0 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.15 N#CC(N)C1=CC=NC=C1 F-4703 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [1,0,0,0,0,0|1,0,1]=3 26 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.6 CC(N)C1=CC=NC=N1 Q51822 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.6 CC(N)C1=CC=NN=C1 G-7533 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.6 CC(N)C1=CC=NN=C1 L13924 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.6 CC(N)C1=CN=CN=C1 G-5168 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.6 CC(N)C1=CN=CN=C1 Q51812 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.6 CC(N)C1=NC=CC=N1 Q55479 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.6 CC(O)C1=CN=CN=C1 Q55478 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.6 C[C@@H](N)C1=CN=CN=C1 I-9747 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.6 C[C@@H](N)C1=NC=CC=N1 Q57196 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.6 C[C@H](N)C1=CN=CN=C1 Q51933 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q57195 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q65669 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.8 N#CCC1=CC=NC=C1 P41732 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.8 NNCC1=CC=CN=C1 O31533 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.8 NNCC1=CC=NC=C1 C-3253 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.8 NNCC1=CC=NC=C1 L13556 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.8 NNCC1=CC=NC=C1 O32212 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.8 NNCC1=CN=CC=C1 C-3254 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.8 NNCC1=NC=CC=C1 C-3255 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.8 NNCC1=NC=CC=C1 O31423 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.8 O=C=NC1=NC=CC=C1 P43266 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,0,0,0,0,0|1,0,0]=2 63 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,0,0,0,0,0|1,0,2]=4 64 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,0,0,0,0,0|1,0,2]=4 65 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 O32008 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.7 CC(C)(CN)C1=CC=CC=C1 P39760 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Q54944 [0,1,0,0,0,0|1,0,2]=4 68 B11R1.7 CC(N)(CO)C1=CC=CC=C1 P35233 [0,1,0,0,0,0|0,0,2]=3 69 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 M15334 [0,1,0,0,0,0|1,0,1]=3 70 B11R1.16 C=CCC(O)C1=NC=CC=C1 L20408 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.16 CC(CCN)C1=CC=CC=C1 P38414 [0,1,0,0,0,0|1,0,1]=3 72 B11R1.16 CC(CCN)C1=CC=NC=C1 Q58360 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.16 CCCC(N)C1=CC=CC=C1 P39016 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58232 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58233 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.16 CNCC(C)C1=CC=CC=C1 P37180 [0,1,0,0,0,0|1,0,1]=3 77 B11R1.16 COCC(N)C1=CC=CC=C1 P40515 [0,1,0,0,0,0|1,0,2]=4 78 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 P35167 [0,1,0,0,0,0|1,0,2]=4 79 B11R1.16 COC[C@H](N)C1=CC=CC=C1 P36845 [0,1,0,0,0,0|1,0,2]=4 80 B11R1.16 NCCC(O)C1=CC=CC=C1 P37784 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 P35908 [0,1,0,0,0,0|1,0,2]=4 82 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 P40616 [0,1,0,0,0,0|1,0,2]=4 83 B11R1.22 C#CC(O)C1=CC=C(Cl)C=C1 P38985 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [0,1,0,0,0,0|1,0,1]=3 85 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [0,1,0,0,0,0|1,0,1]=3 87 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [0,1,0,0,0,0|1,0,1]=3 88 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 P40808 [0,1,0,0,0,0|1,0,1]=3 91 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,1,0,0,0,0|1,0,2]=4 92 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,1,0,0,0,0|1,0,2]=4 94 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,1,0,0,0,0|1,0,2]=4 95 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [0,1,0,0,0,0|2,0,1]=4 100 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,1,0,0,0,0|1,0,2]=4 101 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,1,0,0,0,0|1,0,2]=4 102 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,1,0,0,0,0|1,0,2]=4 103 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,1,0,0,0,0|1,0,2]=4 107 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,1,0,0,0,0|1,0,2]=4 108 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,1,0,0,0,0|1,0,2]=4 109 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,1,0,0,0,0|1,0,2]=4 110 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,1,0,0,0,0|1,0,2]=4 111 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,1,0,0,0,0|1,0,2]=4 112 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 P35986 [0,1,0,0,0,0|1,0,1]=3 113 B11R1.23 C#CC(O)C1=CC=CC(Cl)=C1 P38984 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.23 C#CC(O)C1=CC=CC(F)=C1 O31432 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,1,0,0,0,0|1,0,2]=4 116 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,1,0,0,0,0|1,0,2]=4 118 B11R1.23 CCC(N)C1=CC=CC(Cl)=C1 P38298 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,1,0,0,0,0|1,0,2]=4 121 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,1,0,0,0,0|1,0,2]=4 122 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,1,0,0,0,0|1,0,2]=4 123 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,1,0,0,0,0|1,0,2]=4 128 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,1,0,0,0,0|1,0,2]=4 129 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,1,0,0,0,0|1,0,2]=4 130 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,1,0,0,0,0|1,0,2]=4 131 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,1,0,0,0,0|1,0,2]=4 132 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,1,0,0,0,0|1,0,2]=4 133 B11R1.36 CC(C(=O)O)C1=CC=CN=C1 O29526 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.36 CC(C(=O)O)C1=NC=CC=C1 O29926 [0,1,0,0,0,0|1,0,0]=2 135 B11R1.36 CC(C)C(C)C1=CC=CC=C1 P43269 [0,1,0,0,0,0|1,0,1]=3 136 B11R1.36 CC(C)C(N)C1=CC=CC=C1 P36744 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 P37697 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 Q63762 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.36 NC(C(=O)O)C1=CN=CN=C1 Q63768 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 Q63763 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.36 N[C@@H](C(=O)O)C1=CN=CN=C1 Q63769 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.36 N[C@H](C(=O)O)C1=CC=NC=C1 Q63764 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.36 N[C@H](C(=O)O)C1=CN=CN=C1 Q63770 [0,1,0,0,0,0|3,0,0]=4 144 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58337 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58338 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.222 C#CC(O)C1=CC=CC=C1Cl P40184 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,1,0,0,0,0|1,0,2]=4 148 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.222 CCC(N)C1=CC=CC=C1C P37948 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.222 CCC(N)C1=CC=CC=C1Cl Q66027 [0,1,0,0,0,0|2,0,1]=4 151 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,1,0,0,0,0|1,0,2]=4 152 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,1,0,0,0,0|1,0,2]=4 153 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,1,0,0,0,0|1,0,2]=4 154 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,1,0,0,0,0|2,0,1]=4 155 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,1,0,0,0,0|1,0,2]=4 158 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,1,0,0,0,0|1,0,2]=4 159 B11R2.1 BrC1=COC2=CC=CC=C12 O30635 [0,0,0,1,0,0|1,0,2]=4 160 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,0,0,1,0,0|1,0,1]=3 161 B11R2.1 CC1=CNC2=C1C=CN=C2 P44359 [0,0,0,1,0,0|2,0,1]=4 162 B11R2.1 CC1=CNC2=C1C=NC=C2 L21593 [0,0,0,1,0,0|2,0,1]=4 163 B11R2.1 CC1=CNC2=CC=CN=C12 O30970 [0,0,0,1,0,0|2,0,1]=4 164 B11R2.1 CC1=CNC2=NC=CC=C12 G-5971 [0,0,0,1,0,0|2,0,1]=4 165 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,0,0,1,0,0|2,0,1]=4 166 B11R2.1 CC1=NOC2=CC=CC=C21 O30125 [0,0,0,1,0,0|1,0,2]=4 167 B11R2.1 CN1C=CC2=C1C=NC=C2 P45066 [0,0,0,1,0,0|3,0,0]=4 168 B11R2.1 CN1C=CC2=C1N=CC=C2 P44494 [0,0,0,1,0,0|3,0,0]=4 169 B11R2.1 CN1C=NC2=C1C=CN=C2 Q53288 [0,0,0,1,0,0|3,0,0]=4 170 B11R2.1 ClC1=CNC2=C1C=CC=C2 L14683 [0,0,0,1,0,0|2,0,1]=4 171 B11R2.1 NC1=CNC2=C1C=CC=C2 O32345 [0,0,0,1,0,0|2,0,1]=4 172 B11R2.1 NC1=CNC2=C1C=CC=C2 O32346 [0,0,0,1,0,0|2,0,1]=4 173 B11R2.1 NC1=CSC2=CC=CC=C12 O29978 [0,0,0,1,0,0|1,1,1]=4 174 B11R2.1 OC1=CNC2=CC=CC=C12 Q52523 [0,0,0,1,0,0|2,0,1]=4 175 B11R2.4 NC1CC1C2=CC=CC=C2 Q54793 [0,0,0,1,0,0|1,0,1]=3 176 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 L14213 [0,0,0,1,0,0|1,0,1]=3 177 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 L22363 [0,0,0,1,0,0|1,0,1]=3 178 B11R2.40 NC1(C2=CC=CC=C2)CC1 P38187 [0,0,0,1,0,0|2,0,1]=4 179 B11R2.239 C1=CC=C(C2CCN2)C=C1 O28163 [0,0,0,1,0,0|2,0,0]=3 180 B11R2.239 C1=CC=C(C2CNC2)C=C1 10749 [0,0,0,1,0,0|1,0,1]=3 181 B11R2.239 C1=CC=C(C2CNC2)C=C1 M22666 [0,0,0,1,0,0|1,0,1]=3 182 B11R2.239 C1=CN=C(C2CNC2)C=C1 P46398 [0,0,0,1,0,0|2,0,1]=4 183 B9R1.11 O=CC(=O)C1=CC=CS1 P41441 [0,0,0,0,1,0|2,0,1]=4 184 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 P51547 [0,0,0,0,0,1|2,0,0]=3 185 B11R1.40 CC(C#N)NC1=CC=CC=C1 M15456 [0,0,0,0,0,1|1,0,1]=3 186 B11R1.40 CC(CN)OC1=CC=CC=C1 P36860 [0,0,0,0,0,1|1,0,1]=3 187 B11R1.40 CC(CN)SC1=CC=CC=N1 Q58359 [0,0,0,0,0,1|2,0,1]=4 188 B11R1.40 CCC(N)CC1=CC=CC=C1 P38928 [0,0,0,0,0,1|2,0,1]=4 189 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [0,0,0,0,0,1|1,0,2]=4 190 B8R1.2 BrCC1=CC=CN=C1 P36550 [2,0,0,0,0,0|2,0,0]=4 191 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [2,0,0,0,0,0|2,0,0]=4 192 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [2,0,0,0,0,0|2,0,0]=4 193 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [2,0,0,0,0,0|2,0,0]=4 196 B8R1.2 C=CC1=CC=CN=C1 O30687 [2,0,0,0,0,0|1,0,1]=4 197 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|1,0,0]=3 198 B8R1.2 NCC1=CC=NC=C1 O30621 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [1,1,0,0,0,0|1,0,1]=4 200 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [1,1,0,0,0,0|1,0,1]=4 201 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [1,1,0,0,0,0|1,0,1]=4 202 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [1,1,0,0,0,0|1,0,1]=4 203 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [1,1,0,0,0,0|1,0,1]=4 206 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [1,1,0,0,0,0|1,0,0]=3 208 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.13 CC(C)C1=CN=C(N)C=C1 O34069 [1,1,0,0,0,0|1,0,1]=4 210 B10R1.13 CC(C)C1=NC=C(N)C=C1 G-7522 [1,1,0,0,0,0|1,0,1]=4 211 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [1,1,0,0,0,0|1,0,0]=3 212 B10R1.13 CC(N)C1=NC=C(F)C=C1 C-3369 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [1,1,0,0,0,0|1,0,1]=4 214 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,1,0,0,0,0|0,0,1]=3 215 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,1,0,0,0,0|0,0,1]=3 216 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [1,1,0,0,0,0|1,0,1]=4 217 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [1,1,0,0,0,0|1,0,1]=4 220 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [1,1,0,0,0,0|1,0,1]=4 221 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 O32464 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.28 CC(C)(N)C1=CC=CN=C1 S72454 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32487 [1,1,0,0,0,0|1,0,1]=4 228 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32488 [1,1,0,0,0,0|1,0,1]=4 229 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32489 [1,1,0,0,0,0|1,0,1]=4 230 B10R1.28 CC(C)(O)C1=NC=CC=C1 M15802 [1,1,0,0,0,0|1,0,1]=4 231 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [1,1,0,0,0,0|1,0,1]=4 233 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [1,1,0,0,0,0|1,0,1]=4 234 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [1,1,0,0,0,0|1,0,1]=4 237 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [1,1,0,0,0,0|1,0,1]=4 239 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [1,1,0,0,0,0|1,0,1]=4 240 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [1,1,0,0,0,0|1,0,1]=4 241 B10R1.61 CC(Br)C1=CC=CC=C1F O31043 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.61 CC(C)C1=C(Br)C=NC=C1 Q54489 [1,1,0,0,0,0|1,0,1]=4 243 B10R1.61 CC(C)C1=CC=CN=C1N O33456 [1,1,0,0,0,0|1,0,1]=4 244 B10R1.61 CC(Cl)C1=CC=CC=C1Cl P40025 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.61 CC(N)C1=CC=CC=C1Br O34378 [1,1,0,0,0,0|1,0,0]=3 246 B10R1.61 CC(N)C1=CC=CC=C1Cl P38305 [1,1,0,0,0,0|1,0,0]=3 247 B10R1.61 CC(N)C1=CC=CC=C1F P36297 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.61 CC(N)C1=CC=CC=C1N P38310 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.61 CC(O)C1=C(F)C=NC=C1 Q65366 [1,1,0,0,0,0|1,0,1]=4 250 B10R1.61 CC(O)C1=CC=CN=C1Br O30716 [1,1,0,0,0,0|1,0,1]=4 251 B10R1.61 CC(O)C1=CC=CN=C1Cl P41711 [1,1,0,0,0,0|1,0,1]=4 252 B10R1.61 CC(O)C1=CC=CN=C1F N26796 [1,1,0,0,0,0|1,0,1]=4 253 B10R1.61 CC1=CC=CC=C1C(C)N P38147 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.61 CN(C)C1=CC=CC=C1O P38469 [1,1,0,0,0,0|1,0,1]=4 255 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [1,1,0,0,0,0|0,0,1]=3 256 B10R1.61 C[C@@H](O)C1=CC=CN=C1N Q62533 [1,1,0,0,0,0|1,0,1]=4 257 B10R1.61 C[C@H](N)C1=CC=CC=C1Br P51405 [1,1,0,0,0,0|1,0,0]=3 258 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [1,1,0,0,0,0|0,0,1]=3 259 B10R1.61 C[C@H](O)C1=CC=CN=C1N Q62532 [1,1,0,0,0,0|1,0,1]=4 260 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [1,1,0,0,0,0|0,0,1]=3 261 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [1,1,0,0,0,0|1,0,1]=4 262 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [1,1,0,0,0,0|1,0,1]=4 265 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [1,1,0,0,0,0|1,0,1]=4 266 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [1,1,0,0,0,0|1,0,1]=4 267 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 Q52823 [1,1,0,0,0,0|1,0,1]=4 268 B10R1.113 CC(C)C1=CC(O)=NC=C1 Q52824 [1,1,0,0,0,0|1,0,1]=4 269 B10R1.113 CC(C)C1=CC=CC(I)=N1 N26566 [1,1,0,0,0,0|1,0,1]=4 270 B10R1.113 CC(C)C1=CN=CC(O)=C1 Q52825 [1,1,0,0,0,0|1,0,1]=4 271 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [1,1,0,0,0,0|1,0,0]=3 272 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [1,1,0,0,0,0|1,0,0]=3 276 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58352 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58353 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.113 CC(O)C1=CC(Cl)=NC=C1 P42079 [1,1,0,0,0,0|1,0,1]=4 280 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [1,1,0,0,0,0|1,0,1]=4 281 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [1,1,0,0,0,0|1,0,0]=3 283 B10R1.113 CC1=NC([C@@H](C)N)=CC=C1 Q58193 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.113 CC1=NC([C@H](C)N)=CC=C1 Q58196 [1,1,0,0,0,0|2,0,0]=4 285 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [1,1,0,0,0,0|1,0,1]=4 286 B10R1.113 C[C@@H](N)C1=CC(Cl)=NC=C1 F-4328 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 O29507 [1,1,0,0,0,0|2,0,0]=4 288 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 P43499 [1,1,0,0,0,0|2,0,0]=4 289 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [1,1,0,0,0,0|1,0,1]=4 291 B10R1.1 BrC1=CC=C(CCI)C=C1 P35777 [1,1,0,0,0,0|1,0,1]=4 292 B10R1.1 BrCCC1=CC=C(Br)C=C1 P40516 [1,1,0,0,0,0|1,0,1]=4 293 B10R1.1 C(=O)CC1=NC=C(Br)C=N1 Q52781 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.1 C=COC1=CC=C(Br)C=C1 N25160 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.1 CNCC1=CC=C(Cl)C=C1 P42874 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.1 CNCC1=CC=C(N)C=C1 P38425 [1,1,0,0,0,0|2,0,0]=4 297 B10R1.1 CNCC1=CC=C(O)C=C1 P36065 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.1 COCC1=CC=C(Br)C=C1 Q67196 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.1 FC1=CC=C(CCBr)C=C1 I-9285 [1,1,0,0,0,0|1,0,1]=4 300 B10R1.1 NCCC1=CC=C(I)C=C1 P36354 [1,1,0,0,0,0|1,0,1]=4 301 B10R1.1 NNCC1=CC=C(Br)C=C1 C-3250 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.1 NNCC1=CC=C(Br)C=C1 I-9319 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.1 NNCC1=CC=C(Cl)C=C1 C-3251 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.1 NNCC1=CC=C(Cl)C=C1 Q51808 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.1 NNCC1=CC=C(F)C=C1 C-3247 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.1 NOCC1=CC=C(Cl)C=C1 O31868 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.1 NOCC1=CC=C(F)C=C1 10767 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.4 BrCCC1=CC=CC=C1Br O28100 [1,1,0,0,0,0|1,0,1]=4 309 B10R1.4 C=CCC1=C(C)C=CN=C1 N26419 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.4 CC1=CC=CC=C1CCBr O28115 [1,1,0,0,0,0|1,0,1]=4 311 B10R1.4 CNCC1=CC=CC=C1C P35580 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.4 CNCC1=CC=CC=C1N P40191 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.4 COCC1=CC=CC=C1Br Q67462 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.4 NCCC1=CC=CC=C1N P42500 [1,1,0,0,0,0|1,0,1]=4 315 B10R1.4 NCCC1=CC=CC=C1O M22991 [1,1,0,0,0,0|1,0,1]=4 316 B10R1.4 NNCC1=C(Br)C=CC=C1 G-5141 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.4 NNCC1=C(Br)C=CC=C1 Q51807 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.4 NNCC1=C(Cl)C=CC=C1 C-3252 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.4 NNCC1=C(F)C=CC=C1 C-3249 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.4 OC1=CC=CC=C1CCBr P37343 [1,1,0,0,0,0|1,0,1]=4 321 B10R1.4 OCCC1=CC=CC=C1O P36102 [1,1,0,0,0,0|0,0,2]=4 322 B10R1.10 CC1=CC(CCBr)=CC=C1 P40673 [1,1,0,0,0,0|1,0,1]=4 323 B10R1.10 CC1=CC(CCCl)=CC=C1 P38353 [1,1,0,0,0,0|1,0,1]=4 324 B10R1.10 CC1=CC(CCI)=CC=C1 M23009 [1,1,0,0,0,0|1,0,1]=4 325 B10R1.10 CC1=CC(CCN)=CC=C1 P37429 [1,1,0,0,0,0|1,0,1]=4 326 B10R1.10 CCCC1=CC=CC(N)=C1 M23710 [1,1,0,0,0,0|1,0,1]=4 327 B10R1.10 CNCC1=CC(O)=CC=C1 P42117 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.10 CNCC1=CC=CC(C)=C1 P38357 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.10 COCC1=CC(Br)=CC=C1 Q67458 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.10 FC1=CC(CCBr)=CC=C1 P39371 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.10 N#CCC1=CC=CC(N)=C1 P37983 [1,1,0,0,0,0|1,0,1]=4 332 B10R1.10 NC1=CC(CCO)=CC=C1 O31199 [1,1,0,0,0,0|0,0,2]=4 333 B10R1.10 NCCC1=CC(O)=CC=C1 M23068 [1,1,0,0,0,0|1,0,1]=4 334 B10R1.10 NCCC1=CC=CC(Cl)=C1 G-6963 [1,1,0,0,0,0|1,0,1]=4 335 B10R1.10 NCCC1=CC=CC(I)=C1 P34955 [1,1,0,0,0,0|1,0,1]=4 336 B10R1.10 NCCC1=CC=CC(N)=C1 P36157 [1,1,0,0,0,0|1,0,1]=4 337 B10R1.10 NNCC1=CC(Cl)=CC=C1 Q51809 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.10 NNCC1=CC(F)=CC=C1 C-3248 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.10 NNCC1=CC(F)=CC=C1 Q51806 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.10 NNCC1=CC=CC(Br)=C1 L20978 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.10 OCCC1=CC=CC(O)=C1 P41607 [1,1,0,0,0,0|0,0,2]=4 342 B10R1.17 C#CCOC1=CC=CC=C1 P41520 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.17 C=COCC1=CC=CC=C1 I-9956 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.17 CNCCC1=CC=CC=C1 P37213 [1,1,0,0,0,0|1,0,1]=4 345 B10R1.17 ICCCC1=CC=CC=C1 P38180 [1,1,0,0,0,0|1,0,1]=4 346 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.17 O=CCOC1=CC=CC=C1 K12296 [1,1,0,0,0,0|0,0,0]=2 348 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [1,1,0,0,0,0|1,1,0]=4 350 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.18 O=C(O)CC1=CN=CN=C1 O33591 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.18 O=C(O)CC1=CN=NC=C1 G-5165 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.18 O=C([O-])CC1=CC=NN=C1 L13382 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.18 O=C([O-])CC1=NC=CC=N1 Q51814 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.18 O=C([O-])CC1=NN=CC=C1 L13418 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.23 CC(C(=O)O)N1C=CC=N1 S72600 [0,1,0,0,1,0|2,0,0]=4 358 B10R1.23 NC(C(=O)O)C1=CC=CO1 P40590 [0,1,0,0,1,0|2,0,0]=4 359 B10R1.23 NC(C(=O)O)C1=CC=CS1 O28791 [0,1,0,0,1,0|2,0,0]=4 360 B10R1.23 NC(C(=O)O)C1=CSC=C1 P38413 [0,1,0,0,1,0|2,0,0]=4 361 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 G-7084 [0,1,0,0,1,0|2,0,0]=4 362 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 P42365 [0,1,0,0,1,0|2,0,0]=4 363 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 P36827 [0,1,0,0,1,0|2,0,0]=4 364 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 P42364 [0,1,0,0,1,0|2,0,0]=4 365 B12R1.32 CONC(C)CC1=CC=CC=C1 O31441 [0,1,0,0,0,1|1,0,1]=4 366 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O P43046 [0,1,0,0,0,1|1,0,0]=3 367 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Q60576 [0,1,0,0,0,1|1,0,0]=3 368 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O P43045 [0,1,0,0,0,1|1,0,0]=3 369 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O Q60744 [0,1,0,0,0,1|2,0,0]=4 370 B12R1.43 CC(CC1=NC=NC=C1)C(=O)O Q60710 [0,1,0,0,0,1|2,0,0]=4 371 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O K12054 [0,1,0,0,0,1|0,0,0]=2 372 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O P51664 [0,1,0,0,0,1|1,0,1]=4 373 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P36885 [0,1,0,0,0,1|2,0,0]=4 374 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P43169 [0,1,0,0,0,1|2,0,0]=4 375 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O P38459 [0,1,0,0,0,1|2,0,0]=4 376 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O P38458 [0,1,0,0,0,1|2,0,0]=4 377 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O P36517 [0,1,0,0,0,1|2,0,0]=4 378 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O O27942 [0,1,0,0,0,1|2,0,0]=4 379 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O P38457 [0,1,0,0,0,1|2,0,0]=4 380 B12R1.49 CC(CN)OC1=CC=C(Cl)C=C1 P40582 [0,1,0,0,0,1|1,0,1]=4 381 B12R1.194 C#CC(C)(C)CC1=CC=CC=C1 L21351 [0,1,0,0,0,1|1,0,1]=4 382 B12R1.194 C[C@@](N)(CO)CC1=CC=CC=C1 10161 [0,1,0,0,0,1|0,0,2]=4 383 B12R1.371 CC(CN)OC1=CC=CC=C1Cl P35408 [0,1,0,0,0,1|1,0,1]=4 384 B12R1.371 C\C(C=O)=C/C1=CC=CC=C1F Q69219 [0,1,0,0,0,1|0,0,1]=3 385 B12R1.9 CC(C)(C#N)C1=CC=C(N)C=C1 P42524 [0,2,0,0,0,0|1,0,1]=4 386 B12R1.9 CC(O)(CN)C1=CC=C(Br)C=C1 Q66028 [0,2,0,0,0,0|1,0,1]=4 387 B12R1.10 CCC(C)(N)C1=CC=CC(Cl)=C1 M22935 [0,2,0,0,0,0|1,0,1]=4 388 B12R1.39 CC(C)(CCBr)C1=CC=CC=C1 L19577 [0,2,0,0,0,0|1,0,1]=4 389 B12R1.39 CC(C)(CCO)C1=CC=CC=C1 L20303 [0,2,0,0,0,0|0,0,2]=4 390 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=N1 Q54907 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.253 CC(C)(C(=O)O)C1=CC=CN=C1 O30132 [0,2,0,0,0,0|1,0,0]=3 392 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 P37381 [0,2,0,0,0,0|0,0,0]=2 393 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=N1 Q58336 [0,2,0,0,0,0|1,0,0]=3 394 B12R1.253 O=C(O)C(F)(F)C1=CC=NC=C1 Q52350 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.253 O=C(O)C(F)(F)C1=CN=CC=C1 Q60668 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.253 O=C(O)C(F)(F)C1=NC=CC=C1 G-6799 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.475 CC(CO)(CO)C1=CC=CC=C1 P39384 [0,2,0,0,0,0|0,0,2]=4 398 B12R1.475 CCC(C)(CC)C1=CC=CC=C1 P43341 [0,2,0,0,0,0|1,0,1]=4 399 B12R1.475 CCC(O)(CN)C1=CC=CC=C1 M22836 [0,2,0,0,0,0|1,0,1]=4 400 B12R1.12 CCC(CC)C1=CC=C(N)C=C1 O30912 [0,2,0,0,0,0|1,0,1]=4 401 B12R1.12 NCC(CN)C1=CC=C(F)C=C1 Q70068 [0,2,0,0,0,0|1,0,1]=4 402 B12R1.13 COC(C#N)C1=CC(F)=CC=C1 L19078 [0,2,0,0,0,0|1,0,1]=4 403 B12R1.13 OCC(CO)C1=CC=CC(Br)=C1 P36126 [0,2,0,0,0,0|0,0,2]=4 404 B12R1.478 CN(C)C(CN)C1=CC=CC=C1 P36921 [0,2,0,0,0,0|1,0,1]=4 405 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 P36308 [0,2,0,0,0,0|0,0,0]=2 406 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 P39058 [0,2,0,0,0,0|0,0,0]=2 407 B12R1.478 CNC(C(=O)O)C1=CN=CC=C1 Q62393 [0,2,0,0,0,0|1,0,0]=3 408 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 P38907 [0,2,0,0,0,0|0,0,0]=2 409 B12R1.478 CN[C@H](C(=O)O)C1=CC=CC=C1 P39274 [0,2,0,0,0,0|0,0,0]=2 410 B12R1.478 NC(=O)C(CO)C1=CC=CC=C1 P51093 [0,2,0,0,0,0|0,0,0]=2 411 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 O28753 [0,2,0,0,0,0|0,0,0]=2 412 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 Q69047 [0,2,0,0,0,0|0,0,0]=2 413 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 Q69050 [0,2,0,0,0,0|0,0,0]=2 414 B12R1.478 NC[C@H](C(=O)O)C1=CC=CC=C1 Q69051 [0,2,0,0,0,0|0,0,0]=2 415 B12R1.478 NC[C@H](C(=O)O)C1=CC=CC=C1 Q69055 [0,2,0,0,0,0|0,0,0]=2 416 B12R1.30 C=CCNC(C)C1=CC=CC=N1 Q58228 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.30 C=CCNC(C)C1=CC=CN=C1 Q58240 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.30 C=CCNC(C)C1=CC=NC=C1 Q58229 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.30 CC(NCCN)C1=CC=CC=C1 L20203 [0,2,0,0,0,0|1,0,1]=4 420 B12R1.107 CC(C)N[C@@H](C)C1=CC=CC=C1 L20607 [0,2,0,0,0,0|1,0,1]=4 421 B12R1.107 CC(CC(=O)O)C1=CC=CC=N1 Q60567 [0,2,0,0,0,0|1,0,0]=3 422 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 Q60575 [0,2,0,0,0,0|1,0,0]=3 423 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 M23149 [0,2,0,0,0,0|1,0,0]=3 424 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 P37013 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 P38684 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.107 NC(CC(=O)O)C1=NC=CC=C1 P41103 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 P40807 [0,2,0,0,0,0|1,0,1]=4 428 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 P42359 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 P34974 [0,2,0,0,0,0|0,0,0]=2 430 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 P36216 [0,2,0,0,0,0|0,0,0]=2 431 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 Q65925 [0,2,0,0,0,0|0,0,0]=2 432 B12R1.20 CC1=CC=C(C(=O)C(=O)O)C=C1 P36454 [0,2,0,0,0,0|1,0,1]=4 433 B12R1.20 CC1=CC=C([C@@H](C)C(=O)O)C=C1 P51478 [0,2,0,0,0,0|0,0,0]=2 434 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 P36564 [0,2,0,0,0,0|1,0,0]=3 435 B12R1.20 CC1=CC=C([C@H](C)C(=O)O)C=C1 P51479 [0,2,0,0,0,0|0,0,0]=2 436 B12R1.20 CC1=CC=C([C@H](N)C(=O)O)C=C1 P42360 [0,2,0,0,0,0|1,0,0]=3 437 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 P36483 [0,2,0,0,0,0|1,0,0]=3 438 B12R1.20 NC(C(=O)O)C1=CC=C(I)C=C1 P38972 [0,2,0,0,0,0|1,0,0]=3 439 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 P42008 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 O28109 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 O28686 [0,2,0,0,0,0|1,0,0]=3 442 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Br)C=C1 M22620 [0,2,0,0,0,0|1,0,0]=3 443 B12R1.20 O=C(O)C(=O)C1=CC=C(Br)C=C1 P36491 [0,2,0,0,0,0|1,0,1]=4 444 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 P36490 [0,2,0,0,0,0|1,0,1]=4 445 B12R1.20 O=C(O)C(=O)C1=CC=C(F)C=C1 P39557 [0,2,0,0,0,0|1,0,1]=4 446 B12R1.20 O=C(O)C(=O)C1=CC=C(I)C=C1 P36018 [0,2,0,0,0,0|1,0,1]=4 447 B12R1.1703 O=CC(=O)C1=CC=C(F)C=C1F P36005 [0,2,0,0,0,0|1,0,1]=4 448 B12R1.225 CC1=CC(C(=O)C(=O)O)=CC=C1 P37051 [0,2,0,0,0,0|1,0,1]=4 449 B12R1.225 CC1=CC(C(N)C(=O)O)=CC=C1 P37582 [0,2,0,0,0,0|1,0,0]=3 450 B12R1.225 CC1=CC(C(O)C(=O)O)=CC=C1 P36822 [0,2,0,0,0,0|1,0,0]=3 451 B12R1.225 CC1=CC([C@@H](N)C(=O)O)=CC=C1 P40243 [0,2,0,0,0,0|1,0,0]=3 452 B12R1.225 CC1=CC([C@H](N)C(=O)O)=CC=C1 P42369 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.225 NC(C(=O)O)C1=CC=CC(Br)=C1 O30706 [0,2,0,0,0,0|1,0,0]=3 454 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 P36389 [0,2,0,0,0,0|1,0,0]=3 455 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 O28864 [0,2,0,0,0,0|1,0,0]=3 456 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 O28938 [0,2,0,0,0,0|1,0,0]=3 457 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 P39302 [0,2,0,0,0,0|1,0,0]=3 458 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(O)=C1 O28464 [0,2,0,0,0,0|1,0,0]=3 459 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Br)=C1 P41079 [0,2,0,0,0,0|1,0,0]=3 460 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Cl)=C1 O28946 [0,2,0,0,0,0|1,0,0]=3 461 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(F)=C1 P40985 [0,2,0,0,0,0|1,0,0]=3 462 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(O)=C1 O28477 [0,2,0,0,0,0|1,0,0]=3 463 B12R1.225 O=C(O)C(=O)C1=CC=CC(Br)=C1 P36439 [0,2,0,0,0,0|1,0,1]=4 464 B12R1.225 O=C(O)C(=O)C1=CC=CC(Cl)=C1 P39209 [0,2,0,0,0,0|1,0,1]=4 465 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 P36019 [0,2,0,0,0,0|1,0,1]=4 466 B12R1.225 O=C(O)C(=O)C1=CC=CC(I)=C1 P39211 [0,2,0,0,0,0|1,0,1]=4 467 B12R1.225 O=C(O)C(O)C1=CC=CC(Br)=C1 M23024 [0,2,0,0,0,0|1,0,0]=3 468 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 P38344 [0,2,0,0,0,0|1,0,0]=3 469 B12R1.124 CC1=CC=CC=C1C(=O)C(=O)O P41054 [0,2,0,0,0,0|1,0,1]=4 470 B12R1.124 CC1=CC=CC=C1C(N)C(=O)O P41783 [0,2,0,0,0,0|1,0,0]=3 471 B12R1.124 NC(C(=O)O)C1=CC=CC=C1Br O28104 [0,2,0,0,0,0|1,0,0]=3 472 B12R1.124 NC(C(=O)O)C1=CC=CC=C1F P35865 [0,2,0,0,0,0|1,0,0]=3 473 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O M15540 [0,2,0,0,0,0|1,0,0]=3 474 B12R1.124 NC1=CC=CC=C1C(=O)C(=O)O M22832 [0,2,0,0,0,0|1,0,1]=4 475 B12R1.124 N[C@@H](C(=O)O)C1=CC=CC=C1O O28562 [0,2,0,0,0,0|1,0,0]=3 476 B12R1.124 N[C@H](C(=O)O)C1=CC=CC=C1O O28563 [0,2,0,0,0,0|1,0,0]=3 477 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Br P39207 [0,2,0,0,0,0|1,0,1]=4 478 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Cl P39275 [0,2,0,0,0,0|1,0,1]=4 479 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1F P36020 [0,2,0,0,0,0|1,0,1]=4 480 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Br M22703 [0,2,0,0,0,0|1,0,0]=3 481 B12R1.564 CC(C1=CC=CC=N1)S(N)(=O)=O Q58372 [0,2,0,0,0,0|2,0,0]=4 482 B10R1.2 CN1C(=O)C=CC=C1C=O Q60456 [0,0,1,1,0,0|2,0,0]=4 483 B10R1.172 C=CC1=NC(C=O)=CC=C1 Q52934 [0,0,1,1,0,0|1,0,1]=4 484 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [1,0,0,1,0,0|1,0,1]=4 485 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [1,0,0,1,0,0|1,0,0]=3 486 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [1,0,0,1,0,0|1,0,1]=4 487 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [1,0,0,1,0,0|1,0,0]=3 488 B10R2.7 C1=CC=C2CNCC2=C1 P44607 [1,0,0,1,0,0|2,0,0]=4 489 B10R2.7 C1=CN=C2CC=NC2=C1 O29484 [1,0,0,1,0,0|2,0,0]=4 490 B12R2.18 CC1=C(Br)C2=CC=CC=C2S1 A-725 [0,0,0,1,0,1|1,0,1]=4 491 B12R2.18 CN1N=C2C=CC=CC2=C1Br O33236 [0,0,0,1,0,1|2,0,0]=4 492 B12R2.18 CN1N=C2C=CC=CC2=C1I L14060 [0,0,0,1,0,1|2,0,0]=4 493 B12R2.27 N#CC1CC1C2=CC=CC=C2 P43268 [0,0,0,1,0,1|1,0,1]=4 494 B12R2.27 N#C[C@@H]1C[C@H]1C2=CC=CC=C2 M15885 [0,0,0,1,0,1|1,0,1]=4 495 B12R2.27 NCC1CC1C2=CC=CC=C2 L19913 [0,0,0,1,0,1|1,0,1]=4 496 B12R2.27 O=CC1CC1C2=CC=CC=C2 L20873 [0,0,0,1,0,1|0,0,0]=2 497 B12R2.27 OCC1CC1C2=CC=CC=C2 P51570 [0,0,0,1,0,1|0,0,2]=4 498 B12R2.32 OCC1CC2=C(C=CC=C2)N1 M23283 [0,0,0,1,0,1|0,0,2]=4 499 B12R2.32 OC[C@H]1CC2=C(C=CC=C2)N1 I-9423 [0,0,0,1,0,1|0,0,2]=4 500 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 M22647 [0,0,0,1,0,1|1,0,1]=4 501 B12R2.2058 C1=CC=C(NC2CNC2)C=C1 P36319 [0,0,0,1,0,1|1,0,1]=4 502 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 G-7276 [0,0,0,1,0,1|1,0,1]=4 503 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 M22662 [0,0,0,1,0,1|1,0,1]=4 504 B12R2.48 NCC1(C2=CC=CC=C2)CC1 O33642 [0,1,0,1,0,0|1,0,1]=4 505 B12R2.48 NCC1(C2=CC=CC=C2)CC1 P35008 [0,1,0,1,0,0|1,0,1]=4 506 B12R2.48 OCC1(C2=CC=CC=C2)CC1 O27999 [0,1,0,1,0,0|0,0,2]=4 507 B12R2.116 NC1(C2=CC=CC=C2)CCC1 P40536 [0,1,0,1,0,0|1,0,1]=4 508 B12R2.116 NC1(C2=CC=CC=C2)CCC1 P42329 [0,1,0,1,0,0|1,0,1]=4 509 B12R2.116 NC1(C2=CC=CC=C2)COC1 G-7244 [0,1,0,1,0,0|0,0,2]=4 510 B12R2.116 NC1(C2=CC=CC=C2)COC1 P49351 [0,1,0,1,0,0|0,0,2]=4 511 B12R2.116 OC1(C2=CC=CC=C2)CNC1 G-6286 [0,1,0,1,0,0|1,0,1]=4 512 B12R2.2403 CC1(C)CNC2=C1C=CC=C2 I-9043 [0,1,0,1,0,0|1,0,1]=4 513 B12R2.2403 CC1(C)NCC2=C1C=CC=C2 G-7597 [0,1,0,1,0,0|2,0,0]=4 514 B12R2.1 BrCC1=CNC2=C1C=CC=C2 Q54248 [0,1,0,1,0,0|1,0,1]=4 515 B12R2.1 C(=O)C1=CNC2=C1C=CC=C2 P45569 [0,1,0,1,0,0|0,0,2]=4 516 B12R2.1 O=CC1=COC2=CC=CC=C12 O34082 [0,1,0,1,0,0|0,0,2]=4 517 B12R2.1 OCC1C=CC2=C1C=CC=C2 K12008 [0,1,0,1,0,0|1,0,0]=3 518 B12R2.2 C1=CC=C(C2CCCN2)C=C1 Q55561 [0,1,0,1,0,0|1,0,1]=4 519 B12R2.2 C1=CC=C(C2CCCO2)C=C1 G-5955 [0,1,0,1,0,0|1,0,1]=4 520 B12R2.2 C1=CC=C(C2CCNC2)C=C1 L13987 [0,1,0,1,0,0|1,0,1]=4 521 B12R2.2 C1=CC=C(C2CCNC2)C=C1 P44791 [0,1,0,1,0,0|1,0,1]=4 522 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 L14895 [0,1,0,1,0,0|1,0,1]=4 523 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 10698 [0,1,0,1,0,0|1,0,1]=4 524 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 L22374 [0,1,0,1,0,0|1,0,1]=4 525 B12R2.22 NC1CC(C2=CC=CC=C2)C1 L13852 [0,1,0,1,0,0|1,0,1]=4 526 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 I-9024 [0,1,0,1,0,0|1,0,1]=4 527 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 I-9025 [0,1,0,1,0,0|1,0,1]=4 528 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 O30293 [0,1,0,1,0,0|0,0,0]=2 529 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 D-2509 [0,1,0,1,0,0|0,0,0]=2 530 B12R2.1081 CC1=CN=CC2=C1C=CC=C2 O29973 [0,1,0,1,0,0|1,0,1]=4 531 B12R2.2028 CC1OB(O)C2=CC=CC=C21 N27110 [0,1,0,1,0,0|1,0,1]=4 532 B12R2.2028 CN1C=C(Br)C2=C1C=CC=C2 Q54271 [0,1,0,1,0,0|2,0,0]=4 533 B12R2.2028 CN1N=C(Br)C2=C1C=CC=C2 O31186 [0,1,0,1,0,0|2,0,0]=4 534 B12R2.2028 CN1N=C(I)C2=CC=CC=C21 L14062 [0,1,0,1,0,0|2,0,0]=4 535 B12R2.79 CC1=CC=C(C2CC2N)C=C1 Q69960 [0,1,0,1,0,0|1,0,1]=4 536 B12R2.79 FC1=CC=C(C2CC2Br)C=C1 O29607 [0,1,0,1,0,0|1,0,1]=4 537 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 O34315 [0,1,0,1,0,0|1,0,1]=4 538 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 Q69959 [0,1,0,1,0,0|1,0,1]=4 539 B12R2.79 NC1CC1C2=CC=C(Cl)C=C2 Q69961 [0,1,0,1,0,0|1,0,1]=4 540 B12R2.79 NC1CC1C2=CC=C(F)C=C2 O34585 [0,1,0,1,0,0|1,0,1]=4 541 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 O34571 [0,1,0,1,0,0|1,0,1]=4 542 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 O34573 [0,1,0,1,0,0|1,0,1]=4 543 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(O)C=C2 L14742 [0,1,0,1,0,0|1,0,1]=4 544 B12R2.612 CC1=CNC2=C1C=CC(Br)=C2 L14882 [0,1,0,1,0,0|1,0,1]=4 545 B12R2.612 CC1=CNC2=C1C=CC(O)=C2 P44314 [0,1,0,1,0,0|1,0,1]=4 546 B12R2.612 CC1=CNC2=CC(N)=CC=C12 L13196 [0,1,0,1,0,0|1,0,1]=4 547 B12R2.612 CC1NCC2=C1C=CC(Br)=C2 10152 [0,1,0,1,0,0|2,0,0]=4 548 B12R2.612 CN1C=CC2=C1C=CC(Br)=C2 P43102 [0,1,0,1,0,0|2,0,0]=4 549 B12R2.612 CN1C=NC2=CC(Br)=CC=C21 A-852 [0,1,0,1,0,0|2,0,0]=4 550 B12R2.612 CN1C=NC2=CC(N)=CC=C21 O31795 [0,1,0,1,0,0|2,0,0]=4 551 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 N25053 [0,1,0,1,0,0|1,0,1]=4 552 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 P44403 [0,1,0,1,0,0|1,0,1]=4 553 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 G-7440 [0,1,0,1,0,0|0,0,2]=4 554 B12R2.2302 OC1=CC=C(C2CCC2)C=C1 N25921 [0,1,0,1,0,0|1,0,1]=4 555 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 O34598 [0,1,0,1,0,0|1,0,1]=4 556 B12R2.80 NC1CC1C2=CC=CC(F)=C2 O34562 [0,1,0,1,0,0|1,0,1]=4 557 B12R2.132 CC1=CNC2=C1C=C(Br)C=C2 Q55299 [0,1,0,1,0,0|1,0,1]=4 558 B12R2.132 CC1=CNC2=C1C=C(Cl)C=C2 G-7513 [0,1,0,1,0,0|1,0,1]=4 559 B12R2.132 CC1=CNC2=C1C=C(N)C=C2 Q55296 [0,1,0,1,0,0|1,0,1]=4 560 B12R2.132 CN1C=CC2=C1C=C(Br)C=C2 M22708 [0,1,0,1,0,0|2,0,0]=4 561 B12R2.132 CN1C=NC2=C1C=C(Br)C=C2 L14673 [0,1,0,1,0,0|2,0,0]=4 562 B12R2.196 CC1=CNC2=C1C=CC=C2Br O30302 [0,1,0,1,0,0|1,0,1]=4 563 B12R2.196 CC1=CNC2=C1C=CC=C2N L14881 [0,1,0,1,0,0|1,0,1]=4 564 B12R2.196 CN1C=CC2=C1C=CC=C2Br G-7713 [0,1,0,1,0,0|2,0,0]=4 565 B12R2.196 CN1C=NC2=C(Br)C=CC=C21 O29823 [0,1,0,1,0,0|2,0,0]=4 566 B12R2.2313 BrC1=CC(C2CCC2)=CC=C1 N25708 [0,1,0,1,0,0|1,0,1]=4 567 B12R2.2313 BrC1=CC(C2CNC2)=CC=C1 O33220 [0,1,0,1,0,0|1,0,1]=4 568 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 G-7246 [0,1,0,1,0,0|0,0,2]=4 569 B12R2.115 NC1CC1C2=CC=CC=C2F Q70161 [0,1,0,1,0,0|1,0,1]=4 570 B12R2.203 CC1=CC=CC2=C1N(C)C=C2 P37403 [0,1,0,1,0,0|2,0,0]=4 571 B12R2.203 CC1=CNC2=C1C(F)=CC=C2 Q55308 [0,1,0,1,0,0|1,0,1]=4 572 B12R2.203 CC1=CNC2=C1C(O)=CC=C2 Q55294 [0,1,0,1,0,0|1,0,1]=4 573 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 L13715 [0,1,0,1,0,0|1,0,1]=4 574 B12R2.203 CC1=CNC2=CC=CC(N)=C12 L13255 [0,1,0,1,0,0|1,0,1]=4 575 B12R2.203 CN1C=CC2=CC=CC(N)=C21 Q64776 [0,1,0,1,0,0|2,0,0]=4 576 B8R1.7 CC(C)C1=CC=CO1 A-982 [1,0,0,0,1,0|1,0,1]=4 577 B8R1.7 CC(O)C1=CSC=C1 O31068 [1,0,0,0,1,0|1,0,1]=4 578 B8R1.8 O=CCN1C=CC=N1 S72479 [1,0,0,0,1,0|2,0,0]=4 579 B12R1.27 CC(CO)NCC1=CC=CC=C1 Q66178 [0,0,0,0,0,2|0,0,2]=4 580 B12R1.27 CC(CO)OCC1=CC=CC=C1 P36528 [0,0,0,0,0,2|0,0,2]=4 581 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 O31764 [0,0,0,0,0,2|0,0,2]=4 582 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 10174 [0,0,0,0,0,2|0,0,2]=4