0 B11R2.4 NC1CC1C2=CC=CC=C2 Q54793 [0,0,0,0,0,0|0,0,0]=0 1 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 L14213 [0,0,0,0,0,0|0,0,0]=0 2 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 L22363 [0,0,0,0,0,0|0,0,0]=0 3 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [1,0,0,0,0,0|1,0,0]=2 4 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [1,0,0,0,0,0|1,0,0]=2 5 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [1,0,0,0,0,0|1,0,0]=2 6 B12R2.27 N#CC1CC1C2=CC=CC=C2 P43268 [0,1,0,0,0,0|0,0,1]=2 7 B12R2.27 N#C[C@@H]1C[C@H]1C2=CC=CC=C2 M15885 [0,1,0,0,0,0|0,0,1]=2 8 B12R2.27 NCC1CC1C2=CC=CC=C2 L19913 [0,1,0,0,0,0|0,0,0]=1 9 B12R2.27 O=CC1CC1C2=CC=CC=C2 L20873 [0,1,0,0,0,0|1,0,0]=2 10 B12R2.27 OCC1CC1C2=CC=CC=C2 P51570 [0,1,0,0,0,0|1,0,0]=2 11 B12R2.79 CC1=CC=C(C2CC2N)C=C1 Q69960 [0,1,0,0,0,0|0,0,0]=1 12 B12R2.79 FC1=CC=C(C2CC2Br)C=C1 O29607 [0,1,0,0,0,0|1,0,0]=2 13 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 O34315 [0,1,0,0,0,0|0,0,0]=1 14 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 Q69959 [0,1,0,0,0,0|0,0,0]=1 15 B12R2.79 NC1CC1C2=CC=C(Cl)C=C2 Q69961 [0,1,0,0,0,0|0,0,0]=1 16 B12R2.79 NC1CC1C2=CC=C(F)C=C2 O34585 [0,1,0,0,0,0|0,0,0]=1 17 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 O34571 [0,1,0,0,0,0|0,0,0]=1 18 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 O34573 [0,1,0,0,0,0|0,0,0]=1 19 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(O)C=C2 L14742 [0,1,0,0,0,0|0,0,0]=1 20 B12R2.79 N[C@H]1C[C@@H]1C2=CN=C(Br)C=C2 L14757 [0,1,0,0,0,0|1,0,0]=2 21 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 O34598 [0,1,0,0,0,0|0,0,0]=1 22 B12R2.80 NC1CC1C2=CC=CC(F)=C2 O34562 [0,1,0,0,0,0|0,0,0]=1 23 B12R2.115 NC1CC1C2=CC=CC=C2F Q70161 [0,1,0,0,0,0|0,0,0]=1 24 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [0,0,1,0,0,0|2,0,0]=3 25 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [0,0,1,0,0,0|2,0,0]=3 26 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [0,0,1,0,0,0|2,0,0]=3 27 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [0,0,1,0,0,0|2,0,0]=3 28 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [0,0,1,0,0,0|2,0,1]=4 29 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [0,0,1,0,0,0|3,0,0]=4 30 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [0,0,1,0,0,0|1,0,0]=2 31 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [0,0,1,0,0,0|2,0,0]=3 32 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [0,0,1,0,0,0|2,0,0]=3 33 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [0,0,1,0,0,0|2,0,0]=3 34 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [0,0,1,0,0,0|2,0,0]=3 35 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [0,0,1,0,0,0|1,0,0]=2 36 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [0,0,1,0,0,0|1,0,0]=2 37 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [0,0,1,0,0,0|3,0,0]=4 38 B10R1.17 C#CCOC1=CC=CC=C1 P41520 [0,0,1,0,0,0|2,0,1]=4 39 B10R1.17 C=COCC1=CC=CC=C1 I-9956 [0,0,1,0,0,0|2,0,1]=4 40 B10R1.17 CCCCC1=CC=NC=C1 O30545 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.17 CNCCC1=CC=CC=C1 P37213 [0,0,1,0,0,0|2,0,0]=3 42 B10R1.17 CNCCC1=CC=NC=C1 P37446 [0,0,1,0,0,0|3,0,0]=4 43 B10R1.17 CNCCC1=NC=CC=C1 P40087 [0,0,1,0,0,0|3,0,0]=4 44 B10R1.17 ICCCC1=CC=CC=C1 P38180 [0,0,1,0,0,0|1,0,0]=2 45 B10R1.17 NCC#CC1=CC=CC=N1 Q58471 [0,0,1,0,0,0|1,0,2]=4 46 B10R1.17 NCC#CC1=CC=CC=N1 Q58472 [0,0,1,0,0,0|1,0,2]=4 47 B10R1.17 NCCCC1=CC=NC=C1 P38929 [0,0,1,0,0,0|1,0,0]=2 48 B10R1.17 NCCNC1=NC=CC=C1 P34736 [0,0,1,0,0,0|2,0,0]=3 49 B10R1.17 NCCNC1=NC=CC=C1 P36299 [0,0,1,0,0,0|2,0,0]=3 50 B10R1.17 NCCOC1=CC=CN=C1 O34354 [0,0,1,0,0,0|2,0,0]=3 51 B10R1.17 NCCOC1=CC=NC=C1 P51450 [0,0,1,0,0,0|2,0,0]=3 52 B10R1.17 NCCOC1=NC=CC=C1 O34316 [0,0,1,0,0,0|2,0,0]=3 53 B10R1.17 NC\C=C\C1=CC=CN=C1 Q58489 [0,0,1,0,0,0|1,0,2]=4 54 B10R1.17 NNCCC1=CC=NC=C1 Q58254 [0,0,1,0,0,0|2,0,0]=3 55 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [0,0,1,0,0,0|2,0,1]=4 56 B10R1.17 O=CCOC1=CC=CC=C1 K12296 [0,0,1,0,0,0|2,0,1]=4 57 B10R1.17 OCCCC1=NC=CC=C1 P39056 [0,0,1,0,0,0|2,0,0]=3 58 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [0,0,1,0,0,0|2,0,1]=4 59 B10R1.18 CC(C)OC1=NC=CC=C1 N24110 [0,0,1,0,0,0|3,0,0]=4 60 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [0,0,1,0,0,0|2,0,1]=4 61 B12R2.22 NC1CC(C2=CC=CC=C2)C1 L13852 [0,0,0,0,0,1|0,0,0]=1 62 B12R2.22 NC1CN(C2=CC=CC=C2)C1 L21688 [0,0,0,0,0,1|1,0,0]=2 63 B12R2.22 NC1CN(C2=CC=NC=N2)C1 P46250 [0,0,0,0,0,1|3,0,0]=4 64 B12R2.22 NC1CN(C2=CN=CN=C2)C1 O33339 [0,0,0,0,0,1|3,0,0]=4 65 B12R2.22 NC1CN(C2=NC=CC=N2)C1 O33530 [0,0,0,0,0,1|3,0,0]=4 66 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 I-9024 [0,0,0,0,0,1|0,0,0]=1 67 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 I-9025 [0,0,0,0,0,1|0,0,0]=1 68 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 O30293 [0,0,0,0,0,1|1,0,1]=3 69 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 D-2509 [0,0,0,0,0,1|1,0,1]=3 70 B12R2.22 OC1CN(C2=CC=CC=C2)C1 L18106 [0,0,0,0,0,1|2,0,0]=3 71 B12R2.23 O=C1CCC1C2=CC=CC=C2 F-4430 [0,0,0,0,0,1|1,0,1]=3 72 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [1,0,1,0,0,0|1,0,0]=3 73 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [1,0,1,0,0,0|1,0,0]=3 74 B9R1.6 CC(N)C1=CC=NC=N1 Q51822 [1,0,1,0,0,0|2,0,0]=4 75 B9R1.6 CC(N)C1=CC=NN=C1 G-7533 [1,0,1,0,0,0|2,0,0]=4 76 B9R1.6 CC(N)C1=CC=NN=C1 L13924 [1,0,1,0,0,0|2,0,0]=4 77 B9R1.6 CC(N)C1=CN=CN=C1 G-5168 [1,0,1,0,0,0|2,0,0]=4 78 B9R1.6 CC(N)C1=CN=CN=C1 Q51812 [1,0,1,0,0,0|2,0,0]=4 79 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [1,0,1,0,0,0|1,0,0]=3 80 B9R1.6 CC(N)C1=NC=CC=N1 Q55479 [1,0,1,0,0,0|2,0,0]=4 81 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [1,0,1,0,0,0|1,0,0]=3 82 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [1,0,1,0,0,0|1,0,0]=3 83 B9R1.6 C[C@@H](N)C1=CN=CN=C1 I-9747 [1,0,1,0,0,0|2,0,0]=4 84 B9R1.6 C[C@@H](N)C1=NC=CC=N1 Q57196 [1,0,1,0,0,0|2,0,0]=4 85 B9R1.6 C[C@H](N)C1=CN=CN=C1 Q51933 [1,0,1,0,0,0|2,0,0]=4 86 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q57195 [1,0,1,0,0,0|2,0,0]=4 87 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q65669 [1,0,1,0,0,0|2,0,0]=4 88 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,0,1,0,0,0|2,0,0]=4 89 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,0,1,0,0,0|2,0,0]=4 90 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,0,1,0,0,0|2,0,0]=4 91 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,0,1,0,0,0|2,0,0]=4 92 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,0,1,0,0,0|2,0,0]=4 93 B9R1.8 NCCC1=CC=NC=N1 L14509 [1,0,1,0,0,0|2,0,0]=4 94 B9R1.8 NCCC1=NC=CC=N1 L14904 [1,0,1,0,0,0|2,0,0]=4 95 B9R1.8 NCCC1=NC=CC=N1 Q55474 [1,0,1,0,0,0|2,0,0]=4 96 B9R1.8 NCCC1=NC=NC=C1 Q56454 [1,0,1,0,0,0|2,0,0]=4 97 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,0,1,0,0,0|1,0,0]=3 98 B9R1.8 NNCC1=CC=CN=C1 O31533 [1,0,1,0,0,0|2,0,0]=4 99 B9R1.8 NNCC1=CC=NC=C1 C-3253 [1,0,1,0,0,0|2,0,0]=4 100 B9R1.8 NNCC1=CC=NC=C1 L13556 [1,0,1,0,0,0|2,0,0]=4 101 B9R1.8 NNCC1=CC=NC=C1 O32212 [1,0,1,0,0,0|2,0,0]=4 102 B9R1.8 NNCC1=CN=CC=C1 C-3254 [1,0,1,0,0,0|2,0,0]=4 103 B9R1.8 NNCC1=NC=CC=C1 C-3255 [1,0,1,0,0,0|2,0,0]=4 104 B9R1.8 NNCC1=NC=CC=C1 O31423 [1,0,1,0,0,0|2,0,0]=4 105 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,0,1,0,0,0|2,0,0]=4 106 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,0,1,0,0,0|2,0,0]=4 107 B11R1.7 CC(C)(CN)C1=CC=CC=C1 P39760 [0,1,1,0,0,0|0,0,0]=2 108 B11R1.7 CC(C)(CN)C1=NC=CC=N1 Q52438 [0,1,1,0,0,0|2,0,0]=4 109 B11R1.7 CC(C)(CN)C1=NC=CC=N1 Q52439 [0,1,1,0,0,0|2,0,0]=4 110 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Q54944 [0,1,1,0,0,0|2,0,0]=4 111 B11R1.7 CC(N)(CO)C1=CC=CC=C1 P35233 [0,1,1,0,0,0|1,0,0]=3 112 B11R1.7 NCC(F)(F)C1=NC=CC=C1 L14284 [0,1,1,0,0,0|2,0,0]=4 113 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 M15334 [0,1,1,0,0,0|0,0,2]=4 114 B11R1.16 CC(CCN)C1=CC=CC=C1 P38414 [0,1,1,0,0,0|0,0,0]=2 115 B11R1.16 CC(CCN)C1=CC=NC=C1 Q58360 [0,1,1,0,0,0|1,0,0]=3 116 B11R1.16 CCCC(N)C1=CC=CC=C1 P39016 [0,1,1,0,0,0|2,0,0]=4 117 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58232 [0,1,1,0,0,0|2,0,0]=4 118 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58233 [0,1,1,0,0,0|2,0,0]=4 119 B11R1.16 CNCC(C)C1=CC=CC=C1 P37180 [0,1,1,0,0,0|0,0,0]=2 120 B11R1.16 CNCC(O)C1=CC=CN=C1 Q58187 [0,1,1,0,0,0|2,0,0]=4 121 B11R1.16 CNCC(O)C1=NC=CC=C1 L20626 [0,1,1,0,0,0|2,0,0]=4 122 B11R1.16 COCC(N)C1=CC=CC=C1 P40515 [0,1,1,0,0,0|2,0,0]=4 123 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 P35167 [0,1,1,0,0,0|2,0,0]=4 124 B11R1.16 COC[C@H](N)C1=CC=CC=C1 P36845 [0,1,1,0,0,0|2,0,0]=4 125 B11R1.16 NCCC(O)C1=CC=CC=C1 P37784 [0,1,1,0,0,0|1,0,0]=3 126 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 P35908 [0,1,1,0,0,0|2,0,0]=4 127 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 P40616 [0,1,1,0,0,0|2,0,0]=4 128 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [0,1,1,0,0,0|0,0,2]=4 129 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [0,1,1,0,0,0|0,0,2]=4 130 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [0,1,1,0,0,0|0,0,0]=2 131 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [0,1,1,0,0,0|0,0,0]=2 132 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [0,1,1,0,0,0|1,0,0]=3 133 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [0,1,1,0,0,0|1,0,0]=3 134 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [0,1,1,0,0,0|1,0,1]=4 135 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,1,1,0,0,0|2,0,0]=4 136 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,1,1,0,0,0|1,0,0]=3 137 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,1,1,0,0,0|2,0,0]=4 138 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,1,1,0,0,0|2,0,0]=4 139 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [0,1,1,0,0,0|2,0,0]=4 140 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [0,1,1,0,0,0|2,0,0]=4 141 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,1,1,0,0,0|2,0,0]=4 143 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [0,1,1,0,0,0|2,0,0]=4 144 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,1,1,0,0,0|2,0,0]=4 145 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,1,1,0,0,0|2,0,0]=4 147 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [0,1,1,0,0,0|1,0,1]=4 148 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,1,1,0,0,0|1,0,0]=3 149 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,1,1,0,0,0|1,0,0]=3 150 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,1,1,0,0,0|1,0,0]=3 151 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,1,1,0,0,0|2,0,0]=4 152 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,1,1,0,0,0|2,0,0]=4 153 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,1,1,0,0,0|2,0,0]=4 154 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,1,1,0,0,0|2,0,0]=4 155 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,1,1,0,0,0|2,0,0]=4 156 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,1,1,0,0,0|2,0,0]=4 158 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,1,1,0,0,0|1,0,0]=3 159 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,1,1,0,0,0|2,0,0]=4 160 B11R1.23 CCC(N)C1=CC=CC(Cl)=C1 P38298 [0,1,1,0,0,0|2,0,0]=4 161 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,1,1,0,0,0|2,0,0]=4 162 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,1,1,0,0,0|2,0,0]=4 163 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,1,1,0,0,0|2,0,0]=4 164 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,1,1,0,0,0|2,0,0]=4 165 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,1,1,0,0,0|1,0,1]=4 166 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,1,1,0,0,0|1,0,1]=4 167 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,1,1,0,0,0|1,0,1]=4 168 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,1,1,0,0,0|1,0,1]=4 169 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,1,1,0,0,0|1,0,0]=3 170 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,1,1,0,0,0|1,0,0]=3 171 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,1,1,0,0,0|1,0,0]=3 172 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,1,1,0,0,0|1,0,0]=3 173 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,1,1,0,0,0|2,0,0]=4 174 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,1,1,0,0,0|2,0,0]=4 175 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,1,1,0,0,0|2,0,0]=4 176 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,1,1,0,0,0|2,0,0]=4 177 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,1,1,0,0,0|2,0,0]=4 178 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,1,1,0,0,0|2,0,0]=4 179 B11R1.36 CC(C)C(C)C1=CC=CC=C1 P43269 [0,1,1,0,0,0|1,0,0]=3 180 B11R1.36 CC(C)C(N)C1=CC=CC=C1 P36744 [0,1,1,0,0,0|2,0,0]=4 181 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 P37697 [0,1,1,0,0,0|1,0,1]=4 182 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,1,1,0,0,0|1,0,0]=3 184 B11R1.222 CCC(N)C1=CC=CC=C1C P37948 [0,1,1,0,0,0|2,0,0]=4 185 B11R1.222 CCC(N)C1=CC=CC=C1Cl Q66027 [0,1,1,0,0,0|2,0,0]=4 186 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,1,1,0,0,0|2,0,0]=4 187 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,1,1,0,0,0|2,0,0]=4 188 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.222 NCC(=O)C1=CC=CC=C1Br P35565 [0,1,1,0,0,0|1,0,1]=4 190 B11R1.222 NCC(=O)C1=CC=CC=C1Cl P40753 [0,1,1,0,0,0|1,0,1]=4 191 B11R1.222 NCC(=O)C1=CC=CC=C1O P37785 [0,1,1,0,0,0|1,0,1]=4 192 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,1,1,0,0,0|1,0,0]=3 193 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,1,1,0,0,0|1,0,0]=3 194 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,1,1,0,0,0|1,0,0]=3 195 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,1,1,0,0,0|2,0,0]=4 197 B11R1.1 BrCCCC1=CC=C(Br)C=C1 O28558 [0,1,1,0,0,0|1,0,0]=3 198 B11R1.1 BrCCOC1=CC=C(Br)C=C1 P40240 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.1 CC1=CC=C(CCCN)C=C1 P37491 [0,1,1,0,0,0|0,0,0]=2 200 B11R1.1 CC1=CC=C(CCCO)C=C1 P37548 [0,1,1,0,0,0|1,0,0]=3 201 B11R1.1 CC1=CC=C(NCCN)N=C1 Q58257 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.1 CC1=CC=C(OCCN)C=C1 P39224 [0,1,1,0,0,0|1,0,0]=3 203 B11R1.1 CC1=CC=C(OCCO)C=C1 P41034 [0,1,1,0,0,0|2,0,0]=4 204 B11R1.1 CCCNC1=CC=C(Br)C=C1 L20694 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.1 CCOCC1=CC=C(Br)C=C1 Q68272 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.1 CNCCC1=CC=C(Br)C=C1 P36407 [0,1,1,0,0,0|2,0,0]=4 207 B11R1.1 CNCCC1=CC=C(C)C=C1 P39523 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.1 CNCCC1=CC=C(Cl)C=C1 P38411 [0,1,1,0,0,0|2,0,0]=4 209 B11R1.1 CNCCC1=CC=C(F)C=C1 P38002 [0,1,1,0,0,0|2,0,0]=4 210 B11R1.1 ClC1=CC=C(CCCBr)C=C1 P36856 [0,1,1,0,0,0|1,0,0]=3 211 B11R1.1 ClC1=CC=C(OCCBr)C=C1 P39956 [0,1,1,0,0,0|2,0,0]=4 212 B11R1.1 ClCCOC1=CC=C(Br)C=C1 Q66285 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.1 FC1=CC=C(CCCBr)C=C1 P39413 [0,1,1,0,0,0|1,0,0]=3 214 B11R1.1 FCCOC1=CC=C(Br)C=C1 Q66290 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.1 N#CCCC1=CC=C(Cl)C=C1 P38827 [0,1,1,0,0,0|0,0,2]=4 216 B11R1.1 NC1=CC=C(CCCO)C=C1 O28226 [0,1,1,0,0,0|1,0,0]=3 217 B11R1.1 NC1=CC=C(NCCO)C=C1 P40155 [0,1,1,0,0,0|2,0,0]=4 218 B11R1.1 NC1=CC=C(OCCO)C=C1 P36875 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.1 NCCCC1=CC=C(Br)C=C1 P36773 [0,1,1,0,0,0|0,0,0]=2 220 B11R1.1 NCCCC1=CC=C(Cl)C=C1 P40263 [0,1,1,0,0,0|0,0,0]=2 221 B11R1.1 NCCCC1=CC=C(F)C=C1 P43064 [0,1,1,0,0,0|0,0,0]=2 222 B11R1.1 NCCCC1=CC=C(N)C=C1 P35188 [0,1,1,0,0,0|0,0,0]=2 223 B11R1.1 NCCNC1=CC=C(Br)C=C1 P37781 [0,1,1,0,0,0|1,0,0]=3 224 B11R1.1 NCCNC1=CC=C(F)C=C1 P37782 [0,1,1,0,0,0|1,0,0]=3 225 B11R1.1 NCCNC1=NC=C(Br)C=C1 P40044 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.1 NCCOC1=CC=C(Br)C=C1 P39225 [0,1,1,0,0,0|1,0,0]=3 227 B11R1.1 NCCOC1=CC=C(Cl)C=C1 P39041 [0,1,1,0,0,0|1,0,0]=3 228 B11R1.1 NCCOC1=CC=C(Cl)C=N1 Q58385 [0,1,1,0,0,0|2,0,0]=4 229 B11R1.1 NCCOC1=CC=C(F)C=C1 P37101 [0,1,1,0,0,0|1,0,0]=3 230 B11R1.1 NCCOC1=CC=C(N)C=C1 P36425 [0,1,1,0,0,0|1,0,0]=3 231 B11R1.1 NCCOC1=CC=C(O)C=C1 P37780 [0,1,1,0,0,0|1,0,0]=3 232 B11R1.1 NCCOC1=NC=C(Cl)C=C1 Q62434 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.1 NCCSC1=CC=C(Br)C=C1 P36571 [0,1,1,0,0,0|1,0,0]=3 234 B11R1.1 OCCCC1=CC=C(Br)C=C1 P39318 [0,1,1,0,0,0|1,0,0]=3 235 B11R1.1 OCCCC1=CC=C(F)C=C1 P36540 [0,1,1,0,0,0|1,0,0]=3 236 B11R1.1 OCCOC1=CC=C(Br)C=C1 P38648 [0,1,1,0,0,0|2,0,0]=4 237 B11R1.1 OCCOC1=CC=C(Cl)C=C1 P40217 [0,1,1,0,0,0|2,0,0]=4 238 B11R1.1 OCCOC1=CC=C(F)C=C1 P39022 [0,1,1,0,0,0|2,0,0]=4 239 B11R1.1 OCCOC1=CC=C(I)C=C1 P39004 [0,1,1,0,0,0|2,0,0]=4 240 B11R1.17 BrCCCC1=CC=CC=C1Br O28828 [0,1,1,0,0,0|1,0,0]=3 241 B11R1.17 CC1=CC=CC=C1CCCN P36201 [0,1,1,0,0,0|0,0,0]=2 242 B11R1.17 CC1=CC=CC=C1OCCBr P40239 [0,1,1,0,0,0|2,0,0]=4 243 B11R1.17 CC1=CC=CC=C1OCCN P39223 [0,1,1,0,0,0|1,0,0]=3 244 B11R1.17 CC1=CC=CC=C1OCCO P37048 [0,1,1,0,0,0|2,0,0]=4 245 B11R1.17 CNCCC1=CC=CC=C1Br Q66105 [0,1,1,0,0,0|2,0,0]=4 246 B11R1.17 CNCCC1=CC=CC=C1C P36240 [0,1,1,0,0,0|2,0,0]=4 247 B11R1.17 CNCCC1=CC=CC=C1Cl P37635 [0,1,1,0,0,0|2,0,0]=4 248 B11R1.17 CNCCC1=CC=CC=C1F P37905 [0,1,1,0,0,0|2,0,0]=4 249 B11R1.17 ClC1=CC=CC=C1CCCBr P37495 [0,1,1,0,0,0|1,0,0]=3 250 B11R1.17 ClC1=CC=CC=C1OCCBr P40241 [0,1,1,0,0,0|2,0,0]=4 251 B11R1.17 FC1=CC=CC=C1CCCBr P41797 [0,1,1,0,0,0|1,0,0]=3 252 B11R1.17 NC1=CC=CC=C1OCCO P38113 [0,1,1,0,0,0|2,0,0]=4 253 B11R1.17 NCCCC1=CC=CC=C1Br P36821 [0,1,1,0,0,0|0,0,0]=2 254 B11R1.17 NCCCC1=CC=CC=C1Cl P40265 [0,1,1,0,0,0|0,0,0]=2 255 B11R1.17 NCCCC1=CC=CC=C1F P35165 [0,1,1,0,0,0|0,0,0]=2 256 B11R1.17 NCCCN1C=CC=NC1=O S72631 [0,1,1,0,0,0|2,0,0]=4 257 B11R1.17 NCCCN1N=CC=CC1=O L20832 [0,1,1,0,0,0|2,0,0]=4 258 B11R1.17 NCCOC1=CC=CC=C1Br P39218 [0,1,1,0,0,0|1,0,0]=3 259 B11R1.17 NCCOC1=CC=CC=C1Cl P39230 [0,1,1,0,0,0|1,0,0]=3 260 B11R1.17 NCCOC1=CC=CC=C1F P42323 [0,1,1,0,0,0|1,0,0]=3 261 B11R1.17 NCCOC1=NC=CC=C1Cl Q58383 [0,1,1,0,0,0|2,0,0]=4 262 B11R1.17 NCCOC1=NC=CC=C1Cl Q58384 [0,1,1,0,0,0|2,0,0]=4 263 B11R1.17 NCCOC1=NC=CC=C1F Q58414 [0,1,1,0,0,0|2,0,0]=4 264 B11R1.17 NCCOC1=NC=CC=C1F Q58415 [0,1,1,0,0,0|2,0,0]=4 265 B11R1.17 OCCCC1=CC=CC=C1Cl P36965 [0,1,1,0,0,0|1,0,0]=3 266 B11R1.17 OCCCC1=CC=CC=C1F P36169 [0,1,1,0,0,0|1,0,0]=3 267 B11R1.17 OCCOC1=CC=CC=C1Br P38647 [0,1,1,0,0,0|2,0,0]=4 268 B11R1.17 OCCOC1=CC=CC=C1Cl P40969 [0,1,1,0,0,0|2,0,0]=4 269 B11R1.17 OCCOC1=CC=CC=C1F P39023 [0,1,1,0,0,0|2,0,0]=4 270 B11R1.17 OCCOC1=CC=CC=C1I P36652 [0,1,1,0,0,0|2,0,0]=4 271 B11R1.24 BrCCCC1=CC(Br)=CC=C1 O28830 [0,1,1,0,0,0|1,0,0]=3 272 B11R1.24 CC1=CC(CCCN)=CC=C1 P42846 [0,1,1,0,0,0|0,0,0]=2 273 B11R1.24 CC1=CC(CCCO)=CC=C1 P42630 [0,1,1,0,0,0|1,0,0]=3 274 B11R1.24 CC1=CC(OCCN)=CC=C1 P36838 [0,1,1,0,0,0|1,0,0]=3 275 B11R1.24 CC1=CC(OCCO)=CC=C1 P41522 [0,1,1,0,0,0|2,0,0]=4 276 B11R1.24 CC1=NC(NCCN)=CC=C1 Q62433 [0,1,1,0,0,0|2,0,0]=4 277 B11R1.24 CCCCC1=CC=CC(N)=N1 O30054 [0,1,1,0,0,0|2,0,0]=4 278 B11R1.24 CCCC[N+]1=CC=CC(C)=C1 O34174 [0,1,1,0,0,0|2,0,0]=4 279 B11R1.24 CCCOC1=CC(Br)=CC=C1 Q66928 [0,1,1,0,0,0|2,0,0]=4 280 B11R1.24 CNCCC1=CC=CC(Br)=C1 P36066 [0,1,1,0,0,0|2,0,0]=4 281 B11R1.24 CNCCC1=CC=CC(C)=C1 P41493 [0,1,1,0,0,0|2,0,0]=4 282 B11R1.24 CNCCC1=CC=CC(Cl)=C1 P37634 [0,1,1,0,0,0|2,0,0]=4 283 B11R1.24 CNCCC1=CC=CC(F)=C1 P37712 [0,1,1,0,0,0|2,0,0]=4 284 B11R1.24 ClC1=CC(CCCBr)=CC=C1 P35187 [0,1,1,0,0,0|1,0,0]=3 285 B11R1.24 FC1=CC(CCCBr)=CC=C1 P40928 [0,1,1,0,0,0|1,0,0]=3 286 B11R1.24 NC1=CC(CCCO)=NC=C1 Q53463 [0,1,1,0,0,0|2,0,0]=4 287 B11R1.24 NC1=CC=CC(OCCO)=C1 P37761 [0,1,1,0,0,0|2,0,0]=4 288 B11R1.24 NCCCC1=CC(O)=CC=C1 P37377 [0,1,1,0,0,0|0,0,0]=2 289 B11R1.24 NCCCC1=CC=CC(Br)=C1 P40513 [0,1,1,0,0,0|0,0,0]=2 290 B11R1.24 NCCCC1=CC=CC(Cl)=C1 P40264 [0,1,1,0,0,0|0,0,0]=2 291 B11R1.24 NCCCC1=CC=CC(F)=C1 P42845 [0,1,1,0,0,0|0,0,0]=2 292 B11R1.24 NCCCC1=CC=CC(N)=C1 P38762 [0,1,1,0,0,0|0,0,0]=2 293 B11R1.24 NCCOC1=CC(O)=CC=C1 Q66030 [0,1,1,0,0,0|1,0,0]=3 294 B11R1.24 NCCOC1=CC=CC(Br)=C1 P35063 [0,1,1,0,0,0|1,0,0]=3 295 B11R1.24 NCCOC1=CC=CC(Cl)=C1 P36837 [0,1,1,0,0,0|1,0,0]=3 296 B11R1.24 NCCOC1=CC=CC(F)=C1 P42322 [0,1,1,0,0,0|1,0,0]=3 297 B11R1.24 OCCCC1=CC=CC(Br)=C1 P36802 [0,1,1,0,0,0|1,0,0]=3 298 B11R1.24 OCCCC1=CC=CC(Cl)=C1 P39520 [0,1,1,0,0,0|1,0,0]=3 299 B11R1.24 OCCCC1=CC=CC(F)=C1 P40929 [0,1,1,0,0,0|1,0,0]=3 300 B11R1.24 OCCCC1=CC=CC(O)=C1 P41291 [0,1,1,0,0,0|1,0,0]=3 301 B11R1.24 OCCOC1=CC=CC(Br)=C1 P36001 [0,1,1,0,0,0|2,0,0]=4 302 B11R1.24 OCCOC1=CC=CC(Cl)=C1 P37049 [0,1,1,0,0,0|2,0,0]=4 303 B11R1.24 OCCOC1=CC=CC(F)=C1 P41246 [0,1,1,0,0,0|2,0,0]=4 304 B11R1.24 OCCOC1=CC=CC(I)=C1 P36653 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.28 BrCCCCC1=CC=CC=C1 P41514 [0,1,1,0,0,0|1,0,0]=3 306 B11R1.28 CCCNCC1=CC=CC=C1 P39958 [0,1,1,0,0,0|1,0,0]=3 307 B11R1.28 CNCCCC1=CC=CC=C1 P39485 [0,1,1,0,0,0|0,0,0]=2 308 B11R1.28 ClCCOCC1=CC=CC=C1 P40573 [0,1,1,0,0,0|1,0,0]=3 309 B11R1.28 ICCCCC1=CC=CC=C1 P36870 [0,1,1,0,0,0|1,0,0]=3 310 B11R1.28 ICCOCC1=CC=CC=C1 P37513 [0,1,1,0,0,0|1,0,0]=3 311 B11R1.28 N#CCOCC1=CC=CC=C1 P41519 [0,1,1,0,0,0|0,0,2]=4 312 B11R1.28 NCCCOC1=CC=CC=C1 P36207 [0,1,1,0,0,0|0,0,0]=2 313 B11R1.28 NCCCSC1=CC=CC=N1 Q58262 [0,1,1,0,0,0|1,0,0]=3 314 B11R1.28 O=CCOCC1=CC=CC=C1 P37120 [0,1,1,0,0,0|1,0,1]=4 315 B11R1.28 OCCCCC1=CC=CN=C1 P37114 [0,1,1,0,0,0|2,0,0]=4 316 B11R1.28 OCCCCC1=CC=NC=C1 P37629 [0,1,1,0,0,0|2,0,0]=4 317 B11R1.28 OCCCCC1=NC=CC=C1 P40417 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 P51547 [0,1,1,0,0,0|1,0,1]=4 319 B11R1.40 CC(CN)OC1=CC=CC=C1 P36860 [0,1,1,0,0,0|1,0,0]=3 320 B11R1.40 CC(CN)SC1=CC=CC=N1 Q58359 [0,1,1,0,0,0|2,0,0]=4 321 B11R1.40 CCC(Br)CC1=CC=NC=C1 Q58440 [0,1,1,0,0,0|2,0,0]=4 322 B11R1.40 CCC(N)CC1=CC=CC=C1 P38928 [0,1,1,0,0,0|1,0,0]=3 323 B11R1.40 CCC(O)CC1=CC=NC=C1 Q58397 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [0,1,1,0,0,0|1,0,0]=3 325 B11R1.40 NCC(=O)NC1=CC=CC=C1 P37442 [0,1,1,0,0,0|1,0,1]=4 326 B11R1.40 O=C(CBr)CC1=CC=CC=C1 O31255 [0,1,1,0,0,0|1,0,1]=4 327 B11R1.91 CC(N)COC1=CC=CC=C1 P38614 [0,1,1,0,0,0|1,0,0]=3 328 B11R1.91 NC(=O)COC1=CC=CC=C1 P51047 [0,1,1,0,0,0|1,0,1]=4 329 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 P42284 [0,1,1,0,0,0|2,0,0]=4 330 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 P36150 [0,1,1,0,0,0|2,0,0]=4 331 B11R1.20 CC(C)NC1=CC=C(F)C=C1 P36529 [0,1,1,0,0,0|2,0,0]=4 332 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Q66408 [0,1,1,0,0,0|2,0,0]=4 333 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Q67546 [0,1,1,0,0,0|2,0,0]=4 334 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [0,1,1,0,0,0|2,0,0]=4 335 B11R1.20 CC(N)CC1=CC=C(Br)C=C1 P41684 [0,1,1,0,0,0|0,0,0]=2 336 B11R1.20 CN(C)CC1=CC=C(N)C=C1 P36889 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 O31092 [0,1,1,0,0,0|1,0,1]=4 338 B11R1.86 CC(C)NC1=CC=CC=C1Br P40936 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.86 CC(C)NC1=CC=CC=C1Cl P36079 [0,1,1,0,0,0|2,0,0]=4 340 B11R1.86 CC(C)NC1=CC=CC=C1F P42616 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.86 CC(C)NC1=CC=CC=C1N P36500 [0,1,1,0,0,0|2,0,0]=4 342 B11R1.86 CC(C)OC1=CC=CC=C1F Q67217 [0,1,1,0,0,0|2,0,0]=4 343 B11R1.86 CC(N)CC1=C(O)C=CC=C1 L19732 [0,1,1,0,0,0|0,0,0]=2 344 B11R1.86 CN(C)CC1=CC=CC=C1Br Q68057 [0,1,1,0,0,0|2,0,0]=4 345 B11R1.86 CN(C)CC1=CC=CC=C1N P40192 [0,1,1,0,0,0|2,0,0]=4 346 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 P41926 [0,1,1,0,0,0|2,0,0]=4 347 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 P38903 [0,1,1,0,0,0|2,0,0]=4 348 B11R1.157 CC(C)NC1=CC=CC(F)=C1 P42251 [0,1,1,0,0,0|2,0,0]=4 349 B11R1.157 CC(C)OC1=CC(F)=CC=C1 Q66828 [0,1,1,0,0,0|2,0,0]=4 350 B11R1.157 CC(C)OC1=CC=CC(O)=C1 N24861 [0,1,1,0,0,0|2,0,0]=4 351 B11R1.157 CC1=CC(NC(C)C)=CC=C1 P42983 [0,1,1,0,0,0|2,0,0]=4 352 B11R1.157 CN(C)CC1=CC(N)=CC=C1 P39096 [0,1,1,0,0,0|2,0,0]=4 353 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 Q67698 [0,1,1,0,0,0|2,0,0]=4 354 B11R2.34 BrC1=CC=C(C2CC2)C=C1 O30566 [1,1,0,0,0,0|0,0,0]=2 355 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [1,1,0,0,0,0|1,0,0]=3 356 B11R2.34 BrC1=NN=C(C2CC2)C=C1 O34285 [1,1,0,0,0,0|2,0,0]=4 357 B11R2.34 BrC1=NN=C(C2CC2)C=C1 P51474 [1,1,0,0,0,0|2,0,0]=4 358 B11R2.34 CC1=CC=C(C2CN2)C=C1 P36371 [1,1,0,0,0,0|1,0,0]=3 359 B11R2.34 ClC1=CC=C(C2CN2)C=C1 P36104 [1,1,0,0,0,0|1,0,0]=3 360 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Q67831 [1,1,0,0,0,0|1,0,0]=3 361 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [1,1,0,0,0,0|1,0,0]=3 362 B11R2.34 FC1=NC=C(C2CC2)C=C1 N26245 [1,1,0,0,0,0|1,0,0]=3 363 B11R2.34 NC1=CC=C(C2CC2)C=C1 P38877 [1,1,0,0,0,0|0,0,0]=2 364 B11R2.34 NC1=CC=C(C2CC2)N=C1 P42501 [1,1,0,0,0,0|1,0,0]=3 365 B11R2.34 NC1=CN=C(C2CC2)N=C1 L18124 [1,1,0,0,0,0|2,0,0]=4 366 B11R2.34 O=C1C=CC(C2CC2)=NN1 O34363 [1,1,0,0,0,0|2,0,0]=4 367 B11R2.34 OC1=CC=C(C2CC2)C=C1 P42947 [1,1,0,0,0,0|0,0,0]=2 368 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [1,1,0,0,0,0|1,0,0]=3 369 B11R2.35 BrC1=CC=CC(C2CC2)=C1 O31879 [1,1,0,0,0,0|0,0,0]=2 370 B11R2.35 BrC1=CN=CC(C2CC2)=C1 N25476 [1,1,0,0,0,0|1,0,0]=3 371 B11R2.35 ClC1=CC(C2CC2)=CC=N1 I-9975 [1,1,0,0,0,0|1,0,0]=3 372 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [1,1,0,0,0,0|1,0,0]=3 373 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [1,1,0,0,0,0|1,0,0]=3 374 B11R2.35 FC1=CN=CC(C2CC2)=C1 N27151 [1,1,0,0,0,0|1,0,0]=3 375 B11R2.35 NC1=CC(C2CC2)=NC=C1 M23384 [1,1,0,0,0,0|1,0,0]=3 376 B11R2.35 OC1=CC=CC(C2CC2)=C1 O30101 [1,1,0,0,0,0|0,0,0]=2 377 B11R2.40 NC1(C2=CC=CC=C2)CC1 P38187 [1,1,0,0,0,0|0,0,0]=2 378 B11R2.40 NC1(C2=CC=CN=C2)CC1 P37810 [1,1,0,0,0,0|1,0,0]=3 379 B11R2.40 NC1(C2=CC=NC=C2)CC1 G-7840 [1,1,0,0,0,0|1,0,0]=3 380 B11R2.40 NC1(C2=CC=NC=C2)CC1 Q66089 [1,1,0,0,0,0|1,0,0]=3 381 B11R2.40 NC1(C2=NC=CC=C2)CC1 P37811 [1,1,0,0,0,0|1,0,0]=3 382 B11R2.40 NC1(C2=NC=CC=N2)CC1 L13033 [1,1,0,0,0,0|2,0,0]=4 383 B11R2.40 NC1(C2=NC=CC=N2)CC1 L18110 [1,1,0,0,0,0|2,0,0]=4 384 B11R2.40 NC1(C2=NC=CC=N2)CC1 L18111 [1,1,0,0,0,0|2,0,0]=4 385 B11R2.40 NC1(C2=NC=CN=C2)CC1 L13928 [1,1,0,0,0,0|2,0,0]=4 386 B11R2.55 BrC1=CC=CC=C1C2CO2 P36453 [1,1,0,0,0,0|1,0,0]=3 387 B11R2.55 CC1=C(C2CC2)C=NC=C1 N26487 [1,1,0,0,0,0|1,0,0]=3 388 B11R2.55 CC1=NC=CC=C1C2CC2 N26392 [1,1,0,0,0,0|1,0,0]=3 389 B11R2.55 ClC1=CC=CC=C1C2CO2 P36976 [1,1,0,0,0,0|1,0,0]=3 390 B11R2.55 ClC1=CC=CN=C1C2CC2 N25876 [1,1,0,0,0,0|1,0,0]=3 391 B11R2.55 FC1=CC=CC=C1C2CO2 Q66192 [1,1,0,0,0,0|1,0,0]=3 392 B11R2.55 FC1=NC=CC=C1C2CC2 N26254 [1,1,0,0,0,0|1,0,0]=3 393 B11R2.55 NC1=CC=CC=C1C2CC2 N24777 [1,1,0,0,0,0|0,0,0]=2 394 B11R2.55 NC1=CC=CC=C1C2CC2 P51441 [1,1,0,0,0,0|0,0,0]=2 395 B11R2.55 NC1=NC=CN=C1C2CC2 O32600 [1,1,0,0,0,0|2,0,0]=4 396 B11R2.33 N[C@H]1C[C@@H]1C2=CN=C(Br)S2 P50514 [0,1,0,0,1,0|2,0,0]=4 397 B11R2.51 CN1N=CC=C1C2CC2N L19561 [0,1,0,0,1,0|2,0,0]=4 398 B13R2.147 CC1=CC=C(C2CC(=O)N2)C=C1 P39794 [0,1,0,0,0,1|1,0,1]=4 399 B13R2.147 FC1CC(C2=CC=C(Br)C=C2)C1 P43353 [0,1,0,0,0,1|1,0,0]=3 400 B13R2.147 NC1=CC=C(C2CC(F)C2)C=C1 P43350 [0,1,0,0,0,1|1,0,0]=3 401 B13R2.147 NC1=CC=C(N2CC(O)C2)C=C1 P38669 [0,1,0,0,0,1|2,0,0]=4 402 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 P39325 [0,1,0,0,0,1|1,0,1]=4 403 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)N1 L20848 [0,1,0,0,0,1|1,0,1]=4 404 B13R2.147 O=C1CC(C2=CC=C(Cl)C=C2)N1 P39793 [0,1,0,0,0,1|1,0,1]=4 405 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)N1 P35036 [0,1,0,0,0,1|1,0,1]=4 406 B13R2.151 FC1CC(C2=CC(Br)=CC=C2)C1 P43348 [0,1,0,0,0,1|1,0,0]=3 407 B13R2.151 NC1=CC=CC(C2CC(F)C2)=C1 P43352 [0,1,0,0,0,1|1,0,0]=3 408 B13R2.151 O=C1CC(C2=CC=CC(Br)=C2)N1 P35152 [0,1,0,0,0,1|1,0,1]=4 409 B13R2.151 O=C1CC(C2=CC=CC(Cl)=C2)N1 P35037 [0,1,0,0,0,1|1,0,1]=4 410 B13R2.216 CC1=CC=CC=C1C2CC(=O)N2 P35881 [0,1,0,0,0,1|1,0,1]=4 411 B13R2.216 NC1=CC=CC=C1N2CC(O)C2 P42946 [0,1,0,0,0,1|2,0,0]=4 412 B13R2.216 O=C1CC(C2=CC=CC=C2Cl)N1 P35883 [0,1,0,0,0,1|1,0,1]=4 413 B13R2.216 O=C1CC(C2=CC=CC=C2F)N1 P35879 [0,1,0,0,0,1|1,0,1]=4 414 B13R2.238 NC1CC(O)(C2=CC=CC=C2)C1 P50557 [0,1,0,0,0,1|0,0,0]=2 415 B13R2.219 FC1(F)CNC1C2=CC=CC=C2 P44862 [0,1,0,0,0,1|1,0,0]=3 416 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 Q56881 [0,2,0,0,0,0|1,0,0]=3 417 B13R2.423 O=C(O)C1CC1C2=CC=CC=N2 L19790 [0,2,0,0,0,0|2,0,0]=4 418 B13R2.423 O=C(O)C1CC1C2=CC=NC=C2 Q69973 [0,2,0,0,0,0|2,0,0]=4 419 B13R2.423 O=C(O)C1CC1C2=NC=CC=C2 O34337 [0,2,0,0,0,0|2,0,0]=4 420 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 L22498 [0,2,0,0,0,0|1,0,0]=3 421 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 O33398 [0,2,0,0,0,0|1,0,0]=3 422 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CN=C2 H-8208 [0,2,0,0,0,0|2,0,0]=4 423 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 O33360 [0,2,0,0,0,0|1,0,0]=3 424 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 O34527 [0,2,0,0,0,0|1,0,0]=3 425 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 O32985 [0,2,0,0,0,0|1,0,0]=3 426 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 O33621 [0,2,0,0,0,0|1,0,0]=3 427 B13R2.522 N[C@H]1C[C@@H]1C2=CC(F)=C(Cl)C=C2 L14759 [0,2,0,0,0,0|0,0,0]=2 428 B13R2.2988 NC1=CC=C(C2CC2(F)F)C=C1 P43287 [0,2,0,0,0,0|1,0,0]=3 429 B13R2.154 N[C@@H]1C[C@H]1C2=CC=CC(F)=C2F A-591 [0,2,0,0,0,0|0,0,0]=2 430 B13R2.3020 NC1=CC=CC(C2CC2(F)F)=C1 P43177 [0,2,0,0,0,0|1,0,0]=3 431 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,0,1,1,0,0|0,0,2]=4 432 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,0,1,1,0,0|1,0,1]=4 433 B11R2.239 C1=CC=C(C2CCN2)C=C1 O28163 [0,0,1,1,0,0|2,0,0]=4 434 B11R2.239 C1=CC=C(C2CNC2)C=C1 10749 [0,0,1,1,0,0|0,0,0]=2 435 B11R2.239 C1=CC=C(C2CNC2)C=C1 M22666 [0,0,1,1,0,0|0,0,0]=2 436 B11R2.239 C1=CN=C(C2CNC2)C=C1 P46398 [0,0,1,1,0,0|1,0,0]=3 437 B11R2.20 C1=CC2=C(C=C1)OCCC2 P37892 [0,0,1,1,0,0|1,0,0]=3 438 B11R2.20 C1=CC2=C(C=N1)NCCN2 O29590 [0,0,1,1,0,0|2,0,0]=4 439 B11R2.20 C1=CC=C2OCCNC2=C1 P37325 [0,0,1,1,0,0|1,0,0]=3 440 B11R2.20 C1=NC=C2CCCNC2=C1 P48608 [0,0,1,1,0,0|1,0,0]=3 441 B11R2.238 C1=CC(CC2CO2)=CC=N1 Q53152 [0,0,1,1,0,0|2,0,0]=4 442 B11R2.238 C1=CC=C(NC2CC2)C=C1 M22854 [0,0,1,1,0,0|2,0,0]=4 443 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 L14886 [0,0,1,1,0,0|0,0,0]=2 444 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 I-9534 [0,0,1,1,0,0|0,0,0]=2 445 B9R1.11 NCC(O)C1=CC=CO1 P39131 [0,0,1,0,1,0|2,0,0]=4 446 B9R1.12 BrCCCC1=CC=CS1 P38955 [0,0,1,0,1,0|2,0,0]=4 447 B9R1.12 BrCCCC1=CSC=C1 P42249 [0,0,1,0,1,0|2,0,0]=4 448 B9R1.12 NCCCC1=CC=CS1 P37165 [0,0,1,0,1,0|1,0,0]=3 449 B9R1.12 NCCCC1=CON=C1 L18956 [0,0,1,0,1,0|2,0,0]=4 450 B9R1.12 NCCCN1C=CC=N1 P36232 [0,0,1,0,1,0|2,0,0]=4 451 B9R1.12 OCCCN1C=CC=C1 O31138 [0,0,1,0,1,0|2,0,0]=4 452 B9R2.2 C1=CC(C2CC2)=NN1 O31158 [1,0,0,0,1,0|2,0,0]=4 453 B9R2.2 C1=CN(C2CC2)N=C1 Q69932 [1,0,0,0,1,0|2,0,0]=4 454 B9R2.2 C1=CNC(C2CC2)=N1 C-2889 [1,0,0,0,1,0|2,0,0]=4 455 B9R2.2 C1=NC(C2CC2)=CN1 L13133 [1,0,0,0,1,0|2,0,0]=4 456 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 F-4642 [0,0,0,0,0,2|1,0,0]=3 457 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 G-7010 [0,0,0,0,0,2|1,0,0]=3 458 B13R2.31 O=C1CC(OC2=CC=CC=C2)C1 I-9905 [0,0,0,0,0,2|1,0,1]=4 459 B13R2.10 C[C@H]1CCC(C2=CC=CC=C2)N1 H-8913 [0,0,0,0,0,2|1,0,0]=3 460 B13R2.10 O=C1CC[C@@H](C2=CC=CC=C2)N1 P45465 [0,0,0,0,0,2|1,0,1]=4 461 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 Q54186 [0,0,0,0,0,2|1,0,1]=4 462 B13R2.15 N[C@@H]1CCC[C@H]1C2=CC=CC=C2 L19894 [0,0,0,0,0,2|0,0,0]=2 463 B13R2.15 OC1CCCC1C2=CC=CC=C2 P43293 [0,0,0,0,0,2|1,0,0]=3 464 B13R2.15 O[C@@H]1CNC[C@H]1C2=CC=CC=C2 F-4251 [0,0,0,0,0,2|1,0,0]=3 465 B13R2.15 O[C@@H]1CNC[C@H]1C2=CC=CC=C2 L13344 [0,0,0,0,0,2|1,0,0]=3 466 B13R2.15 O[C@@H]1CNC[C@H]1C2=CC=CC=C2 L22146 [0,0,0,0,0,2|1,0,0]=3