=CC=C1 PC5782 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.113 CC(O)C1=CC(F)=CC=C1 PC4172 [1,1,0,0,0,0|0,0,0]=2 223 B10R1.113 CC(O)C1=CC(N)=NC=C1 OR302501 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.113 CC(O)C1=CC=CC(Br)=N1 OR303627 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.113 CC(O)C1=NC=CC(Br)=C1 OR471467 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.113 CC1=CC=CC(C(F)F)=C1 PC520310 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.113 CN(C)C1=CC(Cl)=CC=C1 OR29384 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.113 CN(C)C1=CC=CC(F)=C1 PC7857 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 PC9079 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 PC0606 [1,1,0,0,0,0|0,0,0]=2 231 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 PC3143 [1,1,0,0,0,0|1,0,0]=3 232 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 PC0608 [1,1,0,0,0,0|0,0,0]=2 233 B10R1.113 FC(F)C1=CC=CC(Br)=C1 PC50007 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.113 FC1=CC=CC(C(Br)Br)=C1 PC3442 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.113 FC1=CC=CC(C(Cl)Cl)=C1 PC3444B [1,1,0,0,0,0|2,0,0]=4 236 B10R1.113 FC1=CC=CC(C(F)F)=C1 PC520546 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.113 NC1=CC=CC(C(=O)O)=C1 OR322640 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.113 NC1=CC=CC(C(F)F)=C1 PC49148 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.113 O=C(O)C1=CC(F)=CC=C1 PC3510 [1,1,0,0,0,0|1,0,1]=4 240 B10R1.113 OB(O)C1=CC(F)=CC=C1 PC7016 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.113 OB(O)C1=CC=CC(I)=C1 OR303431 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.1 CC1=CC=C(CC#N)C=C1 OR350270 [1,1,0,0,0,0|1,0,1]=4 243 B10R1.1 CC1=CC=C(C[Mg]Cl)C=C1 OR320060 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.1 CCNC1=CC=C(N)C=N1 OR306529 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.1 CCOC1=CC=C(C)N=C1 OR345368 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.1 CCOC1=CC=C(F)C=C1 PC4068B [1,1,0,0,0,0|1,0,0]=3 247 B10R1.1 CCOC1=CC=C(I)C=N1 OR345502 [1,1,0,0,0,0|2,0,0]=4 248 B10R1.1 CCOC1=CC=C(N)C=N1 OR345102 [1,1,0,0,0,0|2,0,0]=4 249 B10R1.1 CCOC1=CC=C(O)C=C1 OR350170 [1,1,0,0,0,0|1,0,0]=3 250 B10R1.1 Cl[Mg]CC1=CC=C(Cl)C=C1 OR320059 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.1 FC1=CC=C(CCBr)C=C1 PC7166 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.1 FC1=CC=C(CCCl)C=C1 PC1812J [1,1,0,0,0,0|1,0,0]=3 253 B10R1.1 FC1=CC=C(C[Mg]Cl)C=C1 PC01533 [1,1,0,0,0,0|2,0,0]=4 254 B10R1.1 FC1=CC=C(C[Mg]Cl)C=C1 PC2833 [1,1,0,0,0,0|2,0,0]=4 255 B10R1.1 FC1=CC=C(C[Zn]Cl)C=C1 PC1821 [1,1,0,0,0,0|2,0,0]=4 256 B10R1.1 N#CCC1=CC=C(F)C=C1 PC4144 [1,1,0,0,0,0|1,0,1]=4 257 B10R1.1 NCCC1=CC=C(N)C=C1 OR350013 [1,1,0,0,0,0|1,0,0]=3 258 B10R1.1 NNCC1=CC=C(Br)C=C1 OR306142 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.1 NNCC1=CC=C(F)C=C1 PC403065 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.1 NNCC1=CC=C(F)C=C1 PC9518 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.1 NOCC1=CC=C(F)C=C1 PC4627 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.1 O=CCC1=CC=C(Br)C=C1 OR200079 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.1 OCCC1=CC=C(F)C=C1 PC4067 [1,1,0,0,0,0|1,0,0]=3 264 B10R1.1 OCCC1=CC=C(I)C=C1 OR301185 [1,1,0,0,0,0|1,0,0]=3 265 B10R1.4 BrCCC1=C(Br)C=CC=C1 OR310964 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.4 C=CCC1=CC=CC=C1O OR28673 [1,1,0,0,0,0|0,0,2]=4 267 B10R1.4 CC1=CC=CC=C1CC#N OR315771 [1,1,0,0,0,0|1,0,1]=4 268 B10R1.4 CC1=CC=CN=C1CCN OR322555 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.4 CCNC1=C(F)C=CC=C1 PC3207 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.4 CCOC1=C(Br)C=CC=N1 OR310089 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.4 CCOC1=C(Br)N=CC=C1 OR345151 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.4 CCOC1=C(C)N=CC=C1 OR345160 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.4 CCOC1=C(Cl)C=CC=N1 OR345280 [1,1,0,0,0,0|2,0,0]=4 274 B10R1.4 CCOC1=C(F)C=CC=C1 PC4068 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.4 CCOC1=C(I)C=CC=N1 OR345138 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.4 CCOC1=C(O)N=CC=C1 OR470655 [1,1,0,0,0,0|2,0,0]=4 277 B10R1.4 CCOC1=CC=CN=C1F PC510249 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.4 CCOC1=CC=NC=C1N OR345032 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.4 CCOC1=CN=CC=C1Br OR345278 [1,1,0,0,0,0|2,0,0]=4 280 B10R1.4 CNCC1=CC=CC=C1F PC201248 [1,1,0,0,0,0|1,0,0]=3 281 B10R1.4 COCC1=CC=CC=C1O OR470757 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.4 FC1=C(C[Mg]Cl)C=CC=C1 PC1897 [1,1,0,0,0,0|2,0,0]=4 283 B10R1.4 FC1=C(C[Zn]Cl)C=CC=C1 PC7193 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.4 FC1=CC=CC=C1CCCl PC510242 [1,1,0,0,0,0|1,0,0]=3 285 B10R1.4 FCCC1=CC=CC=C1I PC450003 [1,1,0,0,0,0|1,0,0]=3 286 B10R1.4 N#CCC1=C(F)C=CC=C1 PC4142 [1,1,0,0,0,0|1,0,1]=4 287 B10R1.4 N#CCC1=C(F)C=CC=C1 PC5652 [1,1,0,0,0,0|1,0,1]=4 288 B10R1.4 N#CCC1=CC=CC=C1N OR322191 [1,1,0,0,0,0|1,0,1]=4 289 B10R1.4 NNCC1=C(F)C=CC=C1 PC49334 [1,1,0,0,0,0|2,0,0]=4 290 B10R1.4 NNCC1=CC=CC=C1Br OR306140 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.4 NNCC1=CC=CC=C1F PC403063 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.4 NOCC1=CC=CC=C1F PC4625 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.4 OCCC1=C(F)C=CC=C1 PC4066 [1,1,0,0,0,0|1,0,0]=3 294 B10R1.10 CC1=CC=CC(CCN)=N1 OR322859 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.10 CC1=CC=CC(C[Mg]Cl)=C1 OR320058 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.10 CCNC1=NC=CC(Cl)=C1 OR322975 [1,1,0,0,0,0|2,0,0]=4 297 B10R1.10 CCOC1=CC(Br)=CC=C1 OR322269 [1,1,0,0,0,0|1,0,0]=3 298 B10R1.10 CCOC1=CC(Br)=CN=C1 OR345277 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.10 CCOC1=CC(F)=CC=C1 PC8850 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.10 CCOC1=CC(F)=NC=C1 PC201174 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.10 CNCC1=CC(F)=CC=C1 PC201369 [1,1,0,0,0,0|1,0,0]=3 302 B10R1.10 CNCC1=NC=CC(Cl)=C1 OR302206 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.10 COCC1=CC=NC(Cl)=C1 OR302289 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.10 FC1=CC=CC(CCBr)=C1 PC4528 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.10 FC1=CC=CC(C[Mg]Cl)=C1 PC1363 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.10 FC1=CC=CC(C[Zn]Cl)=C1 PC9144 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.10 N#CCC1=CC(F)=CC=C1 PC4143 [1,1,0,0,0,0|1,0,1]=4 308 B10R1.10 N#CCC1=CC=CC(Cl)=C1 OR350081 [1,1,0,0,0,0|1,0,1]=4 309 B10R1.10 NNCC1=CC=CC(Br)=C1 OR306141 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.10 NNCC1=CC=CC(F)=C1 PC403064 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.10 NOCC1=CC=CC(F)=C1 PC4626 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.10 OCCC1=CC(F)=CC=C1 PC5701 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.10 OCCC1=CC=CC(Br)=N1 OR471389 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.17 BrCCSC1=CC=CC=C1 OR322375 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.17 CCNCC1=CC=CC=N1 OR315116 [1,1,0,0,0,0|1,0,0]=3 316 B10R1.17 CCNCC1=CC=CN=C1 OR318059 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.17 CCNCC1=CC=NC=C1 OR315114 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.17 CNCCC1=CN=CC=C1 OR12532 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.17 N#CCSC1=CC=CC=C1 OR30082 [1,1,0,0,0,0|1,0,1]=4 320 B10R1.17 NCCCC1=CC=NC=C1 OR303785 [1,1,0,0,0,0|1,0,0]=3 321 B10R1.17 OCCCC1=CC=CN=C1 OR303919 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.17 OCCCC1=CC=NC=C1 OR350323 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.17 SCCCC1=CC=CN=C1 OR305417 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.17 SCCCC1=CC=NC=C1 OR305416 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.17 SCCCC1=NC=CC=C1 OR305418 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.18 CC(=O)CC1=CC=CN=C1 OR302610 [1,1,0,0,0,0|1,0,1]=4 327 B10R1.18 CC(=O)CC1=CC=NC=C1 OR9025 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.18 CC(C)CC1=CC=NC=C1 OR470882 [1,1,0,0,0,0|1,0,0]=3 329 B10R1.18 CC(C)OC1=CC=CC=C1 OR25710 [1,1,0,0,0,0|1,0,0]=3 330 B10R1.18 CC(C)OC1=CN=CC=C1 OR321022 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.18 CC(N)CC1=CC=CN=C1 OR322554 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.18 C[C@H](O)CC1=CC=CC=C1 OR304049 [1,1,0,0,0,0|0,0,0]=2 333 B10R1.18 FC(F)CC1=CC=CC=C1 PC49564 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.18 FC(F)OC1=CC=CC=C1 PC4117 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.18 NC(=S)CC1=CC=CC=C1 OR346049 [1,1,0,0,0,0|1,0,1]=4 336 B10R1.9 COC(CN)C1=CC=CS1 OR322399 [0,1,0,0,1,0|2,0,0]=4 337 B12R1.34 N[C@@H](CO)[C@@H](O)C1=CC=CC=C1 OR322214 [0,1,0,0,0,1|2,0,0]=4 338 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 OR322610 [0,1,0,0,0,1|2,0,0]=4 339 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 OR303137 [0,1,0,0,0,1|0,0,2]=4 340 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 OR322015 [0,1,0,0,0,1|1,0,1]=4 341 B12R1.49 CC(CBr)OC1=CC=C(F)C=C1 PC53528 [0,1,0,0,0,1|2,0,0]=4 342 B12R1.118 N#CC(CO)CC1=CC=CC=C1 OR470632 [0,1,0,0,0,1|1,0,1]=4 343 B12R1.371 CCC(=O)NC1=CC=CC=C1C OR111521 [0,1,0,0,0,1|0,0,2]=4 344 B12R1.9 CC(O)(CN)C1=CC=C(Cl)C=C1 OR309431 [0,2,0,0,0,0|1,0,0]=3 345 B12R1.9 CCC(F)(F)C1=CC=C(Br)C=C1 PC520724 [0,2,0,0,0,0|1,0,0]=3 346 B12R1.9 CCS(=O)(=O)C1=CC=C(F)C=C1 PC53511 [0,2,0,0,0,0|1,0,1]=4 347 B12R1.9 FC(F)(CBr)C1=CC=C(Br)C=C1 PC2361 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.9 FC1=CC=C(C(F)(F)CBr)C=C1 PC2362 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.9 OCC(F)(F)C1=CC=C(Br)C=C1 PC520828 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.39 CCCC(F)(F)C1=CC=CC=C1 PC49567 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 OR12676 [0,2,0,0,0,0|1,0,1]=4 352 B12R1.39 O=S(=O)(CCO)C1=CC=CC=C1 OR10975 [0,2,0,0,0,0|1,0,1]=4 353 B12R1.195 CC1=C(C(F)(F)CN)C=CC=C1 PC450019 [0,2,0,0,0,0|2,0,0]=4 354 B12R1.195 CC1=C(C(F)(F)CO)C=CC=C1 PC450038 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.195 OCC(F)(F)C1=CC=CC=C1Br PC520829 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.195 OCC(F)(F)C1=CC=CC=C1F PC510209 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.253 CC(C)C(F)(F)C1=CC=CC=C1 PC49565 [0,2,0,0,0,0|1,0,0]=3 358 B12R1.253 CC(O)(C1=CC=CC=C1)C(F)F PC51087 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.475 COP(=O)(OC)C1=CC=CC=C1 OR322065 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.3 CCNC(C#N)C1=CC=CC=C1 OR300806 [0,2,0,0,0,0|1,0,0]=3 361 B12R1.3 CCNC(C#N)C1=CC=CC=C1 OR300852 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 OR307789 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.12 CNC(C#N)C1=CC=C(C)C=C1 OR300799 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.12 CNC(C#N)C1=CC=C(C)C=C1 OR300846 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.12 CNC(C#N)C1=CC=C(Cl)C=C1 OR300797 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.12 CNC(C#N)C1=CC=C(Cl)C=C1 OR300844 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.12 COC(OC)C1=CC=C(N)C=C1 OR55356 [0,2,0,0,0,0|1,0,0]=3 368 B12R1.12 O\N=C(/CBr)C1=CC=C(F)C=C1 PC31879 [0,2,0,0,0,0|1,0,1]=4 369 B12R1.13 CCN(CC)C1=CC=CC(N)=C1 OR470891 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.13 COC(OC)C1=CC=CC(N)=C1 OR55352 [0,2,0,0,0,0|1,0,0]=3 371 B12R1.243 CCC(NC)C1=CC=CC=C1F PC6297 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.243 COC(OC)C1=C(F)C=CC=C1 PC57020 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.243 COC(OC)C1=C(N)C=CC=C1 OR55350 [0,2,0,0,0,0|1,0,0]=3 374 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 OR300788 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 OR300801 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 PC6692 [0,2,0,0,0,0|0,0,2]=4 377 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 PC48548 [0,2,0,0,0,0|1,0,0]=3 378 B12R1.16 CCOC(=N)C1=CC=C(Cl)C=C1 OR300715 [0,2,0,0,0,0|1,0,1]=4 379 B12R1.16 CCOC(=N)C1=CC=C(F)C=C1 PC401015 [0,2,0,0,0,0|1,0,1]=4 380 B12R1.16 CCOC(=N)C1=CC=C(O)C=C1 OR322256 [0,2,0,0,0,0|1,0,1]=4 381 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 OR28772 [0,2,0,0,0,0|0,0,2]=4 382 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 PC3230 [0,2,0,0,0,0|0,0,2]=4 383 B12R1.16 CN(CCO)C1=CC=C(N)C=C1 OR302380 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 OR350192 [0,2,0,0,0,0|0,0,0]=2 385 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 PC201269 [0,2,0,0,0,0|1,0,0]=3 386 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 OR350365 [0,2,0,0,0,0|1,0,0]=3 387 B12R1.16 N[C@H](CCO)C1=CC=C(Br)C=C1 OR313031 [0,2,0,0,0,0|1,0,0]=3 388 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 PC10384 [0,2,0,0,0,0|0,0,2]=4 389 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 OR471082 [0,2,0,0,0,0|0,0,2]=4 390 B12R1.17 CCOC(=N)C1=CC(Cl)=CC=C1 OR300734 [0,2,0,0,0,0|1,0,1]=4 391 B12R1.17 CCOC(=O)C1=CC(F)=CC=C1 PC3220 [0,2,0,0,0,0|0,0,2]=4 392 B12R1.30 NCCNC(=O)C1=CC=CC=C1 OR318004 [0,2,0,0,0,0|0,0,2]=4 393 B12R1.107 CC(C)CC(N)C1=CC=CN=C1 OR470279 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.107 CC(C)CC(N)C1=CC=NC=C1 OR470278 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 PC0503 [0,2,0,0,0,0|0,0,2]=4 396 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 BICR106 [0,2,0,0,0,0|1,0,1]=4 397 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 PC3210 [0,2,0,0,0,0|0,0,2]=4 398 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 PC421167 [0,2,0,0,0,0|0,0,2]=4 399 B12R1.5 COC1=CC=C(C(O)CN)C=C1 OR300036 [0,2,0,0,0,0|1,0,0]=3 400 B12R1.5 N#CC1=CC=C(C(O)CBr)C=C1 OR400491 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.20 CC(C)C(=O)C1=CC=C(F)C=C1 PC9071 [0,2,0,0,0,0|0,0,2]=4 402 B12R1.20 CC(C)[C@@H](N)C1=CC=C(F)C=C1 PC48546 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 PC48547 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.20 CC(Cl)C(=O)C1=CC=C(F)C=C1 PC0087 [0,2,0,0,0,0|0,0,2]=4 405 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 PC3817A [0,2,0,0,0,0|1,0,1]=4 406 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(Br)C=C1 OR310335 [0,2,0,0,0,0|1,0,1]=4 407 B12R1.367 CCC(=O)C1=CC(Br)=C(F)C=C1 PC7411 [0,2,0,0,0,0|0,0,2]=4 408 B12R1.367 CCC(=O)C1=CC(Cl)=C(O)C=C1 OR22406 [0,2,0,0,0,0|0,0,2]=4 409 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 PC2883 [0,2,0,0,0,0|0,0,2]=4 410 B12R1.367 CCC(=O)C1=CC=C(Cl)C(F)=C1 PC302781 [0,2,0,0,0,0|0,0,2]=4 411 B12R1.367 CCC(=O)C1=CC=C(F)C(Cl)=C1 PC8168 [0,2,0,0,0,0|0,0,2]=4 412 B12R1.367 CCC(O)C1=C[N+]([O-])=C(C)C=C1 OR307241 [0,2,0,0,0,0|1,0,0]=3 413 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 PC421192 [0,2,0,0,0,0|1,0,0]=3 414 B12R1.367 O[C@H](CCl)C1=CC(F)=C(F)C=C1 PC421194 [0,2,0,0,0,0|1,0,0]=3 415 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 PC2880 [0,2,0,0,0,0|0,0,2]=4 416 B12R1.1703 CC[C@@H](N)C1=C(F)C=C(F)C=C1 PC48553 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.24 CCC(=O)C1=C(F)C(F)=CC=C1 PC2879 [0,2,0,0,0,0|0,0,2]=4 418 B12R1.225 CC(Br)C(=O)C1=CC(F)=CC=C1 PC502288 [0,2,0,0,0,0|0,0,2]=4 419 B12R1.225 CC(C)C(=O)C1=CC=CC(Br)=C1 OR315509 [0,2,0,0,0,0|0,0,2]=4 420 B12R1.354 CCC(=O)C1=C(F)C=CC(F)=C1 PC2881 [0,2,0,0,0,0|0,0,2]=4 421 B12R1.354 CCC(=O)C1=C(O)C=CC(F)=C1 PC9810 [0,2,0,0,0,0|0,0,2]=4 422 B12R1.354 CCC(=O)C1=CC(O)=CC=C1O OR22401 [0,2,0,0,0,0|0,0,2]=4 423 B12R1.358 CCC(=O)C1=CC(Cl)=CC(F)=C1 PC302774 [0,2,0,0,0,0|0,0,2]=4 424 B12R1.358 CCC(=O)C1=CC(F)=CC(F)=C1 PC2884 [0,2,0,0,0,0|0,0,2]=4 425 B12R1.358 CCC(N)C1=CC(F)=CC(F)=C1 PC3485 [0,2,0,0,0,0|1,0,0]=3 426 B12R1.358 CCC(O)C1=CC(F)=CC(F)=C1 PC6639 [0,2,0,0,0,0|0,0,0]=2 427 B12R1.358 CC[C@@H](N)C1=CC(F)=CC(F)=C1 PC48551 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.358 CC[C@H](N)C1=CC(F)=CC(F)=C1 PC48552 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.358 NCC(O)C1=CC(Cl)=CC(Cl)=C1 OR12813 [0,2,0,0,0,0|1,0,0]=3 430 B12R1.124 CC(Br)C(=O)C1=C(F)C=CC=C1 PC7689 [0,2,0,0,0,0|0,0,2]=4 431 B12R1.124 CC(C)C(O)C1=CN=CC=C1Cl OR303897 [0,2,0,0,0,0|1,0,0]=3 432 B12R1.124 O=C(O)C(O)C1=C(F)C=CC=C1 PC10363 [0,2,0,0,0,0|1,0,1]=4 433 B12R1.124 O=C(O)[C@@H](O)C1=CC=CC=C1Cl OR315006 [0,2,0,0,0,0|1,0,1]=4 434 B12R1.124 O=C(O)[C@H](O)C1=CC=CC=C1Cl OR315005 [0,2,0,0,0,0|1,0,1]=4 435 B12R1.564 CC(C1=CC=CC=C1)C(F)(F)F PC520642 [0,2,0,0,0,0|2,0,0]=4 436 B12R1.564 FC(C1=CC=CC=C1)C(F)(F)F PC50000 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.564 FC(F)(Br)C(Br)C1=CC=CC=C1 PC450183 [0,2,0,0,0,0|2,0,0]=4 438 B12R1.564 FC(F)(F)C(Br)C1=CC=CC=C1 PC48327 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.564 NC(C1=CC=CC=C1)C(F)(F)F PC520790 [0,2,0,0,0,0|2,0,0]=4 440 B12R1.564 OC(C1=CC=CC=C1)C(F)(F)Br PC450099 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.564 OC(C1=CC=CC=C1)C(F)(F)F PC6224 [0,2,0,0,0,0|1,0,0]=3 442 B12R1.564 O[C@@H](C1=CC=CC=C1)C(F)(F)F PC0769 [0,2,0,0,0,0|1,0,0]=3 443 B12R1.564 O[C@H](C1=CC=CC=C1)C(F)(F)F PC0788 [0,2,0,0,0,0|1,0,0]=3 444 B12R1.3441 CCC(=O)C1=C(F)C=CC=C1F PC2882 [0,2,0,0,0,0|0,0,2]=4 445 B12R1.3441 CCC(=O)C1=C(O)C=CC=C1F PC501294 [0,2,0,0,0,0|0,0,2]=4 446 B12R1.3441 CC[C@@H](N)C1=C(F)C=CC=C1F PC48554 [0,2,0,0,0,0|1,0,0]=3 447 B10R2.6 C1=CC=C(C2CC2)C=C1 OR24951 [1,0,0,1,0,0|1,0,0]=3 448 B10R2.6 [C@H]1(C2=CC=CC=C2)CO1 OR5172 [1,0,0,1,0,0|0,0,0]=2 449 B10R2.7 C1=CC2=C(N=C1)NCC2 OR345007 [1,0,0,1,0,0|2,0,0]=4 450 B10R2.7 C1=CN=C2CCNC2=C1 OR305602 [1,0,0,1,0,0|2,0,0]=4 451 B10R2.16 NC1(C2=CC=CO2)CC1 OR302305 [0,0,0,1,1,0|2,0,0]=4 452 B12R2.18 O[C@@H]1C2=C(C=CC=C2)C[C@H]1Br OR350053 [0,0,0,1,0,1|2,0,0]=4 453 B12R2.32 CCC1=NC2=C(C=CC=N2)O1 OR110179 [0,0,0,1,0,1|1,0,1]=4 454 B12R2.32 CCC1=NC2=CC=CC=C2S1 OR110339 [0,0,0,1,0,1|0,1,1]=4 455 B12R2.32 CCC1=NC2=CC=CN=C2O1 OR470465 [0,0,0,1,0,1|1,0,1]=4 456 B12R2.32 NCC1=NC2=CC=CC=C2O1 OR470756 [0,0,0,1,0,1|1,0,1]=4 457 B12R2.32 OC[C@@H]1CC2=CC=CC=C2N1 OR316029 [0,0,0,1,0,1|2,0,0]=4 458 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 OR451029 [0,0,0,1,0,1|2,0,0]=4 459 B12R2.2058 C1=CC=C(NC2COC2)C=C1 OR312180 [0,0,0,1,0,1|2,0,0]=4 460 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 OR317223 [0,0,0,1,0,1|2,0,0]=4 461 B12R2.48 O=CC1(C2=CC=CC=C2)CC1 OR310885 [0,1,0,1,0,0|0,0,1]=3 462 B12R2.116 CC1(C2=CC=CC=C2)COC1 OR309092 [0,1,0,1,0,0|1,0,0]=3 463 B12R2.116 FC1(C2=CC=CC=C2)COC1 PC406007 [0,1,0,1,0,0|1,0,0]=3 464 B12R2.116 NC1(C2=CC=CC=C2)CCC1 OR451172 [0,1,0,1,0,0|1,0,0]=3 465 B12R2.116 OC1(C2=CC=CC=C2)CNC1 OR317221 [0,1,0,1,0,0|0,0,0]=2 466 B12R2.116 OC1(C2=CC=CC=C2)COC1 OR309070 [0,1,0,1,0,0|0,0,0]=2 467 B12R2.116 OC1(C2=CC=CC=C2)CSC1 OR312066 [0,1,0,1,0,0|0,0,0]=2 468 B12R2.116 OC1(C2=CC=CN=C2)COC1 OR312033 [0,1,0,1,0,0|1,0,0]=3 469 B12R2.1 NCC1CNC2=C1C=CC=C2 OR470603 [0,1,0,1,0,0|2,0,0]=4 470 B12R2.1 OCC1CCC2=C1C=CC=C2 OR471023 [0,1,0,1,0,0|0,0,0]=2 471 B12R2.2 C1=CC(C2NCCS2)=CC=N1 OR303600 [0,1,0,1,0,0|1,1,0]=4 472 B12R2.2 C1=CC=C(C2=NCCC2)C=C1 OR480240 [0,1,0,1,0,0|1,0,1]=4 473 B12R2.2 C1=CC=C([S+]2CCCC2)C=C1 PC8842 [0,1,0,1,0,0|2,0,0]=4 474 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 OR307589 [0,1,0,1,0,0|1,0,1]=4 475 B12R2.1081 CN1CCOC2=C1C=CC=C2 OR111299 [0,1,0,1,0,0|2,0,0]=4 476 B12R2.1081 FC1CNCC2=C1C=CC=C2 PC8299 [0,1,0,1,0,0|1,0,0]=3 477 B12R2.1081 OC1CCCC2=C1N=CC=C2 OR470051 [0,1,0,1,0,0|1,0,0]=3 478 B12R2.2028 O[C@H]1C[C@@H](O)C2=CC=CC=C21 OR12575 [0,1,0,1,0,0|0,0,0]=2 479 B12R2.2075 OC(C1=CC=CN=C1)C2CC2 OR470430 [0,1,0,1,0,0|1,0,0]=3 480 B12R2.290 NC1(C2=CC=C(Br)N=C2)CC1 OR480117 [0,1,0,1,0,0|2,0,0]=4 481 B12R2.290 NC1(C2=CC=C(Cl)N=C2)CC1 OR480091 [0,1,0,1,0,0|2,0,0]=4 482 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 PC48597 [0,1,0,1,0,0|1,0,0]=3 483 B12R2.290 NC1(C2=CC=C(F)N=C2)CC1 PC520357 [0,1,0,1,0,0|2,0,0]=4 484 B12R2.290 NC1(C2=NC=C(Cl)C=C2)CC1 OR480085 [0,1,0,1,0,0|2,0,0]=4 485 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 PC201023 [0,1,0,1,0,0|1,0,0]=3 486 B12R2.612 O=C1CCC2=CC(F)=CC=C12 PC3757 [0,1,0,1,0,0|0,0,2]=4 487 B12R2.612 OC1CCC2=C1C=CC(Br)=C2 OR110851 [0,1,0,1,0,0|0,0,0]=2 488 B12R2.2302 FC1=CC=C(C2COC2)C=C1 PC405518 [0,1,0,1,0,0|2,0,0]=4 489 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 OR471348 [0,1,0,1,0,0|2,0,0]=4 490 B12R2.132 NC1=CC2=C(C=C1)COB2O OR360633 [0,1,0,1,0,0|2,0,0]=4 491 B12R2.132 NC1CCC2=C1C=C(F)C=C2 PC201045 [0,1,0,1,0,0|1,0,0]=3 492 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 PC201132 [0,1,0,1,0,0|1,0,0]=3 493 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 OR301318 [0,1,0,1,0,0|0,0,2]=4 494 B12R2.132 O=C1CCC2=CC=C(F)C=C12 PC2137 [0,1,0,1,0,0|0,0,2]=4 495 B12R2.196 N[C@@H]1CCC2=C(F)C=CC=C21 PC48530 [0,1,0,1,0,0|1,0,0]=3 496 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 PC48531 [0,1,0,1,0,0|1,0,0]=3 497 B12R2.196 O=C1CCC2=C1C=CC=C2Cl OR301320 [0,1,0,1,0,0|0,0,2]=4 498 B12R2.196 O=C1CCC2=C1C=CC=C2F PC1783 [0,1,0,1,0,0|0,0,2]=4 499 B12R2.1282 NC1(C2=CC(Br)=NC=C2)CC1 OR480115 [0,1,0,1,0,0|2,0,0]=4 500 B12R2.1282 NC1(C2=CC(Cl)=CN=C2)CC1 OR480090 [0,1,0,1,0,0|2,0,0]=4 501 B12R2.1282 NC1(C2=CC(Cl)=NC=C2)CC1 OR480084 [0,1,0,1,0,0|2,0,0]=4 502 B12R2.1282 NC1(C2=CC(F)=CN=C2)CC1 PC520356 [0,1,0,1,0,0|2,0,0]=4 503 B12R2.1282 NC1(C2=CC(F)=NC=C2)CC1 PC520359 [0,1,0,1,0,0|2,0,0]=4 504 B12R2.1282 NC1(C2=CC=CC(F)=C2)CC1 PC408074 [0,1,0,1,0,0|1,0,0]=3 505 B12R2.1282 NC1(C2=NC(F)=CC=C2)CC1 PC520352 [0,1,0,1,0,0|2,0,0]=4 506 B12R2.1282 NC1(C2=NC=CC(Cl)=C2)CC1 OR480086 [0,1,0,1,0,0|2,0,0]=4 507 B12R2.1282 NC1(C2=NC=CC(F)=C2)CC1 PC520353 [0,1,0,1,0,0|2,0,0]=4 508 B12R2.2313 BrC1=CC=CC(C2COC2)=C1 OR312164 [0,1,0,1,0,0|2,0,0]=4 509 B12R2.2313 BrC1=CC=NC(C2CCC2)=C1 OR305557 [0,1,0,1,0,0|2,0,0]=4 510 B12R2.92 CC1(C)NC1C2=CC=CC=C2 OR340191 [0,1,0,1,0,0|1,0,0]=3 511 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 OR350128 [0,1,0,1,0,0|2,0,0]=4 512 B12R2.88 NC1(C2=C(Br)C=CN=C2)CC1 OR480116 [0,1,0,1,0,0|2,0,0]=4 513 B12R2.88 NC1(C2=C(Br)C=NC=C2)CC1 OR480114 [0,1,0,1,0,0|2,0,0]=4 514 B12R2.88 NC1(C2=C(Cl)C=CN=C2)CC1 OR480088 [0,1,0,1,0,0|2,0,0]=4 515 B12R2.88 NC1(C2=C(Cl)C=NC=C2)CC1 OR480083 [0,1,0,1,0,0|2,0,0]=4 516 B12R2.88 NC1(C2=C(F)C=CN=C2)CC1 PC520355 [0,1,0,1,0,0|2,0,0]=4 517 B12R2.88 NC1(C2=C(F)C=NC=C2)CC1 PC520358 [0,1,0,1,0,0|2,0,0]=4 518 B12R2.88 NC1(C2=CC=CC=C2F)CC1 PC49539 [0,1,0,1,0,0|1,0,0]=3 519 B12R2.88 NC1(C2=CC=CN=C2Cl)CC1 OR480089 [0,1,0,1,0,0|2,0,0]=4 520 B12R2.88 NC1(C2=CC=CN=C2F)CC1 PC520354 [0,1,0,1,0,0|2,0,0]=4 521 B12R2.88 NC1(C2=NC=CC=C2Cl)CC1 OR480087 [0,1,0,1,0,0|2,0,0]=4 522 B12R2.203 O=C1CCC2=CC=CC(F)=C12 PC2136 [0,1,0,1,0,0|0,0,2]=4 523 B12R2.517 NC1=C(C2CCC2)N=CC=C1 OR306646 [0,1,0,1,0,0|2,0,0]=4 524 B12R2.517 NC1=CC=NC=C1C2CCC2 OR306648 [0,1,0,1,0,0|2,0,0]=4 525 B12R2.517 OC1=CC=CC=C1C2COC2 OR312165 [0,1,0,1,0,0|2,0,0]=4 526 B8R1.7 CC(O)C1=CC=CO1 OR28933 [1,0,0,0,1,0|1,0,0]=3 527 B8R1.8 CNCC1=CC=CO1 OR110977 [1,0,0,0,1,0|2,0,0]=4 528 B8R1.8 CNCC1=COC=C1 OR110085 [1,0,0,0,1,0|2,0,0]=4 529 B12R1.27 NCC(O)COC1=CC=CC=C1 OR322020 [0,0,0,0,0,2|1,0,0]=3