0 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 CC(O)C1=CN=CN=C1 Q55478 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.6 NC(=O)C1=NC=NC=C1 P51213 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.6 O=C(O)[C@@H]1CC=CCC1 I-9874 [0,0,0,0,0,0|0,0,4]=4 22 B9R1.6 O=C(O)[C@H]1CC=CCC1 G-7812 [0,0,0,0,0,0|0,0,4]=4 23 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [0,0,0,0,0,0|2,0,1]=3 24 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [0,0,0,0,0,0|2,0,1]=3 25 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.6 OB(O)C1=CC=NC=C1 C-3686 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.6 OB(O)C1=CN=CN=C1 A-805 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.6 OB(O)C1=NC=NC=C1 H-8023 [0,0,0,0,0,0|3,0,1]=4 29 B8R1.2 BrCC1=CC=CN=C1 P36550 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.2 C#CC1=CC=NC=C1 G-7546 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.2 C#CC1=CC=NC=C1 L13525 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 C=CC1=CC=CN=C1 O30687 [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 ICC1=CC=CC=C1 P37031 [1,0,0,0,0,0|1,0,1]=3 39 B8R1.2 N#CC1=CC=NC=C1 Q58209 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.2 NCC1=CC=NC=C1 O30621 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 NNC1=CC=CN=C1 C-3227 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 NNC1=CC=NC=C1 C-3226 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.2 NNC1=CC=NC=C1 L19135 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 NNC1=CC=NC=C1 O31964 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 OCC1=CC=CN=N1 C-2224 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 OCC1=CC=NC=N1 C-2228 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.2 OCC1=CC=NN=C1 C-2213 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.2 OCC1=CN=CC=N1 C-2217 [1,0,0,0,0,0|2,0,1]=4 49 B8R1.2 OCC1=CN=CN=C1 C-2215 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.2 OCC1=NC=CC=N1 C-2220 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [0,1,0,0,0,0|2,0,0]=3 53 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.13 CC(=O)C1=CN=C(C)N=C1 H-8030 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 Q54991 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 G-7164 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.13 CC(=O)C1=NC=C(C)C=N1 O31005 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.13 CC(=O)C1=NC=C(C)N=C1 F-4678 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 O30416 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.13 CC(=O)C1=NC=C(F)C=N1 O30210 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 L13130 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.13 CC(=O)C1=NN=C(O)C=C1 P51623 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [0,1,0,0,0,0|2,0,1]=4 71 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [0,1,0,0,0,0|2,0,1]=4 72 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [0,1,0,0,0,0|1,0,1]=3 73 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [0,1,0,0,0,0|1,0,1]=3 74 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [0,1,0,0,0,0|2,0,1]=4 75 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [0,1,0,0,0,0|2,0,0]=3 79 B10R1.13 CC1=NC=C(B(O)O)C=C1 Q66950 [0,1,0,0,0,0|2,0,1]=4 80 B10R1.13 CC1=NC=C(C(=O)O)C=N1 P44549 [0,1,0,0,0,0|2,0,0]=3 81 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 I-9184 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [0,1,0,0,0,0|2,0,1]=4 83 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [0,1,0,0,0,0|2,0,1]=4 87 B10R1.13 N=C(N)C1=CC=C(Br)N=C1 Q52330 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 N=C(N)C1=CC=C(N)C=N1 Q58199 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 N=C(N)C1=CN=C(F)C=C1 G-5718 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.13 N=C(N)C1=NC=C(Br)C=C1 Q52329 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 G-5717 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 N=C(N)C1=NC=C(F)C=C1 C-2886 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.13 NC(=O)C1=CC=C(Br)N=C1 P35365 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 O30890 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 N24759 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 O31863 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.13 NC(=O)C1=NN=C(N)C=C1 G-7026 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.13 NC1=CC=C(B(O)O)C=C1 Q66344 [0,1,0,0,0,0|1,0,1]=3 102 B10R1.13 NC1=CC=C(B(O)O)C=N1 G-5207 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.13 NC1=CN=C(C(=O)O)C=N1 10608 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 NC1=CN=C(C(=O)O)N=C1 O33536 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [0,1,0,0,0,0|1,0,0]=2 108 B10R1.13 NC1=NN=C(C(=O)O)C=C1 G-5218 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.13 O=C(Cl)C1=NC=C(Cl)C=C1 N25108 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 Q64836 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 G-5309 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.13 O=C(O)C1=CN=C(O)N=C1 O31007 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 Q52548 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 G-7253 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 B-1219 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.13 O=C(O)C1=NC=C(F)C=N1 H-8066 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 L14250 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 B-1753 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.13 O=[N+]([O-])C1=CC=C(Br)N=C1 E-3076 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 10648 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 O=[N+]([O-])C1=NC=C(F)C=C1 O30344 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.13 OB(O)C1=CC=C(O)N=C1 Q68881 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 OB(O)C1=CC=C(S)C=C1 P39473 [0,1,0,0,0,0|1,0,1]=3 129 B10R1.13 OB(O)C1=CN=C(F)C=C1 P51343 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.13 OB(O)C1=NC=C(Br)C=C1 Q53805 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.13 OB(O)C1=NC=C(F)C=C1 O33560 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [0,1,0,0,0,0|2,0,0]=3 134 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [0,1,0,0,0,0|1,0,1]=3 141 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [0,1,0,0,0,0|1,0,1]=3 155 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [0,1,0,0,0,0|1,0,1]=3 156 B10R1.15 NNC(=O)C1=NC=NC=C1 O30565 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.15 O=C(CBr)C1=CN=CN=C1 Q54899 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.15 O=C(CBr)C1=NC=CC=N1 L22105 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.15 O=C(CBr)C1=NC=CC=N1 Q52568 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.15 O=C(CBr)C1=NC=NC=C1 P51516 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.15 O=C(CCl)C1=NC=CN=C1 L19661 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [0,1,0,0,0,0|2,0,1]=4 166 B10R1.28 CC(C)(O)C1=NC=CC=C1 M15802 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 C-3245 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 C-3246 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.28 O=S(=O)(Cl)C1=CC=NC=C1 F-4410 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 C-3244 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 P45341 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 P51550 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.61 CC(=O)C1=CN=CN=C1C Q58769 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [0,1,0,0,0,0|2,0,0]=3 183 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.61 CC(=O)C1=NC=CN=C1Cl G-7946 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.61 CC(Br)C1=CC=CC=C1F O31043 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.61 CC(Cl)C1=CC=CC=C1Cl P40025 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.61 CC(N)C1=CC=CC=C1Br O34378 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.61 CC(N)C1=CC=CC=C1Cl P38305 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.61 CC(N)C1=CC=CC=C1F P36297 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.61 CC(N)C1=CC=CC=C1N P38310 [0,1,0,0,0,0|2,0,1]=4 192 B10R1.61 CC(O)C1=C(F)C=NC=C1 Q65366 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.61 CC(O)C1=CC=CN=C1Br O30716 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.61 CC(O)C1=CC=CN=C1Cl P41711 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.61 CC(O)C1=CC=CN=C1F N26796 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.61 CC1=C(B(O)O)C=CN=C1 I-9950 [0,1,0,0,0,0|2,0,1]=4 197 B10R1.61 CC1=C(B(O)O)C=NC=C1 Q66522 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.61 CC1=C(C(=O)O)C=CN=C1 Q56301 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.61 CC1=C(C(=O)O)C=NN=C1 G-5521 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.61 CC1=C(C(=O)O)N=NC=C1 L13035 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 C-3702 [0,1,0,0,0,0|2,0,1]=4 202 B10R1.61 CC1=CC=CC=C1C(C)N P38147 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] G-6919 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.61 CC1=CN=CN=C1C(=O)O O33331 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.61 CC1=NC=CC=C1B(O)O N24577 [0,1,0,0,0,0|2,0,1]=4 207 B10R1.61 CC1=NC=CC=C1B(O)O P43526 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] C-3336 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.61 CC1=NC=CN=C1C(=O)O G-5660 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.61 CN(C)C1=CC=CC=C1O P38469 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.61 C[C@@H](O)C1=CC=CN=C1N Q62533 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.61 C[C@H](N)C1=CC=CC=C1Br P51405 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [0,1,0,0,0,0|1,0,1]=3 216 B10R1.61 C[C@H](O)C1=CC=CN=C1N Q62532 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.61 N=C(N)C1=CC=CC=C1F P51589 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.61 N=C(N)C1=NC=CC=C1F O32719 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.61 N=C(N)C1=NC=CC=C1F O32720 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 N25046 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.61 NC(=O)C1=C(N)C=CN=C1 C-3535 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 NC(=O)C1=CC=CN=C1F N25255 [0,1,0,0,0,0|2,0,0]=3 223 B10R1.61 NC(=O)C1=CC=NC=C1N O34515 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.61 NC(=O)C1=CN=CN=C1O O34320 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.61 NC(=O)C1=NC=CC=C1N C-3697 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72547 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72548 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.61 NC1=C(C(=O)O)C=CN=C1 G-6779 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.61 NC1=C(C(=O)O)N=CN=C1 Q57220 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [0,1,0,0,0,0|1,0,0]=2 232 B10R1.61 NC1=CC=NC=C1N(=O)=O A-908 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.61 NC1=NC=CC=C1B(O)O Q68886 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] C-3682 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.61 NC1=NN=CC=C1C(=O)O M15199 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.61 O=C(Cl)C1=CC=CN=C1Br N24418 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.61 O=C(Cl)C1=CC=CN=C1F N25171 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 G-5495 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.61 O=C(O)C1=C(Br)N=CN=C1 H-8378 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [0,1,0,0,0,0|1,0,0]=2 242 B10R1.61 O=C(O)C1=C(Cl)N=CN=C1 H-8380 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.61 O=C(O)C1=C(F)C=NC=C1 G-7559 [0,1,0,0,0,0|1,0,0]=2 244 B10R1.61 O=C(O)C1=C(I)C=NC=C1 O31943 [0,1,0,0,0,0|1,0,0]=2 245 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.61 O=C(O)C1=CN=CNC1=O H-8379 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [0,1,0,0,0,0|1,0,0]=2 249 B10R1.61 O=C(O)C1=NC=CN=C1Br S70901 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.61 O=C(O)C1=NC=CN=C1Cl G-5403 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.61 O=C(O)C1=NC=CN=C1I O29988 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.61 O=C(O)C1=NC=CN=C1O C-3727 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.61 O=C(O)C1=NC=NC=C1Cl P51523 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 O=C(O)C1=NC=NC=C1F O33158 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.61 O=C1NC=CC=C1B(O)O G-7460 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 O30658 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.61 O=[N+]([O-])C1=C(I)C=CN=C1 Q52538 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 10600 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br C-3687 [0,1,0,0,0,0|2,0,1]=4 260 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O G-5324 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O L13797 [0,1,0,0,0,0|2,0,1]=4 262 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N25518 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N26550 [0,1,0,0,0,0|2,0,1]=4 264 B10R1.61 OB(O)C1=C(Br)C=CN=C1 O29115 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.61 OB(O)C1=C(Br)C=NC=C1 Q66417 [0,1,0,0,0,0|2,0,1]=4 266 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 M24062 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 N24124 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.61 OB(O)C1=C(F)C=CN=C1 Q54495 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.61 OB(O)C1=C(F)C=NC=C1 N24272 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.61 OB(O)C1=CC=CC=C1I Q67114 [0,1,0,0,0,0|1,0,1]=3 271 B10R1.61 OB(O)C1=CC=CN=C1Br Q66269 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.61 OB(O)C1=NC=CC=C1F Q53806 [0,1,0,0,0,0|2,0,1]=4 273 B10R1.61 OB(O)C1=NC=CC=C1O Q62472 [0,1,0,0,0,0|2,0,1]=4 274 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.113 CC(=O)C1=CC(C)=NC=N1 M15580 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.113 CC(=O)C1=NC=CC(C)=N1 Q65344 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [0,1,0,0,0,0|2,0,1]=4 286 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [0,1,0,0,0,0|2,0,1]=4 288 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [0,1,0,0,0,0|2,0,1]=4 289 B10R1.113 CC(O)C1=CC(Cl)=NC=C1 P42079 [0,1,0,0,0,0|2,0,1]=4 290 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.113 CC1=CC(C(=O)O)=CN=N1 P49779 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.113 CC1=CC(C(=O)O)=NN=C1 L14505 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [0,1,0,0,0,0|2,0,1]=4 294 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [0,1,0,0,0,0|2,0,1]=4 295 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.113 CC1=CN=CC(C(=O)O)=N1 G-6898 [0,1,0,0,0,0|2,0,0]=3 297 B10R1.113 CC1=NC(C(=O)O)=NC=C1 L14301 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.113 CC1=NC=CC(B(O)O)=C1 O30330 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.113 CC1=NC=NC(C(=O)O)=C1 I-9646 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [0,1,0,0,0,0|2,0,1]=4 302 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 P51219 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58426 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58427 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.113 N=C(N)C1=CC=CC(N)=N1 Q58197 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 O29660 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [0,1,0,0,0,0|1,0,0]=2 309 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 O30750 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 G-6824 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 G-7501 [0,1,0,0,0,0|2,0,0]=3 312 B10R1.113 NC(=S)C1=NC=CC(N)=C1 Q54468 [0,1,0,0,0,0|2,1,0]=4 313 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 10638 [0,1,0,0,0,0|2,0,1]=4 314 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 O32690 [0,1,0,0,0,0|2,0,1]=4 315 B10R1.113 NC1=CN=CC(B(O)O)=C1 Q68878 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.113 NC1=NC=CC(B(O)O)=C1 Q52829 [0,1,0,0,0,0|2,0,1]=4 317 B10R1.113 NC1=NC=CC(C(=O)O)=C1 G-6760 [0,1,0,0,0,0|1,0,0]=2 318 B10R1.113 NC1=NC=CC(C(=O)O)=N1 O31660 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 A-722 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 Q66304 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 O30825 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 Q68020 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 G-6966 [0,1,0,0,0,0|2,0,0]=3 324 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 G-7305 [0,1,0,0,0,0|2,0,0]=3 325 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [0,1,0,0,0,0|1,0,0]=2 327 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [0,1,0,0,0,0|1,0,0]=2 328 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [0,1,0,0,0,0|1,0,0]=2 329 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C-2323 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [0,1,0,0,0,0|1,0,0]=2 331 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 O30875 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.113 O=C(O)C1=NC(O)=NC=C1 O30222 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [0,1,0,0,0,0|1,0,0]=2 334 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [0,1,0,0,0,0|1,0,0]=2 335 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [0,1,0,0,0,0|1,0,0]=2 336 B10R1.113 O=C1C=C(C(=O)O)NC=N1 Q57219 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.113 O=[N+]([O-])C1=CC(F)=NC=C1 O31098 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 O30304 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 O30887 [0,1,0,0,0,0|2,0,1]=4 340 B10R1.113 O=[N+]([O-])C1=CC=NC(Br)=C1 E-3102 [0,1,0,0,0,0|2,0,1]=4 341 B10R1.113 O=[N+]([O-])C1=NC=CC(Br)=C1 Q53333 [0,1,0,0,0,0|2,0,1]=4 342 B10R1.113 OB(O)C1=CC(Br)=CN=C1 P38023 [0,1,0,0,0,0|2,0,1]=4 343 B10R1.113 OB(O)C1=CC(Cl)=CC=N1 Q53792 [0,1,0,0,0,0|2,0,1]=4 344 B10R1.113 OB(O)C1=CC(F)=NC=C1 Q66308 [0,1,0,0,0,0|2,0,1]=4 345 B10R1.113 OB(O)C1=CC(O)=CN=C1 Q68880 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.113 OB(O)C1=CC=CC(I)=C1 Q66503 [0,1,0,0,0,0|1,0,1]=3 347 B10R1.113 OB(O)C1=CC=NC(O)=C1 Q53788 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.113 OB(O)C1=CN=CC(F)=C1 F-4263 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.113 OB(O)C1=NC(Br)=CC=C1 Q53725 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.113 OB(O)C1=NC(Cl)=CC=C1 A-717 [0,1,0,0,0,0|2,0,1]=4 351 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [0,0,0,1,0,0|2,0,1]=4 352 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [0,0,0,1,0,0|2,0,1]=4 353 B8R1.7 CC(=O)C1=CNC=N1 P51504 [0,0,0,0,1,0|3,0,0]=4 354 B8R1.7 CC(=O)C1=CNN=C1 H-8406 [0,0,0,0,1,0|3,0,0]=4 355 B8R1.7 CC(=O)C1=NNC=C1 Q62132 [0,0,0,0,1,0|3,0,0]=4 356 B8R1.7 CC(O)C1=CSC=C1 O31068 [0,0,0,0,1,0|2,0,1]=4 357 B8R1.7 NC(=O)C1=CC=CN1 P38018 [0,0,0,0,1,0|2,0,0]=3 358 B8R1.7 NC(=O)C1=CN=CO1 O31664 [0,0,0,0,1,0|3,0,0]=4 359 B8R1.7 NC(=O)C1=CN=CS1 O30585 [0,0,0,0,1,0|3,0,0]=4 360 B8R1.7 NC(=O)C1=CNC=N1 M15544 [0,0,0,0,1,0|3,0,0]=4 361 B8R1.7 NC(=O)C1=COC=N1 O34456 [0,0,0,0,1,0|3,0,0]=4 362 B8R1.7 O=C(Cl)C1=NC=CS1 O31126 [0,0,0,0,1,0|3,0,0]=4 363 B8R1.7 O=C(O)C1=CC=NS1 P51141 [0,0,0,0,1,0|2,0,0]=3 364 B8R1.7 O=C(O)C1=CNN=C1 G-5584 [0,0,0,0,1,0|2,0,0]=3 365 B8R1.7 O=C(O)C1=CNN=N1 F-4261 [0,0,0,0,1,0|3,0,0]=4 366 B8R1.7 O=C(O)C1=COC=N1 I-9284 [0,0,0,0,1,0|2,0,0]=3 367 B8R1.7 O=C(O)C1=COCC1 C-2964 [0,0,0,0,1,0|1,0,2]=4 368 B8R1.7 O=C(O)C1=CSN=C1 L22423 [0,0,0,0,1,0|2,0,0]=3 369 B8R1.7 O=C(O)C1=NC=CO1 F-4564 [0,0,0,0,1,0|2,0,0]=3 370 B8R1.7 O=C(O)C1=NC=NO1 H-8647 [0,0,0,0,1,0|3,0,0]=4 371 B8R1.7 O=C(O)C1=NNC=C1 I-9172 [0,0,0,0,1,0|2,0,0]=3 372 B8R1.7 O=C(O)C1=NSC=C1 O30998 [0,0,0,0,1,0|2,0,0]=3 373 B8R1.7 O=C(O)C1CC=CC1 G-6381 [0,0,0,0,1,0|0,0,3]=4 374 B8R1.7 O=C(O)[C@@H]1C=CCN1 P39990 [0,0,0,0,1,0|1,0,2]=4 375 B8R1.7 O=C(O)[C@H]1C=CCN1 M22943 [0,0,0,0,1,0|1,0,2]=4 376 B8R1.7 O=C([O-])C1=NC=CO1 K16120 [0,0,0,0,1,0|2,0,1]=4 377 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [0,0,0,0,0,1|2,0,0]=3 378 B10R1.18 CC(=O)NC1=NC=NC=C1 O29559 [0,0,0,0,0,1|3,0,0]=4 379 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [0,0,0,0,0,1|2,1,0]=4 380 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [0,0,0,0,0,1|2,0,0]=3 381 B10R1.18 O=C(O)CC1=CN=CN=C1 O33591 [0,0,0,0,0,1|2,0,0]=3 382 B10R1.18 O=C(O)CC1=CN=NC=C1 G-5165 [0,0,0,0,0,1|2,0,0]=3 383 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [0,0,0,0,0,1|2,0,0]=3 384 B10R1.18 O=C([O-])CC1=CC=NN=C1 L13382 [0,0,0,0,0,1|2,0,1]=4 385 B10R1.18 O=C([O-])CC1=NC=CC=N1 Q51814 [0,0,0,0,0,1|2,0,1]=4 386 B10R1.18 O=C([O-])CC1=NN=CC=C1 L13418 [0,0,0,0,0,1|2,0,1]=4 387 B7R1.3 O=C1C=CC=NN1 C-2425 [2,0,0,0,0,0|2,0,0]=4 388 B7R1.3 O=C1C=CN=CN1 C-2283 [2,0,0,0,0,0|2,0,0]=4 389 B7R1.3 OC1=CC=NN=C1 H-8637 [2,0,0,0,0,0|2,0,0]=4 390 B7R1.3 OC1=CN=CN=C1 I-9410 [2,0,0,0,0,0|2,0,0]=4 391 B7R1.3 OC1=CN=CN=C1 N25469 [2,0,0,0,0,0|2,0,0]=4 392 B7R1.3 SC1=CC=CN=C1 Q62383 [2,0,0,0,0,0|1,1,0]=4 393 B9R1.1 C#CC1=CC=C(Br)C=C1 P36174 [1,1,0,0,0,0|1,0,1]=4 394 B9R1.1 C#CC1=CC=C(Cl)C=C1 C-3288 [1,1,0,0,0,0|1,0,1]=4 395 B9R1.1 C#CC1=CC=C(I)C=C1 P36173 [1,1,0,0,0,0|1,0,1]=4 396 B9R1.1 C(=O)C1=CN=C(Cl)C=C1 E-3026 [1,1,0,0,0,0|1,0,0]=3 397 B9R1.1 C(=O)C1=CN=C(Cl)N=C1 C-3437 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.1 C=CC1=CN=C(Br)C=C1 Q62407 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.1 C=CC1=CN=C(C)C=C1 L13585 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.1 C=CC1=CN=C(F)C=C1 L14939 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.1 C=CC1=CN=C(F)C=C1 O29601 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.1 C=CC1=NC=C(Cl)C=C1 O33380 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.1 CC1=CC=C(CO)C=N1 H-8186 [1,1,0,0,0,0|1,0,1]=4 404 B9R1.1 CC1=CN=C(C=O)C=C1 Q67276 [1,1,0,0,0,0|1,0,0]=3 405 B9R1.1 CC1=CN=C(C=O)C=N1 O30472 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.1 CC1=CN=C(C=O)N=C1 G-6319 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.1 CC1=CN=C(CO)C=C1 N24952 [1,1,0,0,0,0|1,0,1]=4 408 B9R1.1 CC1=NC=C(C=O)C=C1 C-2363 [1,1,0,0,0,0|1,0,0]=3 409 B9R1.1 CC1=NC=C(C=O)C=N1 A-729 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.1 N#CC1=CC=C(S)C=C1 O30392 [1,1,0,0,0,0|1,0,1]=4 414 B9R1.1 NC1=CC=C(C=O)C=N1 L13611 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.1 NC1=CN=C(C=O)C=N1 P51620 [1,1,0,0,0,0|2,0,0]=4 416 B9R1.1 NC1=NC=C(CO)C=C1 E-3098 [1,1,0,0,0,0|1,0,1]=4 417 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [1,1,0,0,0,0|1,0,1]=4 418 B9R1.1 NNC1=CC=C(Br)C=C1 P38159 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.1 NNC1=CC=C(F)C=C1 P38478 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.1 O=CC1=CC=C(O)C=N1 P44434 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.1 O=CC1=CN=C(Br)N=C1 Q53659 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.1 O=CC1=CN=C(F)C=C1 P50975 [1,1,0,0,0,0|1,0,0]=3 423 B9R1.1 O=CC1=NC=C(Br)C=N1 G-6054 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.1 O=CC1=NC=C(Cl)C=C1 Q67275 [1,1,0,0,0,0|1,0,0]=3 425 B9R1.1 O=CC1=NC=C(Cl)N=C1 I-9606 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.1 O=CC1=NC=C(F)C=C1 O30696 [1,1,0,0,0,0|1,0,0]=3 427 B9R1.1 O=CC1=NC=C(F)C=N1 G-7866 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.1 O=CC1=NN=C(Cl)C=C1 G-7962 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.1 O=CC1=NN=C(O)C=C1 O30370 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.1 OCC1=CC=C(Br)N=C1 O34239 [1,1,0,0,0,0|1,0,1]=4 431 B9R1.1 OCC1=CC=C(F)N=C1 O30867 [1,1,0,0,0,0|1,0,1]=4 432 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [1,1,0,0,0,0|0,0,1]=3 433 B9R1.1 OCC1=NC=C(Cl)C=C1 N24430 [1,1,0,0,0,0|1,0,1]=4 434 B9R1.1 OCC1=NC=C(F)C=C1 C-3467 [1,1,0,0,0,0|1,0,1]=4 435 B9R1.2 C#CC1=CC(O)=CC=C1 P42883 [1,1,0,0,0,0|1,0,1]=4 436 B9R1.2 C#CC1=CC=CC(Br)=C1 O27910 [1,1,0,0,0,0|1,0,1]=4 437 B9R1.2 C#CC1=CC=CC(C)=C1 P36176 [1,1,0,0,0,0|1,0,1]=4 438 B9R1.2 C(=O)C1=CC=CC(Br)=N1 C-3289 [1,1,0,0,0,0|1,0,0]=3 439 B9R1.2 C(=O)C1=CC=NC(Cl)=C1 C-3314 [1,1,0,0,0,0|1,0,0]=3 440 B9R1.2 C(=O)C1=CC=NC(Cl)=N1 Q56440 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.2 C=CC1=CN=CC(C)=C1 O31501 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.2 C=CC1=CN=CC(F)=C1 L21838 [1,1,0,0,0,0|2,0,0]=4 443 B9R1.2 C=CC1=NC(Br)=CC=C1 L18289 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.2 CC1=CC(C=O)=NC=C1 O31911 [1,1,0,0,0,0|1,0,0]=3 445 B9R1.2 CC1=CC(C=O)=NC=N1 Q60298 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.2 CC1=CC=NC(C=O)=N1 P44430 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.2 CC1=CN=CC(C=O)=C1 M15605 [1,1,0,0,0,0|1,0,0]=3 448 B9R1.2 CC1=CN=CC(CO)=C1 I-9425 [1,1,0,0,0,0|1,0,1]=4 449 B9R1.2 CC1=NC=CC(CO)=C1 O30864 [1,1,0,0,0,0|1,0,1]=4 450 B9R1.2 CNC1=CC(O)=CC=C1 P41161 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.2 CNC1=CC=CC(I)=C1 P37043 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.2 NC1=CC(C=O)=CC=C1 O30581 [1,1,0,0,0,0|0,0,0]=2 453 B9R1.2 NC1=CC(CO)=NC=C1 P43136 [1,1,0,0,0,0|1,0,1]=4 454 B9R1.2 NC1=NC(C=O)=CC=C1 Q53329 [1,1,0,0,0,0|1,0,0]=3 455 B9R1.2 NC1=NC=CC(C=O)=C1 G-5572 [1,1,0,0,0,0|1,0,0]=3 456 B9R1.2 NC1=NC=CC(CO)=C1 G-7574 [1,1,0,0,0,0|1,0,1]=4 457 B9R1.2 NCC1=CC(O)=CC=C1 P36367 [1,1,0,0,0,0|1,0,1]=4 458 B9R1.2 NCC1=CC=CC(F)=C1 N26365 [1,1,0,0,0,0|1,0,1]=4 459 B9R1.2 O=C1C=C(CO)C=CN1 C-2797 [1,1,0,0,0,0|1,0,1]=4 460 B9R1.2 O=C1C=CC=C(CO)N1 Q52489 [1,1,0,0,0,0|1,0,1]=4 461 B9R1.2 O=CC1=CC(Cl)=CN=C1 L21834 [1,1,0,0,0,0|1,0,0]=3 462 B9R1.2 O=CC1=CC(Cl)=NC=N1 Q52806 [1,1,0,0,0,0|2,0,0]=4 463 B9R1.2 O=CC1=CC(F)=CN=C1 C-3502 [1,1,0,0,0,0|1,0,0]=3 464 B9R1.2 O=CC1=CC(F)=NC=C1 Q66309 [1,1,0,0,0,0|1,0,0]=3 465 B9R1.2 O=CC1=CC(O)=CN=C1 O31574 [1,1,0,0,0,0|1,0,0]=3 466 B9R1.2 O=CC1=NC(Br)=CC=N1 Q56237 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.2 O=CC1=NC=CC(Cl)=C1 G-5341 [1,1,0,0,0,0|1,0,0]=3 468 B9R1.2 O=CC1=NC=CC(F)=C1 Q56665 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.2 O=CC1=NC=CC(O)=C1 Q53140 [1,1,0,0,0,0|1,0,0]=3 470 B9R1.2 O=CC1=NC=NC(O)=C1 S72508 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.2 OC1=CC=CC(CBr)=C1 O29845 [1,1,0,0,0,0|1,0,1]=4 472 B9R1.2 OCC1=CC(Cl)=CN=C1 P39543 [1,1,0,0,0,0|1,0,1]=4 473 B9R1.2 OCC1=CC(Cl)=NC=C1 Q67739 [1,1,0,0,0,0|1,0,1]=4 474 B9R1.2 OCC1=CC(F)=CN=C1 C-3496 [1,1,0,0,0,0|1,0,1]=4 475 B9R1.2 OCC1=CC(F)=NC=C1 P41706 [1,1,0,0,0,0|1,0,1]=4 476 B9R1.2 OCC1=CN=CC(Br)=C1 P38449 [1,1,0,0,0,0|1,0,1]=4 477 B9R1.2 OCC1=NC(Br)=CC=C1 P38733 [1,1,0,0,0,0|1,0,1]=4 478 B9R1.2 OCC1=NC(F)=CC=C1 P38880 [1,1,0,0,0,0|1,0,1]=4 479 B9R1.2 OCC1=NC=CC(Br)=C1 B-1208 [1,1,0,0,0,0|1,0,1]=4 480 B9R1.2 OCC1=NC=CC(F)=C1 O29281 [1,1,0,0,0,0|1,0,1]=4 481 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,1,0,0,0,0|1,0,1]=4 483 B9R1.8 O=C=NC1=NC=CC=C1 P43266 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,1,0,0,0,0|1,0,0]=3 485 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,1,0,0,0,0|1,0,1]=4 486 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.8 O\N=C\C1=CC=NC=N1 Q58586 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.15 C#CC1=CC=CC=C1Br O27884 [1,1,0,0,0,0|1,0,1]=4 489 B9R1.15 C#CC1=CC=CC=C1C O28000 [1,1,0,0,0,0|1,0,1]=4 490 B9R1.15 C#CC1=CC=CC=C1N L13529 [1,1,0,0,0,0|1,0,1]=4 491 B9R1.15 C#CC1=CC=CC=C1O O30353 [1,1,0,0,0,0|1,0,1]=4 492 B9R1.15 C(=O)C1=C(O)C=CN=C1 Q57085 [1,1,0,0,0,0|1,0,0]=3 493 B9R1.15 C(=O)C1=CC=CN=C1C C-2892 [1,1,0,0,0,0|1,0,0]=3 494 B9R1.15 C(=O)C1=CC=CN=C1N E-3082 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.15 C(=O)C1=CN=CC=C1C C-2893 [1,1,0,0,0,0|1,0,0]=3 496 B9R1.15 C(=O)C1=CN=CN=C1N Q55481 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.15 C(=O)C1=NC=CN=C1Cl L18467 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.15 C(=O)C1=NC=CN=C1N C-3433 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.15 C(=O)C1=NC=NC=C1N Q55482 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.15 C=CC1=C(C)N=CC=C1 L14938 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.15 C=CC1=CC=CC=C1N O30540 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.15 C=CC1=CC=CN=C1Br O29963 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.15 CC1=C(C=O)N=CC=C1 G-5812 [1,1,0,0,0,0|1,0,0]=3 504 B9R1.15 CC1=C(CO)C=NC=C1 G-7931 [1,1,0,0,0,0|1,0,1]=4 505 B9R1.15 CC1=C(CO)N=CC=C1 Q62329 [1,1,0,0,0,0|1,0,1]=4 506 B9R1.15 CC1=CN=CC=C1CO C-2894 [1,1,0,0,0,0|1,0,1]=4 507 B9R1.15 CC1=NC=CC=C1CO 10789 [1,1,0,0,0,0|1,0,1]=4 508 B9R1.15 CC1=NC=NC=C1C=O Q60398 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.15 NC1=C(C=O)C=CN=C1 I-9640 [1,1,0,0,0,0|1,0,0]=3 510 B9R1.15 NC1=C(C=O)C=NC=C1 Q51902 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.15 NC1=C(CO)C=NC=C1 O34460 [1,1,0,0,0,0|1,0,1]=4 512 B9R1.15 NC1=CC=CC=C1CO G-7793 [1,1,0,0,0,0|0,0,1]=3 513 B9R1.15 NC1=NC=CC=C1CO O32321 [1,1,0,0,0,0|1,0,1]=4 514 B9R1.15 NCC1=CC=CC=C1Br P38336 [1,1,0,0,0,0|1,0,1]=4 515 B9R1.15 NCC1=CC=CC=C1I P38307 [1,1,0,0,0,0|1,0,1]=4 516 B9R1.15 O=C1NC=CC=C1CO L18304 [1,1,0,0,0,0|1,0,1]=4 517 B9R1.15 O=CC1=C(Br)C=CN=C1 L14209 [1,1,0,0,0,0|1,0,0]=3 518 B9R1.15 O=CC1=C(Br)C=CN=C1 L21843 [1,1,0,0,0,0|1,0,0]=3 519 B9R1.15 O=CC1=C(Br)C=CN=C1 N24911 [1,1,0,0,0,0|1,0,0]=3 520 B9R1.15 O=CC1=C(Br)C=NC=C1 Q66929 [1,1,0,0,0,0|1,0,0]=3 521 B9R1.15 O=CC1=C(Br)C=NC=C1 Q67986 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.15 O=CC1=C(Cl)C=CN=C1 G-7008 [1,1,0,0,0,0|1,0,0]=3 523 B9R1.15 O=CC1=C(Cl)C=CN=C1 N24210 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.15 O=CC1=C(Cl)C=NC=C1 N27329 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.15 O=CC1=C(Cl)N=CN=C1 Q53710 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.15 O=CC1=C(F)C=CN=C1 Q56666 [1,1,0,0,0,0|1,0,0]=3 527 B9R1.15 O=CC1=C(I)C=CC=C1 G-5775 [1,1,0,0,0,0|0,0,0]=2 528 B9R1.15 O=CC1=NC=CC=C1Br O31907 [1,1,0,0,0,0|1,0,0]=3 529 B9R1.15 O=CC1=NC=CC=C1Cl O31967 [1,1,0,0,0,0|1,0,0]=3 530 B9R1.15 O=CC1=NC=CC=C1F Q66589 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.15 O=CC1=NC=CC=C1O L22205 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.15 OCC1=C(Br)C=CN=C1 N25303 [1,1,0,0,0,0|1,0,1]=4 533 B9R1.15 OCC1=C(Br)C=CN=C1 N25521 [1,1,0,0,0,0|1,0,1]=4 534 B9R1.15 OCC1=C(Br)C=CN=C1 N25828 [1,1,0,0,0,0|1,0,1]=4 535 B9R1.15 OCC1=C(Br)C=NC=C1 P41171 [1,1,0,0,0,0|1,0,1]=4 536 B9R1.15 OCC1=C(Cl)C=CN=C1 O31919 [1,1,0,0,0,0|1,0,1]=4 537 B9R1.15 OCC1=C(Cl)C=NC=C1 P36007 [1,1,0,0,0,0|1,0,1]=4 538 B9R1.15 OCC1=C(F)C=CN=C1 L14446 [1,1,0,0,0,0|1,0,1]=4 539 B9R1.15 OCC1=C(F)C=CN=C1 Q55508 [1,1,0,0,0,0|1,0,1]=4 540 B9R1.15 OCC1=C(F)C=NC=C1 G-5482 [1,1,0,0,0,0|1,0,1]=4 541 B9R1.15 OCC1=CC=CN=C1Br P41707 [1,1,0,0,0,0|1,0,1]=4 542 B9R1.15 OCC1=CC=CN=C1Cl C-3458 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.15 OCC1=CC=CN=C1F Q67775 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.15 OCC1=NC=CC=C1F C-2822 [1,1,0,0,0,0|1,0,1]=4 545 B9R1.15 OCC1=NC=CC=C1O P41369 [1,1,0,0,0,0|1,0,1]=4 546 B9R1.11 COC(=O)C1=CC=CN1 G-7797 [0,1,0,0,1,0|1,0,0]=3 547 B9R1.11 COC(=O)C1=CN=CO1 O30359 [0,1,0,0,1,0|2,0,0]=4 548 B9R1.11 COC(=O)C1=CN=CS1 P48087 [0,1,0,0,1,0|2,0,0]=4 549 B9R1.11 COC(=O)C1=CNN=C1 G-7338 [0,1,0,0,1,0|2,0,0]=4 550 B9R1.11 COC(=O)C1=NC=CN1 G-6057 [0,1,0,0,1,0|2,0,0]=4 551 B9R1.11 COC(=O)C1=NC=CS1 P37422 [0,1,0,0,1,0|2,0,0]=4 552 B9R1.11 COC(=O)C1=NNC=C1 P40994 [0,1,0,0,1,0|2,0,0]=4 553 B9R1.11 O=C(CBr)C1=CC=CS1 P43533 [0,1,0,0,1,0|2,0,0]=4 554 B9R1.11 O=C(CBr)C1=CSC=C1 O31908 [0,1,0,0,1,0|2,0,0]=4 555 B9R1.11 O=CC(=O)C1=CC=CS1 P41441 [0,1,0,0,1,0|1,0,1]=4 556 B9R1.35 CC(=O)C1=CC(Br)=CS1 Q67343 [0,1,0,0,1,0|2,0,0]=4 557 B9R1.35 CC(=O)C1=CSC(Cl)=C1 G-5625 [0,1,0,0,1,0|2,0,0]=4 558 B9R1.35 CC1=CC(C(=O)O)=CN1 M15493 [0,1,0,0,1,0|1,0,0]=3 559 B9R1.35 CC1=CC(C(=O)O)=CS1 I-9860 [0,1,0,0,1,0|1,0,0]=3 560 B9R1.35 CC1=CC(C(=O)O)=NN1 G-6037 [0,1,0,0,1,0|2,0,0]=4 561 B9R1.35 CC1=COC(C(=O)O)=C1 O29596 [0,1,0,0,1,0|1,0,0]=3 562 B9R1.35 CC1=CSC(C(=O)O)=C1 G-7586 [0,1,0,0,1,0|1,0,0]=3 563 B9R1.35 CC1=NOC(C(=O)O)=C1 O30705 [0,1,0,0,1,0|2,0,0]=4 564 B9R1.35 CN1C=C(C(=O)O)C=N1 G-5543 [0,1,0,0,1,0|2,0,0]=4 565 B9R1.35 CN1C=CC(C(=O)O)=N1 K12250 [0,1,0,0,1,0|2,0,0]=4 566 B9R1.35 CN1C=NC(C(=O)O)=C1 G-5691 [0,1,0,0,1,0|2,0,0]=4 567 B9R1.35 NC(=O)C1=CC=C(Br)N1 G-6434 [0,1,0,0,1,0|2,0,0]=4 568 B9R1.35 NC1=CN=C(C(=O)O)S1 G-5065 [0,1,0,0,1,0|2,0,0]=4 569 B9R1.35 NC1=NC(C(=O)O)=CO1 G-7158 [0,1,0,0,1,0|2,0,0]=4 570 B9R1.35 NC1=NC(C(=O)O)=CS1 O30841 [0,1,0,0,1,0|2,0,0]=4 571 B9R1.35 O=C(O)C1=CC(Br)=NN1 H-8098 [0,1,0,0,1,0|2,0,0]=4 572 B9R1.35 O=C(O)C1=CC(Cl)=CS1 O30065 [0,1,0,0,1,0|1,0,0]=3 573 B9R1.35 O=C(O)C1=CC=C(Cl)S1 G-6814 [0,1,0,0,1,0|1,0,0]=3 574 B9R1.35 O=C(O)C1=CC=C(F)S1 G-5621 [0,1,0,0,1,0|1,0,0]=3 575 B9R1.35 O=C(O)C1=CN=C(Cl)S1 O31901 [0,1,0,0,1,0|2,0,0]=4 576 B9R1.35 O=C(O)C1=COC(Cl)=N1 O30387 [0,1,0,0,1,0|2,0,0]=4 577 B9R1.35 O=C(O)C1=CSC(Cl)=C1 G-5624 [0,1,0,0,1,0|1,0,0]=3 578 B9R1.35 O=C(O)C1=NC(Br)=CS1 G-6045 [0,1,0,0,1,0|2,0,0]=4 579 B9R1.35 O=C(O)C1=NC=C(Br)S1 I-9912 [0,1,0,0,1,0|2,0,0]=4 580 B9R1.35 O=C(O)C1=NC=C(Cl)S1 I-9904 [0,1,0,0,1,0|2,0,0]=4 581 B9R1.35 O=C(O)C1=NNC(Br)=C1 H-8089 [0,1,0,0,1,0|2,0,0]=4 582 B9R1.35 O=C(O)C1=NNC(Cl)=C1 O34355 [0,1,0,0,1,0|2,0,0]=4 583 B9R1.35 O=C(O)C1=NNC(F)=C1 Q52440 [0,1,0,0,1,0|2,0,0]=4 584 B9R1.35 O=C1C=C(C(=O)O)CC1 O30224 [0,1,0,0,1,0|0,0,2]=4 585 B9R1.35 O=C1NC=C(C(=O)O)N1 O34427 [0,1,0,0,1,0|2,0,0]=4 586 B9R1.41 CC(=O)C1=C(Br)C=CS1 Q65588 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.41 CC1=C(C(=O)O)N=CO1 O31842 [0,1,0,0,1,0|2,0,0]=4 588 B9R1.41 CC1=C(C(=O)O)N=CS1 10657 [0,1,0,0,1,0|2,0,0]=4 589 B9R1.41 CC1=C(C(=O)O)NC=N1 L20560 [0,1,0,0,1,0|2,0,0]=4 590 B9R1.41 CC1=CSC=C1C(=O)O L22411 [0,1,0,0,1,0|1,0,0]=3 591 B9R1.41 CN1C=NC=C1C(=O)O G-7569 [0,1,0,0,1,0|2,0,0]=4 592 B9R1.41 CN1N=CC=C1C(=O)O G-5544 [0,1,0,0,1,0|2,0,0]=4 593 B9R1.41 NC(=O)C1=CC=CN1N L13700 [0,1,0,0,1,0|2,0,0]=4 594 B9R1.41 NC1=C(C(=O)O)C=CS1 P44611 [0,1,0,0,1,0|1,0,0]=3 595 B9R1.41 NC1=C(C(=O)O)C=NN1 A-808 [0,1,0,0,1,0|2,0,0]=4 596 B9R1.41 O=C(O)C1=C(Br)C=CS1 G-6768 [0,1,0,0,1,0|1,0,0]=3 597 B9R1.41 O=C(O)C1=C(Br)N=CN1 H-8119 [0,1,0,0,1,0|2,0,0]=4 598 B9R1.41 O=C(O)C1=C(Br)N=CS1 Q68781 [0,1,0,0,1,0|2,0,0]=4 599 B9R1.41 O=C(O)C1=C(Br)SC=N1 O34437 [0,1,0,0,1,0|2,0,0]=4 600 B9R1.41 O=C(O)C1=C(Cl)C=CN1 H-8302 [0,1,0,0,1,0|1,0,0]=3 601 B9R1.41 O=C(O)C1=CNN=C1Br Q61498 [0,1,0,0,1,0|2,0,0]=4 602 B9R1.41 O=C(O)C1=CNNC1=O F-4837 [0,1,0,0,1,0|2,0,0]=4 603 B9R1.41 O=C(O)C1=CSC=C1Br G-7938 [0,1,0,0,1,0|1,0,0]=3 604 B9R1.41 O=C(O)C1=NNC=C1F Q64164 [0,1,0,0,1,0|2,0,0]=4 605 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 P38969 [0,1,0,0,0,1|2,0,0]=4 606 B11R1.20 CC(=O)NC1=CC=C(N)N=C1 Q58423 [0,1,0,0,0,1|2,0,0]=4 607 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 L19034 [0,1,0,0,0,1|2,0,0]=4 608 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 M15214 [0,1,0,0,0,1|2,0,0]=4 609 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 P40160 [0,1,0,0,0,1|1,0,0]=3 610 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 P41430 [0,1,0,0,0,1|1,0,0]=3 611 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 P43234 [0,1,0,0,0,1|1,1,0]=4 612 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 O31092 [0,1,0,0,0,1|1,0,0]=3 613 B11R1.20 NC1=CN=C(CC(=O)O)N=C1 F-4355 [0,1,0,0,0,1|2,0,0]=4 614 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 Q62419 [0,1,0,0,0,1|1,0,0]=3 615 B11R1.20 O=C(O)CC1=CC=C(Br)N=C1 P38230 [0,1,0,0,0,1|1,0,0]=3 616 B11R1.20 O=C(O)CC1=CC=C(F)C=N1 I-9943 [0,1,0,0,0,1|1,0,0]=3 617 B11R1.20 O=C(O)CC1=CC=C(I)C=N1 P49243 [0,1,0,0,0,1|1,0,0]=3 618 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 L13539 [0,1,0,0,0,1|1,0,0]=3 619 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 G-6586 [0,1,0,0,0,1|2,0,0]=4 620 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 Q52525 [0,1,0,0,0,1|1,0,0]=3 621 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 L14934 [0,1,0,0,0,1|2,0,0]=4 622 B11R1.36 CC(C(=O)O)C1=CC=CN=C1 O29526 [0,1,0,0,0,1|1,0,0]=3 623 B11R1.36 CC(C(=O)O)C1=NC=CC=C1 O29926 [0,1,0,0,0,1|1,0,0]=3 624 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 P37697 [0,1,0,0,0,1|1,0,0]=3 625 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 Q63762 [0,1,0,0,0,1|1,0,0]=3 626 B11R1.36 NC(C(=O)O)C1=CN=CN=C1 Q63768 [0,1,0,0,0,1|2,0,0]=4 627 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 Q63763 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.36 N[C@@H](C(=O)O)C1=CN=CN=C1 Q63769 [0,1,0,0,0,1|2,0,0]=4 629 B11R1.36 N[C@H](C(=O)O)C1=CC=NC=C1 Q63764 [0,1,0,0,0,1|1,0,0]=3 630 B11R1.36 N[C@H](C(=O)O)C1=CN=CN=C1 Q63770 [0,1,0,0,0,1|2,0,0]=4 631 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58337 [0,1,0,0,0,1|1,0,0]=3 632 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58338 [0,1,0,0,0,1|1,0,0]=3 633 B11R1.40 C=CC(=O)NC1=CC=CC=N1 Q58307 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.40 C=CC(=O)NC1=CC=CN=C1 Q58308 [0,1,0,0,0,1|2,0,0]=4 635 B11R1.40 COC(=O)CC1=CC=CN=C1 P38302 [0,1,0,0,0,1|1,0,0]=3 636 B11R1.40 COC(=O)CC1=CC=NN=C1 G-6745 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.40 COC(=O)CC1=NC=NC=C1 P44252 [0,1,0,0,0,1|2,0,0]=4 638 B11R1.40 COC(=O)CC1=NN=CC=C1 G-6749 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [0,1,0,0,0,1|1,0,1]=4 640 B11R1.40 NCC(=O)NC1=CC=CC=C1 P37442 [0,1,0,0,0,1|1,0,0]=3 641 B11R1.40 NNC(=O)CC1=CC=NC=C1 P36560 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.40 O=C(CBr)CC1=CC=CC=C1 O31255 [0,1,0,0,0,1|1,0,0]=3 643 B11R1.40 O=C(CBr)NC1=CC=CC=C1 P37595 [0,1,0,0,0,1|1,0,0]=3 644 B11R1.40 O=C(CC1=CC=CC=C1)NO P37592 [0,1,0,0,0,1|0,0,0]=2 645 B11R1.40 O=C(CCl)NC1=CC=CN=C1 P36081 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.86 CC(=O)CC1=NC=CC=C1Br Q58439 [0,1,0,0,0,1|2,0,0]=4 647 B11R1.86 CC(=O)CC1=NC=CC=C1Cl Q58438 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.86 CC(=O)OC1=CC=CC=C1Br P40333 [0,1,0,0,0,1|1,0,0]=3 649 B11R1.86 CC1=C(CC(=O)O)C=CC=N1 H-8205 [0,1,0,0,0,1|1,0,0]=3 650 B11R1.86 CC1=CC=NC=C1CC(=O)O Q60617 [0,1,0,0,0,1|1,0,0]=3 651 B11R1.86 FC1=CC=CC=C1C=C(Br)Br P43279 [0,1,0,0,0,1|2,0,0]=4 652 B11R1.86 NC1=CC=CC=C1CC(=O)O P38750 [0,1,0,0,0,1|0,0,0]=2 653 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 Q60647 [0,1,0,0,0,1|1,0,0]=3 654 B11R1.86 O=C(O)CC1=CC=CN=C1Cl G-5570 [0,1,0,0,0,1|1,0,0]=3 655 B11R1.86 O=C(O)CC1=CC=NC=C1Cl Q60592 [0,1,0,0,0,1|1,0,0]=3 656 B11R1.86 O=C(O)CC1=NC=CC=C1Br I-9578 [0,1,0,0,0,1|1,0,0]=3 657 B11R1.86 O=C(O)CC1=NC=CC=C1O F-4648 [0,1,0,0,0,1|1,0,0]=3 658 B11R1.86 OB(O)CC1=C(Cl)C=CC=C1 L20522 [0,1,0,0,0,1|1,0,1]=4 659 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 Q69806 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 P38633 [0,1,0,0,0,1|1,0,0]=3 661 B11R1.157 CC1=CC(CB(O)O)=CC=C1 L20484 [0,1,0,0,0,1|1,0,1]=4 662 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 L21790 [0,1,0,0,0,1|1,0,0]=3 663 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 Q60602 [0,1,0,0,0,1|1,0,0]=3 664 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 M15842 [0,1,0,0,0,1|1,0,0]=3 665 B11R1.157 CC1=CC=NC(CC(=O)O)=C1 Q52544 [0,1,0,0,0,1|1,0,0]=3 666 B11R1.157 CC1=NC=CC(CC(=O)O)=C1 Q52656 [0,1,0,0,0,1|1,0,0]=3 667 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 C-3500 [0,1,0,0,0,1|1,0,0]=3 668 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 P42693 [0,1,0,0,0,1|1,0,0]=3 669 B11R1.157 O=C(O)CC1=NC(F)=CC=C1 L21789 [0,1,0,0,0,1|1,0,0]=3 670 B11R1.157 O=C(O)CC1=NC(O)=CC=C1 S72816 [0,1,0,0,0,1|1,0,0]=3 671 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 Q60753 [0,1,0,0,0,1|1,0,0]=3 672 B11R1.157 O=C(O)CC1=NC=CC(F)=C1 Q60777 [0,1,0,0,0,1|1,0,0]=3 673 B11R1.509 O=S(=O)(O)CC1=CC=CC=N1 Q62430 [0,1,0,0,0,1|2,0,0]=4 674 B11R1.3 C#CC1=CC=C(B(O)O)C=C1 P39238 [0,2,0,0,0,0|1,0,1]=4 675 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 O28118 [0,2,0,0,0,0|0,0,0]=2 676 B11R1.3 C#CC1=CC=C(C(=O)O)C=N1 Q53214 [0,2,0,0,0,0|1,0,0]=3 677 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,2,0,0,0,0|1,0,0]=3 678 B11R1.3 C#CC1=CC=C([N+](=O)[O-])C=C1 S86243 [0,2,0,0,0,0|1,0,1]=4 679 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,2,0,0,0,0|1,0,0]=3 680 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,2,0,0,0,0|1,0,0]=3 681 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 P37663 [0,2,0,0,0,0|1,0,1]=4 682 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [0,2,0,0,0,0|2,0,0]=4 683 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [0,2,0,0,0,0|1,0,1]=4 684 B11R1.3 CCC1=CN=C(C(=O)O)C=N1 P43454 [0,2,0,0,0,0|2,0,0]=4 685 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 Q60524 [0,2,0,0,0,0|1,0,0]=3 686 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 P50006 [0,2,0,0,0,0|1,0,1]=4 687 B11R1.3 COC1=CN=C(C(=O)O)C=C1 Q68348 [0,2,0,0,0,0|1,0,0]=3 688 B11R1.3 COC1=CN=C(C(=O)O)C=N1 O31701 [0,2,0,0,0,0|2,0,0]=4 689 B11R1.3 COC1=CN=C(C(=O)O)N=C1 Q52332 [0,2,0,0,0,0|2,0,0]=4 690 B11R1.3 COC1=NC=C(C(=O)O)C=N1 Q67508 [0,2,0,0,0,0|2,0,0]=4 691 B11R1.3 COC1=NN=C(C(=O)O)C=C1 L22364 [0,2,0,0,0,0|2,0,0]=4 692 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 N24630 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 P43237 [0,2,0,0,0,0|1,0,0]=3 694 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 P38941 [0,2,0,0,0,0|1,0,0]=3 695 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 P43253 [0,2,0,0,0,0|1,0,0]=3 696 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 E-3027 [0,2,0,0,0,0|1,0,0]=3 697 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 G-6152 [0,2,0,0,0,0|2,0,0]=4 698 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 P37128 [0,2,0,0,0,0|1,0,0]=3 699 B11R1.3 NCC1=CC=C(B(O)O)C=C1 O30152 [0,2,0,0,0,0|1,0,1]=4 700 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 O28757 [0,2,0,0,0,0|1,0,0]=3 701 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 P50970 [0,2,0,0,0,0|1,0,1]=4 702 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 G-5405 [0,2,0,0,0,0|1,0,0]=3 703 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 A-701 [0,2,0,0,0,0|1,0,1]=4 704 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 P44354 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [0,2,0,0,0,0|0,0,0]=2 706 B11R1.3 O=CC1=CC=C(C(=O)O)C=N1 Q62284 [0,2,0,0,0,0|1,0,0]=3 707 B11R1.3 O=CC1=CN=C(C(=O)O)C=C1 Q60215 [0,2,0,0,0,0|1,0,0]=3 708 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 G-6969 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 P39871 [0,2,0,0,0,0|1,0,1]=4 710 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1765 [0,2,0,0,0,0|1,0,0]=3 711 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1766 [0,2,0,0,0,0|1,0,0]=3 712 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 G-6636-1 [0,2,0,0,0,0|1,0,0]=3 713 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H-8848 [0,2,0,0,0,0|1,0,0]=3 714 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 L14045 [0,2,0,0,0,0|1,0,0]=3 715 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O32785 [0,2,0,0,0,0|1,0,0]=3 716 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P45972 [0,2,0,0,0,0|1,0,0]=3 717 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P48341 [0,2,0,0,0,0|1,0,0]=3 718 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P50560 [0,2,0,0,0,0|1,0,0]=3 719 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q54491 [0,2,0,0,0,0|1,0,0]=3 720 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56087 [0,2,0,0,0,0|1,0,0]=3 721 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56091 [0,2,0,0,0,0|1,0,0]=3 722 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q69557 [0,2,0,0,0,0|1,0,0]=3 723 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 G-7786 [0,2,0,0,0,0|1,0,1]=4 724 B11R1.19 CS(=N)(=O)C1=CC=C(Cl)C=C1 F-4632 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 M15585 [0,2,0,0,0,0|1,0,0]=3 726 B11R1.21 CC(=O)C1=CC(Cl)=C(C)N=C1 O29923 [0,2,0,0,0,0|2,0,0]=4 727 B11R1.21 CC(=O)C1=CC=C(Br)C(Cl)=C1 M15796 [0,2,0,0,0,0|1,0,0]=3 728 B11R1.21 CC(=O)C1=CC=C(Cl)C(Br)=C1 Q66292 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 N25331 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 Q67058 [0,2,0,0,0,0|1,0,1]=4 731 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 N24268 [0,2,0,0,0,0|1,0,1]=4 732 B11R1.21 CC1=C(Br)N=C(C(=O)O)C=C1 Q53116 [0,2,0,0,0,0|1,0,0]=3 733 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=N1 Q60858 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 N25142 [0,2,0,0,0,0|1,0,1]=4 735 B11R1.21 CC1=C(O)C=C(C(=O)O)C=N1 Q60795 [0,2,0,0,0,0|1,0,0]=3 736 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 N26054 [0,2,0,0,0,0|1,0,1]=4 737 B11R1.21 CC1=C(O)N=CC(C(=O)O)=C1 L19518 [0,2,0,0,0,0|1,0,0]=3 738 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl Q66430 [0,2,0,0,0,0|1,0,1]=4 739 B11R1.21 CC1=CC(C(=O)Cl)=NC=C1Br N27305 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.21 CC1=CC(C(=O)O)=CN=C1Br Q66669 [0,2,0,0,0,0|1,0,0]=3 741 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q68802 [0,2,0,0,0,0|1,0,0]=3 742 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q69971 [0,2,0,0,0,0|1,0,0]=3 743 B11R1.21 CC1=CC(C(=O)O)=CN=C1Cl N25124 [0,2,0,0,0,0|1,0,0]=3 744 B11R1.21 CC1=CC(C(=O)O)=CN=C1F Q66670 [0,2,0,0,0,0|1,0,0]=3 745 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br Q67785 [0,2,0,0,0,0|1,0,0]=3 746 B11R1.21 CC1=CC(C(N)=O)=CC=C1N M15755 [0,2,0,0,0,0|1,0,0]=3 747 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br N25351 [0,2,0,0,0,0|2,0,0]=4 748 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Q67305 [0,2,0,0,0,0|1,0,1]=4 749 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66342 [0,2,0,0,0,0|1,0,1]=4 750 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66343 [0,2,0,0,0,0|1,0,1]=4 751 B11R1.21 CC1=CC=C(C(C)O)C=C1C M22902 [0,2,0,0,0,0|1,0,1]=4 752 B11R1.21 CC1=CN=C(C(=O)O)C=C1C Q60799 [0,2,0,0,0,0|1,0,0]=3 753 B11R1.21 CC1=CN=C(C(=O)O)C=C1Cl Q52680 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.21 CC1=CN=C(C(=O)O)C=C1N Q53529 [0,2,0,0,0,0|1,0,0]=3 755 B11R1.21 CC1=NC(C(=O)Cl)=CC=C1Br N27313 [0,2,0,0,0,0|2,0,0]=4 756 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br Q67308 [0,2,0,0,0,0|1,0,0]=3 757 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br N25229 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br P51094 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.21 CC1=NC=C(C(=O)O)C=C1N G-6537 [0,2,0,0,0,0|1,0,0]=3 760 B11R1.21 CN1C=C(C(=O)O)C=CC1=O G-5206 [0,2,0,0,0,0|1,0,0]=3 761 B11R1.21 CN1C=CC(C(=O)O)=CC1=O C-2302 [0,2,0,0,0,0|1,0,0]=3 762 B11R1.21 CN1C=CC(C(N)=O)=CC1=O I-9710 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.21 CN1N=C(C(=O)O)C=CC1=O L21788 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 O30355 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 O30426 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.21 NC(=O)C1=CC(F)=C(Cl)N=C1 O29836 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.21 NC(=O)C1=NC(Br)=C(F)C=C1 O31506 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.21 NC1=C(Br)N=C(C(=O)O)C=N1 C-2776 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.21 NC1=C(O)C=C(C(=O)O)C=N1 L19943 [0,2,0,0,0,0|1,0,0]=3 770 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 A-871 [0,2,0,0,0,0|0,0,0]=2 771 B11R1.21 NC1=C(S)C=CC(C(=O)O)=C1 H-8774 [0,2,0,0,0,0|0,0,0]=2 772 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66341 [0,2,0,0,0,0|1,0,1]=4 773 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66772 [0,2,0,0,0,0|1,0,1]=4 774 B11R1.21 NC1=CC(C(=O)O)=CC=C1S K16116 [0,2,0,0,0,0|0,0,0]=2 775 B11R1.21 NC1=CC(C(=O)O)=NC=C1Br L13873 [0,2,0,0,0,0|1,0,0]=3 776 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1S K12275 [0,2,0,0,0,0|1,0,1]=4 777 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10924 [0,2,0,0,0,0|1,0,1]=4 778 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10938 [0,2,0,0,0,0|1,0,1]=4 779 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 C-3764 [0,2,0,0,0,0|1,0,0]=3 780 B11R1.21 O=C(O)C1=CC(F)=C(Cl)N=C1 O31712 [0,2,0,0,0,0|1,0,0]=3 781 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 P37038 [0,2,0,0,0,0|0,0,0]=2 782 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 K13440 [0,2,0,0,0,0|0,0,0]=2 783 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 L13055 [0,2,0,0,0,0|1,0,0]=3 784 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 O31936 [0,2,0,0,0,0|1,0,0]=3 785 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 O33279 [0,2,0,0,0,0|1,0,0]=3 786 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 L18290 [0,2,0,0,0,0|1,0,0]=3 787 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 F-4046 [0,2,0,0,0,0|1,0,0]=3 788 B11R1.21 O=C(O)C1=NC(O)=C(F)C=C1 Q60811 [0,2,0,0,0,0|1,0,0]=3 789 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 Q65591 [0,2,0,0,0,0|1,0,0]=3 790 B11R1.21 O=C(O)C1=NC=C(Cl)C(Cl)=C1 Q60752 [0,2,0,0,0,0|1,0,0]=3 791 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 P45931 [0,2,0,0,0,0|1,0,1]=4 792 B11R1.21 O=[N+]([O-])C1=CC=C(Br)C(O)=C1 O31196 [0,2,0,0,0,0|1,0,1]=4 793 B11R1.21 OB(O)C1=CC(Br)=C(Cl)C=C1 N24750 [0,2,0,0,0,0|1,0,1]=4 794 B11R1.21 OB(O)C1=CC(Br)=C(F)C=C1 N25430 [0,2,0,0,0,0|1,0,1]=4 795 B11R1.21 OB(O)C1=CC(Cl)=C(Br)C=C1 N25064 [0,2,0,0,0,0|1,0,1]=4 796 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 P44661 [0,2,0,0,0,0|1,0,1]=4 797 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 N24197 [0,2,0,0,0,0|1,0,1]=4 798 B11R1.21 OB(O)C1=CC(O)=C(Br)C=C1 N25862 [0,2,0,0,0,0|1,0,1]=4 799 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 N25249 [0,2,0,0,0,0|1,0,1]=4 800 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 N24560 [0,2,0,0,0,0|1,0,1]=4 801 B11R1.21 OB(O)C1=CC=C(O)C(Cl)=C1 Q66714 [0,2,0,0,0,0|1,0,1]=4 802 B11R1.21 OB(O)C1=CC=C(O)C(F)=C1 O31813 [0,2,0,0,0,0|1,0,1]=4 803 B11R1.22 C#CC(=O)C1=CC=C(Cl)C=C1 P39524 [0,2,0,0,0,0|1,0,0]=3 804 B11R1.22 C#CC(O)C1=CC=C(Cl)C=C1 P38985 [0,2,0,0,0,0|1,0,1]=4 805 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 P40808 [0,2,0,0,0,0|0,0,1]=3 806 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [0,2,0,0,0,0|1,0,0]=3 807 B11R1.22 CC1=CC=C(C(=O)NN)C=N1 P40085 [0,2,0,0,0,0|2,0,0]=4 808 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,2,0,0,0,0|1,0,1]=4 809 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,2,0,0,0,0|1,0,1]=4 810 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,2,0,0,0,0|1,0,1]=4 811 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,2,0,0,0,0|1,0,1]=4 812 B11R1.22 CC1=NC=C(C(=O)CBr)C=C1 Q52597 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,2,0,0,0,0|1,0,1]=4 814 B11R1.22 CNC(=O)C1=CC=C(Br)N=C1 P35629 [0,2,0,0,0,0|2,0,0]=4 815 B11R1.22 CNC(=O)C1=CC=C(N)N=C1 S72671 [0,2,0,0,0,0|2,0,0]=4 816 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 P50985 [0,2,0,0,0,0|2,0,0]=4 817 B11R1.22 CNC(=O)C1=NC=C(O)C=C1 O30530 [0,2,0,0,0,0|2,0,0]=4 818 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 C-3212 [0,2,0,0,0,0|1,0,0]=3 819 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 C-3291 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.22 COC(=O)C1=CC=C(N)C=N1 C-2286 [0,2,0,0,0,0|1,0,0]=3 821 B11R1.22 COC(=O)C1=CC=C(O)N=N1 C-2379 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.22 COC(=O)C1=CC=C(S)N=C1 H-8392 [0,2,0,0,0,0|1,0,0]=3 823 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 Q64835 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.22 COC(=O)C1=CN=C(C)N=C1 L13555 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 C-2772 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.22 COC(=O)C1=CN=C(F)C=C1 Q66489 [0,2,0,0,0,0|1,0,0]=3 827 B11R1.22 COC(=O)C1=CN=C(N)C=N1 C-3306 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.22 COC(=O)C1=CN=C(O)C=C1 G-5577 [0,2,0,0,0,0|1,0,0]=3 829 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 O30862 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.22 COC(=O)C1=NC=C(C)C=N1 G-5731 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 G-5538 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.22 COC(=O)C1=NC=C(F)C=C1 Q54927 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.22 COC(=O)C1=NC=C(F)C=N1 O34307 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.22 COC(=O)C1=NC=C(N)C=N1 C-2775 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.22 COC(=O)C1=NC=C(N)C=N1 G-5008 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.22 COC(=O)C1=NC=C(N)N=C1 O31116 [0,2,0,0,0,0|2,0,0]=4 837 B11R1.22 COC(=O)C1=NC=C(O)C=C1 G-5601 [0,2,0,0,0,0|1,0,0]=3 838 B11R1.22 COC(=O)C1=NC=C(O)C=N1 Q55461 [0,2,0,0,0,0|2,0,0]=4 839 B11R1.22 COC(=O)C1=NN=C(N)C=C1 G-5477 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,2,0,0,0,0|1,0,1]=4 841 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,2,0,0,0,0|1,0,1]=4 842 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,2,0,0,0,0|1,0,1]=4 843 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [0,2,0,0,0,0|1,0,0]=3 844 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,2,0,0,0,0|1,0,1]=4 845 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,2,0,0,0,0|1,0,1]=4 846 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,2,0,0,0,0|1,0,1]=4 847 B11R1.22 NNC(=O)C1=CC=[N+]([O-])C=C1 L19826 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,2,0,0,0,0|1,0,1]=4 849 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,2,0,0,0,0|1,0,1]=4 850 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,2,0,0,0,0|1,0,1]=4 851 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,2,0,0,0,0|1,0,1]=4 852 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,2,0,0,0,0|1,0,1]=4 853 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,2,0,0,0,0|1,0,1]=4 854 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 O31201 [0,2,0,0,0,0|1,0,0]=3 855 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 P35986 [0,2,0,0,0,0|0,0,1]=3 856 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 O31353 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.166 CC(=O)C1=CC=C(C)C=C1Br P42929 [0,2,0,0,0,0|1,0,0]=3 858 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl O30258 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1N Q69764 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.166 CC(=O)C1=CC=C(N)C=C1Cl O32522 [0,2,0,0,0,0|1,0,0]=3 861 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl Q62398 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C O31315 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.166 CC(=O)C1=NC=C(Br)C=C1Cl O31321 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Br O30236 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C O29675 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F O30130 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.166 CC(=O)C1=NC=C(F)C=C1Br O31291 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.166 CC(=O)C1=NC=C(F)C=C1Cl O29749 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.166 CC(=O)C1=NC=C(F)C=C1F O32686 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.166 CC1=CC(=O)NC=C1C(=O)O Q57090 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.166 CC1=CC(Br)=CC=C1B(O)O N25479 [0,2,0,0,0,0|1,0,1]=4 872 B11R1.166 CC1=CC(Br)=CN=C1C(=O)Cl N24228 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O N25137 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O N26124 [0,2,0,0,0,0|1,0,0]=3 875 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O N25656 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 C-3216 [0,2,0,0,0,0|1,0,1]=4 877 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 Q60789 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.166 CC1=CC(F)=NC=C1C(=O)O Q67322 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.166 CC1=CC(O)=CC=C1B(O)O Q66536 [0,2,0,0,0,0|1,0,1]=4 880 B11R1.166 CC1=CC(O)=CN=C1C(=O)O Q60879 [0,2,0,0,0,0|1,0,0]=3 881 B11R1.166 CC1=CC=C(B(O)O)C(Br)=C1 N26773 [0,2,0,0,0,0|1,0,1]=4 882 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 G-5911 [0,2,0,0,0,0|1,0,1]=4 883 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 L13612 [0,2,0,0,0,0|1,0,0]=3 884 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=C1 Q67791 [0,2,0,0,0,0|1,0,1]=4 885 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 O31836 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 O31096 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 I-9719 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.166 CC1=CN=C(C(=O)O)C(O)=N1 K12278 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 O31639 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.166 CC1=NC(Br)=C(C(=O)O)C=N1 H-8399 [0,2,0,0,0,0|2,0,0]=4 891 B11R1.166 CC1=NC(Br)=CC=C1C(=O)O N26103 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 P51309 [0,2,0,0,0,0|1,0,0]=3 893 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 Q60943 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.166 CC1=NC(Cl)=CC=C1C(=O)O N25033 [0,2,0,0,0,0|1,0,0]=3 895 B11R1.166 CC1=NC(Cl)=NC=C1C(=O)O O30245 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.166 CC1=NC(F)=C(C(=O)O)C=C1 N24616 [0,2,0,0,0,0|1,0,0]=3 897 B11R1.166 CC1=NC(F)=CC=C1C(=O)O Q67993 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.166 CC1=NC(N)=NC=C1C(=O)O O30878 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.166 CC1=NC(O)=CC=C1C(=O)O Q52564 [0,2,0,0,0,0|1,0,0]=3 900 B11R1.166 CC1=NC=C(C(=O)O)C(C)=N1 O34423 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 M15159 [0,2,0,0,0,0|1,0,0]=3 902 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 H-8401 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl O30415 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)N=C1 H-8999 [0,2,0,0,0,0|2,0,0]=4 905 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 N24181 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 F-4223 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 O32779 [0,2,0,0,0,0|2,0,0]=4 908 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl Q68006 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Br Q68008 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl Q67952 [0,2,0,0,0,0|2,0,0]=4 911 B11R1.166 NC(=O)C1=CC=C(O)C=C1F O30471 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F O31169 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N C-3698 [0,2,0,0,0,0|2,0,0]=4 914 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F O30034 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O C-2276 [0,2,0,0,0,0|1,0,0]=3 916 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6102 [0,2,0,0,0,0|1,0,0]=3 917 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6103 [0,2,0,0,0,0|1,0,0]=3 918 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O I-9422 [0,2,0,0,0,0|1,0,0]=3 919 B11R1.166 NC1=CC(F)=C(C(=O)O)N=C1 Q55031 [0,2,0,0,0,0|1,0,0]=3 920 B11R1.166 NC1=CC(F)=CN=C1C(=O)O O33092 [0,2,0,0,0,0|1,0,0]=3 921 B11R1.166 NC1=CC(F)=NC=C1C(=O)O G-7587 [0,2,0,0,0,0|1,0,0]=3 922 B11R1.166 NC1=CC(I)=CC=C1C(=O)O O32287 [0,2,0,0,0,0|0,0,0]=2 923 B11R1.166 NC1=CC=C(C(=O)O)C(Br)=N1 Q64646 [0,2,0,0,0,0|1,0,0]=3 924 B11R1.166 NC1=NC(Cl)=CC=C1C(=O)O C-2357 [0,2,0,0,0,0|1,0,0]=3 925 B11R1.166 NC1=NC(O)=CC=C1C(=O)O L19692 [0,2,0,0,0,0|1,0,0]=3 926 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Q67951 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 F-4417 [0,2,0,0,0,0|1,0,0]=3 928 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=N1 Q60904 [0,2,0,0,0,0|1,0,0]=3 929 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 G-6764 [0,2,0,0,0,0|1,0,0]=3 930 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=N1 Q60786 [0,2,0,0,0,0|1,0,0]=3 931 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br P37092 [0,2,0,0,0,0|0,0,0]=2 932 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br Q51864 [0,2,0,0,0,0|1,0,0]=3 933 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl N26004 [0,2,0,0,0,0|1,0,0]=3 934 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1F O30248 [0,2,0,0,0,0|1,0,0]=3 935 B11R1.166 O=C(O)C1=CC=C(F)C=C1O M22934 [0,2,0,0,0,0|0,0,0]=2 936 B11R1.166 O=C(O)C1=CC=C(I)C=C1F P43484 [0,2,0,0,0,0|0,0,0]=2 937 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl Q66502 [0,2,0,0,0,0|0,0,0]=2 938 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl O32638 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.166 O=C(O)C1=CN=C(Br)C=C1I Q52323 [0,2,0,0,0,0|1,0,0]=3 940 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1I N27822 [0,2,0,0,0,0|1,0,0]=3 941 B11R1.166 O=C(O)C1=CN=C(O)N=C1O G-7724 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl Q68112 [0,2,0,0,0,0|1,0,0]=3 943 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F G-7561 [0,2,0,0,0,0|1,0,0]=3 944 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br Q67790 [0,2,0,0,0,0|1,0,0]=3 945 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F O30677 [0,2,0,0,0,0|1,0,0]=3 946 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl I-9428 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl O31562 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.166 O=C(O)C1=NC=C(O)C=C1F O29407 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br P50972 [0,2,0,0,0,0|1,0,1]=4 950 B11R1.166 OB(O)C1=C(Cl)C=C(Br)C=C1 N25136 [0,2,0,0,0,0|1,0,1]=4 951 B11R1.166 OB(O)C1=CC=C(Br)C=C1F N24200 [0,2,0,0,0,0|1,0,1]=4 952 B11R1.166 OB(O)C1=CC=C(Br)C=C1O N27788 [0,2,0,0,0,0|1,0,1]=4 953 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Br N24488 [0,2,0,0,0,0|1,0,1]=4 954 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O N25789 [0,2,0,0,0,0|1,0,1]=4 955 B11R1.166 OB(O)C1=CC=C(F)C=C1Br N25282 [0,2,0,0,0,0|1,0,1]=4 956 B11R1.166 OB(O)C1=CC=C(F)C=C1O N24631 [0,2,0,0,0,0|1,0,1]=4 957 B11R1.166 OB(O)C1=CC=C(O)C=C1Cl O30606 [0,2,0,0,0,0|1,0,1]=4 958 B11R1.166 OB(O)C1=CC=C(O)C=C1F N24632 [0,2,0,0,0,0|1,0,1]=4 959 B11R1.7 CC(N)(CO)C1=CC=CC=C1 P35233 [0,2,0,0,0,0|1,0,1]=4 960 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 M15334 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.16 CCCC(=O)C1=CC=CN=C1 P40625 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.16 CCOC(=N)C1=CC=NC=C1 O30241 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.16 COCC(N)C1=CC=CC=C1 P40515 [0,2,0,0,0,0|1,0,1]=4 964 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 P35167 [0,2,0,0,0,0|1,0,1]=4 965 B11R1.16 COC[C@H](N)C1=CC=CC=C1 P36845 [0,2,0,0,0,0|1,0,1]=4 966 B11R1.16 CONC(=O)C1=CC=CC=C1 Q65648 [0,2,0,0,0,0|0,0,0]=2 967 B11R1.16 N#CCC(=O)C1=CC=CN=C1 P38931 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.16 N#CCC(=O)C1=CC=NC=C1 P39466 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.16 N#CCC(=O)C1=NC=CC=C1 M15816 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.16 NCCC(O)C1=CC=CC=C1 P37784 [0,2,0,0,0,0|1,0,1]=4 971 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 P35908 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 P40616 [0,2,0,0,0,0|1,0,1]=4 973 B11R1.23 C#CC(=O)C1=CC=CC(Cl)=C1 P38720 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.23 C#CC(O)C1=CC=CC(Cl)=C1 P38984 [0,2,0,0,0,0|1,0,1]=4 975 B11R1.23 C#CC(O)C1=CC=CC(F)=C1 O31432 [0,2,0,0,0,0|1,0,1]=4 976 B11R1.23 CC1=CC(C(=O)CBr)=CC=C1 O28559 [0,2,0,0,0,0|1,0,0]=3 977 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,2,0,0,0,0|1,0,1]=4 978 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.23 CC1=CC=CC(C(=O)NN)=N1 S72497 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.23 CC1=CN=CC(C(=O)NN)=C1 O30082 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,2,0,0,0,0|1,0,1]=4 983 B11R1.23 COC(=O)C1=CC(C)=CN=C1 Q66697 [0,2,0,0,0,0|1,0,0]=3 984 B11R1.23 COC(=O)C1=CC(C)=CN=N1 L22161 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 G-7304 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.23 COC(=O)C1=CC(F)=CN=C1 C-2951 [0,2,0,0,0,0|1,0,0]=3 987 B11R1.23 COC(=O)C1=CC(N)=NC=N1 I-9515 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.23 COC(=O)C1=CC(O)=CN=C1 P45785 [0,2,0,0,0,0|1,0,0]=3 989 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 Q66806 [0,2,0,0,0,0|0,0,0]=2 990 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 C-3476 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 G-5883 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.23 COC(=O)C1=NC(F)=CC=C1 Q68381 [0,2,0,0,0,0|1,0,0]=3 993 B11R1.23 COC(=O)C1=NC(O)=NC=C1 S72664 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 E-3030 [0,2,0,0,0,0|1,0,0]=3 995 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M15778 [0,2,0,0,0,0|1,0,0]=3 996 B11R1.23 COC(=O)C1=NC=CC(C)=N1 L14173 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.23 COC(=O)C1=NC=CC(F)=C1 L22462 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.23 COC(=O)C1=NC=CC(N)=C1 G-6744 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M23610 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.23 COC(=O)C1=NC=NC(C)=C1 P44278 [0,2,0,0,0,0|2,0,0]=4 1001 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 L14015 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,2,0,0,0,0|1,0,1]=4 1003 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,2,0,0,0,0|1,0,1]=4 1004 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,2,0,0,0,0|1,0,1]=4 1005 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,2,0,0,0,0|1,0,0]=3 1006 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,2,0,0,0,0|1,0,0]=3 1007 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,2,0,0,0,0|1,0,0]=3 1008 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,2,0,0,0,0|1,0,0]=3 1009 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,2,0,0,0,0|1,0,1]=4 1010 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,2,0,0,0,0|1,0,1]=4 1011 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,2,0,0,0,0|1,0,1]=4 1012 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,2,0,0,0,0|1,0,1]=4 1013 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 C-3315 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,2,0,0,0,0|1,0,1]=4 1015 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,2,0,0,0,0|1,0,1]=4 1016 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,2,0,0,0,0|1,0,1]=4 1017 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,2,0,0,0,0|1,0,1]=4 1018 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,2,0,0,0,0|1,0,1]=4 1019 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,2,0,0,0,0|1,0,1]=4 1020 B11R1.23 O=C(CBr)C1=NC=CC(Cl)=C1 O30189 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.23 O=C(CCl)C1=NC=CC(Cl)=C1 O29576 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.222 C#CC(=O)C1=CC=CC=C1Cl M23022 [0,2,0,0,0,0|1,0,0]=3 1023 B11R1.222 C#CC(O)C1=CC=CC=C1Cl P40184 [0,2,0,0,0,0|1,0,1]=4 1024 B11R1.222 CC1=CC=CC=C1C(=O)CBr O28087 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,2,0,0,0,0|1,0,1]=4 1026 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.222 CC1=CC=CN=C1C(=O)CCl O30165 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.222 CNC(=O)C1=CC=CC=C1Br P37075 [0,2,0,0,0,0|1,0,0]=3 1029 B11R1.222 CNC(=O)C1=CC=CC=C1C O32523 [0,2,0,0,0,0|1,0,0]=3 1030 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 N25636 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.222 COC(=O)C1=C(Br)N=CN=C1 H-8377 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.222 COC(=O)C1=C(C)C=NC=C1 G-7865 [0,2,0,0,0,0|1,0,0]=3 1033 B11R1.222 COC(=O)C1=C(C)C=NN=C1 G-7306 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.222 COC(=O)C1=C(C)N=CC=C1 I-9174 [0,2,0,0,0,0|1,0,0]=3 1035 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 N25043 [0,2,0,0,0,0|1,0,0]=3 1036 B11R1.222 COC(=O)C1=C(F)C=NC=C1 G-7746 [0,2,0,0,0,0|1,0,0]=3 1037 B11R1.222 COC(=O)C1=C(F)N=CC=C1 Q66492 [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.222 COC(=O)C1=C(I)C=NC=C1 G-6795 [0,2,0,0,0,0|1,0,0]=3 1039 B11R1.222 COC(=O)C1=C(N)C=NC=N1 Q65333 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.222 COC(=O)C1=C(O)C=NC=C1 O30771 [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.222 COC(=O)C1=CC=CN=C1Br Q67675 [0,2,0,0,0,0|1,0,0]=3 1042 B11R1.222 COC(=O)C1=CC=CN=C1I O30553 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.222 COC(=O)C1=CC=NC=C1N C-3596 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.222 COC(=O)C1=CC=NNC1=O L14296 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.222 COC(=O)C1=CN=CN=C1Cl H-8381 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.222 COC(=O)C1=NC=CC=C1Cl Q68224 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.222 COC(=O)C1=NC=CC=C1F Q68214 [0,2,0,0,0,0|1,0,0]=3 1048 B11R1.222 COC(=O)C1=NC=CN=C1Br Q51827 [0,2,0,0,0,0|2,0,0]=4 1049 B11R1.222 COC(=O)C1=NC=CN=C1Cl C-3373 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.222 COC(=O)C1=NC=CN=C1F L18388 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,2,0,0,0,0|1,0,1]=4 1052 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,2,0,0,0,0|1,0,1]=4 1053 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.222 NCC(=O)C1=CC=CC=C1Br P35565 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.222 NCC(=O)C1=CC=CC=C1Cl P40753 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.222 NCC(=O)C1=CC=CC=C1O P37785 [0,2,0,0,0,0|1,0,0]=3 1057 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,2,0,0,0,0|1,0,1]=4 1060 B11R1.222 NNC(=O)C1=CC=CN=C1N O30046 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,2,0,0,0,0|1,0,1]=4 1062 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,2,0,0,0,0|1,0,1]=4 1063 B11R1.222 O=C(CBr)C1=CC=CC=C1Br P37875 [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.222 O=C(CCl)C1=NC=CC=C1F O32003 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.222 O=C(CF)C1=CC=CC=C1F P51651 [0,2,0,0,0,0|1,0,0]=3 1066 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 D-2711 [0,2,0,0,0,0|1,0,1]=4 1067 B11R1.87 CC(C)(O)C1=CC=CC=C1I Q69151 [0,2,0,0,0,0|1,0,1]=4 1068 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Br P51334 [0,2,0,0,0,0|1,0,1]=4 1069 B11R1.53 C#CC1=CC=CC=C1B(O)O Q65557 [0,2,0,0,0,0|1,0,1]=4 1070 B11R1.53 C#CC1=CC=CC=C1C(=O)O O28760 [0,2,0,0,0,0|0,0,0]=2 1071 B11R1.53 C#CC1=CC=CC=C1C(C)=O O29479 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.53 C#CC1=CC=CC=C1C(N)=O O29403 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.53 C#CC1=CC=CC=C1[N+](=O)[O-] O27867 [0,2,0,0,0,0|1,0,1]=4 1074 B11R1.53 CCC1=CN=CC=C1C(=O)O Q60755 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.53 COC1=C(C(C)=O)C=NC=C1 O33511 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.53 COC1=C(C(C)=O)N=CC=C1 Q62300 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.53 COC1=CC=CC=C1C(N)=O P39422 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.53 COC1=CC=CN=C1C(=O)O O31773 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.53 COC1=NC=CC=C1C(C)=O P41710 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 Q60785 [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.53 N#CC1=CC=CC=C1B(O)O Q66418 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.53 N#CC1=CC=CN=C1C(=O)O G-7848 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.53 N#CC1=CC=NC=C1C(=O)O G-7849 [0,2,0,0,0,0|1,0,0]=3 1084 B11R1.53 N#CC1=CN=CC=C1C(=O)O Q60903 [0,2,0,0,0,0|1,0,0]=3 1085 B11R1.53 NCC1=CC=CC=C1B(O)O O34146 [0,2,0,0,0,0|1,0,1]=4 1086 B11R1.53 NCC1=CC=CC=C1C(=O)O O28742 [0,2,0,0,0,0|0,0,0]=2 1087 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] P39381 [0,2,0,0,0,0|1,0,1]=4 1088 B11R1.53 O=C(O)C1=CC=CC=C1CO O34075 [0,2,0,0,0,0|0,0,0]=2 1089 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 P44466 [0,2,0,0,0,0|1,0,0]=3 1090 B11R1.53 O=CC1=C(C(=O)O)N=CC=C1 Q60211 [0,2,0,0,0,0|1,0,0]=3 1091 B11R1.53 O=CC1=CN=CC=C1C(=O)O Q60210 [0,2,0,0,0,0|1,0,0]=3 1092 B11R1.53 O=CC1=NC=CC=C1C(=O)O Q60213 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl Q68333 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.156 CC(=O)C1=C(I)C=CN=C1F N27716 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.156 CC1=C(C(=O)O)C(Br)=CN=C1 Q64763 [0,2,0,0,0,0|1,0,0]=3 1096 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 I-9230 [0,2,0,0,0,0|0,0,0]=2 1097 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=N1 Q60700 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 Q52933 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.156 CC1=C(C(=O)O)C(F)=CN=C1 Q60648 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.156 CC1=C(C(=O)O)C(F)=NC=C1 N26390 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.156 CC1=CN=CC(C)=C1C(=O)O Q60782 [0,2,0,0,0,0|1,0,0]=3 1102 B11R1.156 CC1=CN=CC(N)=C1C(=O)O Q63314 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.156 CC1=NC=CC(C)=C1C(=O)O G-7850 [0,2,0,0,0,0|1,0,0]=3 1104 B11R1.156 NC(=O)C1=C(Cl)C=NC=C1Cl O29200 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.156 NC(=O)C1=C(F)C=CN=C1Cl Q62283 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 L14459 [0,2,0,0,0,0|1,0,0]=3 1107 B11R1.156 NC1=C([N+](=O)[O-])C(F)=CC=C1 E-3042 [0,2,0,0,0,0|1,0,1]=4 1108 B11R1.156 NC1=CC=CC(Br)=C1[N+](=O)[O-] E-3034 [0,2,0,0,0,0|1,0,1]=4 1109 B11R1.156 NC1=CC=CC(I)=C1C(=O)O O32252 [0,2,0,0,0,0|0,0,0]=2 1110 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Br Q67512 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.156 O=C(Cl)C1=C(Cl)C=NC=C1Cl O29012 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br Q67183 [0,2,0,0,0,0|0,0,0]=2 1113 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F C-3485 [0,2,0,0,0,0|0,0,0]=2 1114 B11R1.156 O=C(O)C1=C(Br)C=CN=C1F O30907 [0,2,0,0,0,0|1,0,0]=3 1115 B11R1.156 O=C(O)C1=C(Br)C=NC=C1Br Q66331 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F N24768 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O Q66580 [0,2,0,0,0,0|0,0,0]=2 1118 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1O Q60761 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Br N27720 [0,2,0,0,0,0|1,0,0]=3 1120 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Cl Q67313 [0,2,0,0,0,0|1,0,0]=3 1121 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F Q57224 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1Br Q67320 [0,2,0,0,0,0|1,0,0]=3 1123 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F O30790 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I P43249 [0,2,0,0,0,0|1,0,0]=3 1125 B11R1.156 O=C(O)C1=C(F)C=CN=C1Br O29983 [0,2,0,0,0,0|1,0,0]=3 1126 B11R1.156 O=C(O)C1=C(F)N=CC=C1I A-622 [0,2,0,0,0,0|1,0,0]=3 1127 B11R1.156 O=C(O)C1=C(I)C=NC=C1Br N26737 [0,2,0,0,0,0|1,0,0]=3 1128 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1F O30650 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.156 OB(O)C1=C(Br)C=CC=C1Br N24222 [0,2,0,0,0,0|1,0,1]=4 1130 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Br Q66801 [0,2,0,0,0,0|1,0,1]=4 1131 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O N25356 [0,2,0,0,0,0|1,0,1]=4 1132 B11R1.156 OB(O)C1=C(I)C=CC=C1F Q66793 [0,2,0,0,0,0|1,0,1]=4 1133 B11R1.156 OB(O)C1=C(O)C=CC=C1F P51507 [0,2,0,0,0,0|1,0,1]=4 1134 B11R1.156 OB(O)C1=C(O)C=CC=C1O O29455 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 N26896 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 M23816 [0,2,0,0,0,0|1,0,0]=3 1137 B11R1.159 CC(O)C1=CC=CC(Cl)=C1Cl P37496 [0,2,0,0,0,0|1,0,1]=4 1138 B11R1.159 CC1=C(B(O)O)C=CC=C1F N24187 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.159 CC1=C(B(O)O)C=CC=C1O N27745 [0,2,0,0,0,0|1,0,1]=4 1140 B11R1.159 CC1=C(Br)C=CC=C1B(O)O Q67304 [0,2,0,0,0,0|1,0,1]=4 1141 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O P49354 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.159 CC1=C(C(=O)O)C=CN=C1F N26427 [0,2,0,0,0,0|1,0,0]=3 1143 B11R1.159 CC1=C(C(=O)O)C=NC=C1Br N25194 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.159 CC1=C(C(=O)O)C=NC=C1Cl Q60529 [0,2,0,0,0,0|1,0,0]=3 1145 B11R1.159 CC1=C(C(=O)O)C=NC=C1F Q60749 [0,2,0,0,0,0|1,0,0]=3 1146 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br N24536 [0,2,0,0,0,0|1,0,0]=3 1147 B11R1.159 CC1=C(C(N)=O)C=NC=C1Br N25587 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.159 CC1=C(C)C(C(=O)O)=CC=N1 Q60787 [0,2,0,0,0,0|1,0,0]=3 1149 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O Q66298 [0,2,0,0,0,0|1,0,1]=4 1150 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 Q66499 [0,2,0,0,0,0|1,0,1]=4 1151 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 Q67898 [0,2,0,0,0,0|0,0,0]=2 1152 B11R1.159 CC1=C(N)C(C(N)=O)=CC=C1 O30695 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.159 CC1=CC=CC(B(O)O)=C1O N24258 [0,2,0,0,0,0|1,0,1]=4 1154 B11R1.159 CC1=NC=CC(C(=O)O)=C1N Q64766 [0,2,0,0,0,0|1,0,0]=3 1155 B11R1.159 CC1=NC=NC(C(=O)O)=C1C Q60491 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.159 CN1C=CC=C(C(=O)O)C1=O G-7544 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=NC=C1 N25264 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 O31275 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.159 NC(=O)C1=CC=CC(N)=C1N G-7463 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O L14675 [0,2,0,0,0,0|1,0,0]=3 1161 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl O31474 [0,2,0,0,0,0|1,0,0]=3 1162 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 P35150 [0,2,0,0,0,0|0,0,0]=2 1163 B11R1.159 NC1=C(I)C=CC=C1C(=O)O O32276 [0,2,0,0,0,0|0,0,0]=2 1164 B11R1.159 NC1=NC=CC(C(=O)O)=C1N Q58195 [0,2,0,0,0,0|1,0,0]=3 1165 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 O29217 [0,2,0,0,0,0|1,0,0]=3 1166 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CN=C1 N26393 [0,2,0,0,0,0|1,0,0]=3 1167 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 Q66969 [0,2,0,0,0,0|1,0,0]=3 1168 B11R1.159 O=C(O)C1=C(Cl)C(F)=CN=C1 N26255 [0,2,0,0,0,0|1,0,0]=3 1169 B11R1.159 O=C(O)C1=C(Cl)C(F)=NC=C1 Q66538 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 E-3012 [0,2,0,0,0,0|1,0,0]=3 1171 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 N24320 [0,2,0,0,0,0|0,0,0]=2 1172 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O P51774 [0,2,0,0,0,0|0,0,0]=2 1173 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O Q66616 [0,2,0,0,0,0|0,0,0]=2 1174 B11R1.159 O=C(O)C1=CC=CC(I)=C1F Q67650 [0,2,0,0,0,0|0,0,0]=2 1175 B11R1.159 O=C(O)C1=CC=NC(F)=C1F F-4045 [0,2,0,0,0,0|1,0,0]=3 1176 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl S72554 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.159 O=C(O)C1=NC=NC(Cl)=C1F Q53531 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.159 O=[N+]([O-])C1=C(Br)C(O)=CC=C1 O34477 [0,2,0,0,0,0|1,0,1]=4 1179 B11R1.159 O=[N+]([O-])C1=C(F)C(O)=CC=C1 H-8862 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br P40178 [0,2,0,0,0,0|1,0,1]=4 1181 B11R1.159 OB(O)C1=C(Br)C(F)=CC=C1 N26461 [0,2,0,0,0,0|1,0,1]=4 1182 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 N25968 [0,2,0,0,0,0|1,0,1]=4 1183 B11R1.159 OB(O)C1=CC=CC(Br)=C1F Q66366 [0,2,0,0,0,0|1,0,1]=4 1184 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O Q66633 [0,2,0,0,0,0|1,0,1]=4 1185 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl G-7117 [0,2,0,0,0,0|1,0,1]=4 1186 B11R1.159 OB(O)C1=CC=CC(F)=C1O Q66632 [0,2,0,0,0,0|1,0,1]=4 1187 B11R1.159 OB(O)C1=CC=CC(I)=C1F Q66484 [0,2,0,0,0,0|1,0,1]=4 1188 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 Q54706 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F G-7719 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.167 CC(=O)C1=CC(C)=CC=C1Br O29725 [0,2,0,0,0,0|1,0,0]=3 1191 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N26923 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F P37541 [0,2,0,0,0,0|1,0,0]=3 1193 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1Br O31310 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.167 CC(=O)C1=CC(O)=CC=C1C N26381 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.167 CC(O)C1=CC(Br)=CC=C1F Q66925 [0,2,0,0,0,0|1,0,1]=4 1196 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 P43289 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 L18299 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 P44204 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 Q60931 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 Q60684 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 Q60686 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 Q51924 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.167 CC1=CC=C(Br)C(B(O)O)=C1 N26851 [0,2,0,0,0,0|1,0,1]=4 1204 B11R1.167 CC1=CC=C(Br)C=C1B(O)O N25858 [0,2,0,0,0,0|1,0,1]=4 1205 B11R1.167 CC1=CC=C(Cl)C(B(O)O)=C1 Q66271 [0,2,0,0,0,0|1,0,1]=4 1206 B11R1.167 CC1=CC=C(F)C(C(=O)O)=N1 O30076 [0,2,0,0,0,0|1,0,0]=3 1207 B11R1.167 CC1=CC=C(I)C=C1C(=O)O P43248 [0,2,0,0,0,0|0,0,0]=2 1208 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 L22360 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.167 CC1=CC=C(N)C=C1C(=O)O P43309 [0,2,0,0,0,0|0,0,0]=2 1210 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 N24688 [0,2,0,0,0,0|1,0,1]=4 1211 B11R1.167 CC1=CC=C(O)C=C1B(O)O N25272 [0,2,0,0,0,0|1,0,1]=4 1212 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 N24563 [0,2,0,0,0,0|1,0,0]=3 1213 B11R1.167 CC1=CN=C(Cl)N=C1C(=O)O Q53304 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 N25261 [0,2,0,0,0,0|1,0,0]=3 1215 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 L18300 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 Q60885 [0,2,0,0,0,0|1,0,0]=3 1217 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 G-7847 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 G-5635 [0,2,0,0,0,0|1,0,0]=3 1219 B11R1.167 CC1=NC=C(N)C=C1C(=O)O Q58346 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 O30799 [0,2,0,0,0,0|2,0,0]=4 1221 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 O30885 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.167 NC(=O)C1=C(F)C=NC(Br)=C1 Q62405 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Br N26093 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Q67299 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F N24843 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl N25426 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N O31569 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.167 NC(=O)C1=CC(F)=CC=C1Br P43107 [0,2,0,0,0,0|1,0,0]=3 1229 B11R1.167 NC(=O)C1=NC(Br)=CC=C1F Q62404 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.167 NC1=C(C(=O)O)C=C(Cl)N=C1 C-3440 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 L22147 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 G-6804 [0,2,0,0,0,0|1,0,0]=3 1233 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O O34588 [0,2,0,0,0,0|1,0,0]=3 1234 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O G-5404 [0,2,0,0,0,0|1,0,0]=3 1235 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O O34386 [0,2,0,0,0,0|1,0,0]=3 1236 B11R1.167 NC1=CC=C(F)C(B(O)O)=C1 N25572 [0,2,0,0,0,0|1,0,1]=4 1237 B11R1.167 NC1=CN=C(Cl)N=C1C(=O)O P51239 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O P37901 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 M15563 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.167 NC1=NC=C(F)C=C1C(=O)O L18306 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1F Q67078 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl N25174 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1F N27324 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.167 O=C(Cl)C1=CC(Cl)=NC=C1Cl N27773 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 Q66324 [0,2,0,0,0,0|1,0,0]=3 1246 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 Q67587 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 C-3726 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 Q67957 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl C-3392 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O C-3696 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br Q67187 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl L22357 [0,2,0,0,0,0|1,0,0]=3 1253 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F K12095 [0,2,0,0,0,0|1,0,0]=3 1254 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F E-3037 [0,2,0,0,0,0|1,0,0]=3 1255 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl E-3057 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br O31572 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C-3699 [0,2,0,0,0,0|1,0,0]=3 1258 B11R1.167 O=C(O)C1=CC(F)=CN=C1F Q62473 [0,2,0,0,0,0|1,0,0]=3 1259 B11R1.167 O=C(O)C1=CC(F)=NC=C1Br N26408 [0,2,0,0,0,0|1,0,0]=3 1260 B11R1.167 O=C(O)C1=CC(F)=NC=C1F H-8387 [0,2,0,0,0,0|1,0,0]=3 1261 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br Q52652 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br G-7754 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F P44595 [0,2,0,0,0,0|1,0,0]=3 1264 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br L21544 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl Q60687 [0,2,0,0,0,0|1,0,0]=3 1266 B11R1.167 O=[N+]([O-])C1=C(S)C=CC(Br)=C1 H-8777 [0,2,0,0,0,0|1,0,1]=4 1267 B11R1.167 OB(O)C1=CC(Br)=CC=C1Br Q66796 [0,2,0,0,0,0|1,0,1]=4 1268 B11R1.167 OB(O)C1=CC(Br)=CC=C1O N24388 [0,2,0,0,0,0|1,0,1]=4 1269 B11R1.167 OB(O)C1=CC(Cl)=CC=C1Br N24945 [0,2,0,0,0,0|1,0,1]=4 1270 B11R1.167 OB(O)C1=CC(Cl)=CC=C1O Q66631 [0,2,0,0,0,0|1,0,1]=4 1271 B11R1.167 OB(O)C1=CC(F)=CC=C1Br Q66800 [0,2,0,0,0,0|1,0,1]=4 1272 B11R1.167 OB(O)C1=CC(F)=CC=C1O Q66483 [0,2,0,0,0,0|1,0,1]=4 1273 B11R1.167 OB(O)C1=CC(I)=CC=C1Br N24772 [0,2,0,0,0,0|1,0,1]=4 1274 B11R1.167 OB(O)C1=CC(O)=CC=C1Br Q67431 [0,2,0,0,0,0|1,0,1]=4 1275 B11R1.167 OB(O)C1=CC(O)=CC=C1F N24783 [0,2,0,0,0,0|1,0,1]=4 1276 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 P43442 [0,2,0,0,0,0|1,0,0]=3 1277 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 N24889 [0,2,0,0,0,0|1,0,0]=3 1278 B11R1.74 CC(=O)C1=CC(Cl)=NC(Cl)=C1 O31877 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 O30551 [0,2,0,0,0,0|1,0,0]=3 1280 B11R1.74 CC(=O)C1=NC(C)=CC(Cl)=C1 Q53148 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.74 CC(O)C1=CC(Cl)=CC(Cl)=C1 P40306 [0,2,0,0,0,0|1,0,1]=4 1282 B11R1.74 CC1=CC(B(O)O)=CC(O)=C1 N26309 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.74 CC1=CC(Br)=CC(B(O)O)=C1 Q66359 [0,2,0,0,0,0|1,0,1]=4 1284 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 P37229 [0,2,0,0,0,0|0,0,0]=2 1285 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 O31676 [0,2,0,0,0,0|1,0,0]=3 1286 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 G-6688 [0,2,0,0,0,0|1,0,0]=3 1287 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 O31886 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.74 CC1=CC(C(=O)O)=NC(O)=C1 Q60690 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 Q66609 [0,2,0,0,0,0|1,0,1]=4 1290 B11R1.74 CC1=CC(C)=NC(C(=O)O)=C1 Q60526 [0,2,0,0,0,0|1,0,0]=3 1291 B11R1.74 CC1=CC(C)=NC(C(=O)O)=N1 Q65314 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 Q66831 [0,2,0,0,0,0|1,0,1]=4 1293 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 O32304 [0,2,0,0,0,0|0,0,0]=2 1294 B11R1.74 CC1=NC(O)=CC(C(=O)O)=N1 P51502 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 O30715 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 Q67696 [0,2,0,0,0,0|1,0,0]=3 1297 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 Q67950 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.74 NC1=CC(C(=O)O)=NC(Br)=C1 Q53661 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.74 NC1=NC(Br)=CC(C(=O)O)=N1 Q53410 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.74 NC1=NC(Cl)=CC(C(=O)O)=N1 Q53411 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.74 NC1=NC(O)=CC(C(=O)O)=N1 M15195 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 Q67948 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.74 O=C(Cl)C1=CC(F)=CC(Br)=C1 O29004 [0,2,0,0,0,0|1,0,0]=3 1304 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 G-6615 [0,2,0,0,0,0|1,0,0]=3 1305 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 Q67862 [0,2,0,0,0,0|0,0,0]=2 1306 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 Q62337 [0,2,0,0,0,0|1,0,0]=3 1307 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 O30874 [0,2,0,0,0,0|1,0,0]=3 1308 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 10758 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.74 O=C(O)C1=NC(F)=CC(Cl)=C1 Q62427 [0,2,0,0,0,0|1,0,0]=3 1310 B11R1.74 O=C(O)C1=NC(F)=CC(F)=C1 Q62424 [0,2,0,0,0,0|1,0,0]=3 1311 B11R1.74 O=C([O-])C1=NC(F)=CC(F)=C1 O33117 [0,2,0,0,0,0|1,0,1]=4 1312 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 O30417 [0,2,0,0,0,0|1,0,1]=4 1313 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(O)=C1 O32687 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 P42451 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.74 OB(O)C1=CC(Cl)=CC(Br)=C1 Q67379 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.74 OB(O)C1=CC(F)=CC(Cl)=C1 Q66814 [0,2,0,0,0,0|1,0,1]=4 1317 B11R1.74 OB(O)C1=CC(O)=CC(Cl)=C1 N25649 [0,2,0,0,0,0|1,0,1]=4 1318 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 Q66713 [0,2,0,0,0,0|1,0,1]=4 1319 B11R1.266 C#CC1=CC(B(O)O)=CC=C1 G-5867 [0,2,0,0,0,0|1,0,1]=4 1320 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 O28043 [0,2,0,0,0,0|0,0,0]=2 1321 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 O28811 [0,2,0,0,0,0|1,0,0]=3 1322 B11R1.266 C#CC1=CC(C(N)=O)=CC=C1 M23346 [0,2,0,0,0,0|1,0,0]=3 1323 B11R1.266 C#CC1=CC=CC([N+](=O)[O-])=C1 O28041 [0,2,0,0,0,0|1,0,1]=4 1324 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 P39070 [0,2,0,0,0,0|0,0,0]=2 1325 B11R1.266 CCC1=CC(B(O)O)=CC=C1 Q67300 [0,2,0,0,0,0|1,0,1]=4 1326 B11R1.266 CCC1=CC(C(=O)O)=CC=C1 P37036 [0,2,0,0,0,0|0,0,0]=2 1327 B11R1.266 CCC1=CC(C(=O)O)=NC=C1 Q60534 [0,2,0,0,0,0|1,0,0]=3 1328 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 Q60685 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.266 CNC1=CC(C(=O)O)=CC=C1 P37710 [0,2,0,0,0,0|0,0,0]=2 1330 B11R1.266 COC1=CC(C(=O)O)=CN=C1 Q67568 [0,2,0,0,0,0|1,0,0]=3 1331 B11R1.266 COC1=CC(C(C)=O)=NC=C1 O30173 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.266 COC1=CC=CC(C(=O)O)=N1 P39197 [0,2,0,0,0,0|1,0,0]=3 1333 B11R1.266 COC1=NC(C(=O)O)=CC=N1 Q62605 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.266 COC1=NC(C(=O)O)=NC=C1 Q60646 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.266 COC1=NC=CC(C(C)=O)=C1 O30294 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.266 COC1=NN=CC(C(=O)O)=C1 L14279 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.266 CSC1=CN=CC(C(=O)O)=C1 N26072 [0,2,0,0,0,0|1,0,0]=3 1338 B11R1.266 N#CC1=CC(C(=O)O)=NC=C1 O31274 [0,2,0,0,0,0|1,0,0]=3 1339 B11R1.266 N#CC1=CC(C(N)=O)=CC=C1 P38673 [0,2,0,0,0,0|1,0,0]=3 1340 B11R1.266 NC(=O)C1=CC(CBr)=CN=C1 Q66568 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 P41901 [0,2,0,0,0,0|1,0,0]=3 1342 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 10633 [0,2,0,0,0,0|0,0,0]=2 1343 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 O28911 [0,2,0,0,0,0|0,0,0]=2 1344 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 O28730 [0,2,0,0,0,0|1,0,0]=3 1345 B11R1.266 NCC1=CC(C(N)=O)=NC=C1 Q62435 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.266 NNC1=CC(C(=O)O)=NC=C1 Q62382 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 Q60757 [0,2,0,0,0,0|1,0,0]=3 1348 B11R1.266 O=C(O)C1=CC=CC(CS)=C1 P39077 [0,2,0,0,0,0|0,0,0]=2 1349 B11R1.266 O=CC1=NC(C(=O)O)=CC=C1 Q62315 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.266 OB(O)C1=CC=CC(CBr)=C1 P37725 [0,2,0,0,0,0|1,0,1]=4 1351 B9R1.13 O=C(O)CC1=CC=CS1 I-9532 [0,0,1,1,0,0|1,0,1]=4 1352 B11R2.10 BrC1=CC2=NC=CC=C2O1 Q64356 [0,0,0,1,0,1|2,0,0]=4 1353 B11R2.10 CC1=NC2=C(C=CN=C2)O1 O34256 [0,0,0,1,0,1|2,0,0]=4 1354 B11R2.10 ClC1=CC2=CC=CC=C2N1 D-2538 [0,0,0,1,0,1|2,0,0]=4 1355 B11R2.10 NC1=CC2=C(C=CC=C2)N1 O29924 [0,0,0,1,0,1|2,0,0]=4 1356 B11R2.10 NC1=NC2=CC=CC=C2S1 O30669 [0,0,0,1,0,1|1,1,0]=4 1357 B11R2.10 O=C1CC2=C(C=NC=C2)N1 L14128 [0,0,0,1,0,1|2,0,0]=4 1358 B11R2.10 O=C1CC2=CC=CN=C2N1 C-2476 [0,0,0,1,0,1|2,0,0]=4 1359 B11R2.10 O=C1CC2=CC=CN=C2N1 C-2476-01 [0,0,0,1,0,1|2,0,0]=4 1360 B11R2.10 O=C1CC2=CC=NC=C2N1 C-2345 [0,0,0,1,0,1|2,0,0]=4 1361 B11R2.10 O=C1CC2=CN=CC=C2N1 C-3239 [0,0,0,1,0,1|2,0,0]=4 1362 B11R2.10 O=C1CC2=NC=CC=C2N1 C-2343 [0,0,0,1,0,1|2,0,0]=4 1363 B11R2.10 O=C1CN2C=CC=CC2=N1 O31095 [0,0,0,1,0,1|2,0,0]=4 1364 B11R2.10 O=C1NC2=C(C=NC=C2)N1 Q65490 [0,0,0,1,0,1|2,0,0]=4 1365 B11R2.10 O=C1NC2=CC=CN=C2N1 Q70155 [0,0,0,1,0,1|2,0,0]=4 1366 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [0,1,0,1,0,0|1,0,1]=4 1367 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [0,1,0,1,0,0|1,0,1]=4 1368 B11R2.1 BrC1=COC2=CC=CC=C12 O30635 [0,1,0,1,0,0|1,0,0]=3 1369 B11R2.1 BrC1=NNC2=CC=CC=C21 C-2069 [0,1,0,1,0,0|2,0,0]=4 1370 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,1,0,1,0,0|2,0,0]=4 1371 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,1,0,1,0,0|2,0,0]=4 1372 B11R2.1 CC1=NOC2=CC=CC=C21 O30125 [0,1,0,1,0,0|1,0,0]=3 1373 B11R2.1 ClC1=CNC2=C1C=CC=C2 L14683 [0,1,0,1,0,0|2,0,0]=4 1374 B11R2.1 IC1=NNC2=C1C=CC=C2 Q67919 [0,1,0,1,0,0|2,0,0]=4 1375 B11R2.1 NC1=CNC2=C1C=CC=C2 O32345 [0,1,0,1,0,0|2,0,0]=4 1376 B11R2.1 NC1=CNC2=C1C=CC=C2 O32346 [0,1,0,1,0,0|2,0,0]=4 1377 B11R2.1 NC1=CSC2=CC=CC=C12 O29978 [0,1,0,1,0,0|1,1,0]=4 1378 B11R2.1 NC1=NNC2=C1C=CC=C2 P35582 [0,1,0,1,0,0|2,0,0]=4 1379 B11R2.1 NC1=NOC2=C1C=CN=C2 K10867 [0,1,0,1,0,0|2,0,0]=4 1380 B11R2.1 NC1=NOC2=C1C=NC=C2 K10866 [0,1,0,1,0,0|2,0,0]=4 1381 B11R2.1 NC1=NOC2=CC=CN=C21 K10865 [0,1,0,1,0,0|2,0,0]=4 1382 B11R2.1 O=C1CCC2=C1C=CN=C2 L22316 [0,1,0,1,0,0|2,0,0]=4 1383 B11R2.1 O=C1CCC2=NC=CC=C12 G-6870 [0,1,0,1,0,0|2,0,0]=4 1384 B11R2.1 O=C1NCC2=C1C=CC=C2 I-9101 [0,1,0,1,0,0|1,0,0]=3 1385 B11R2.1 O=C1NCC2=CC=NC=C12 C-2838 [0,1,0,1,0,0|2,0,0]=4 1386 B11R2.1 O=C1SNC2=CC=CC=C12 L18705 [0,1,0,1,0,0|0,1,0]=3 1387 B11R2.1 OC1=CNC2=CC=CC=C12 Q52523 [0,1,0,1,0,0|1,0,0]=3 1388 B11R2.55 BrC1=CC=CC=C1C2CO2 P36453 [0,1,0,1,0,0|1,0,1]=4 1389 B11R2.55 ClC1=CC=CC=C1C2CO2 P36976 [0,1,0,1,0,0|1,0,1]=4 1390 B11R2.55 FC1=CC=CC=C1C2CO2 Q66192 [0,1,0,1,0,0|1,0,1]=4 1391 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [0,1,0,1,0,0|1,0,1]=4 1392 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [0,1,0,1,0,0|1,0,1]=4 1393 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [0,1,0,1,0,0|1,0,1]=4 1394 B7R1.1 C(=O)C1=CN=CS1 Q52103 [1,0,0,0,1,0|2,0,0]=4 1395 B7R1.1 O=CC1=CN=CO1 I-9061 [1,0,0,0,1,0|2,0,0]=4 1396 B7R1.1 O=CC1=CNN=C1 C-2878 [1,0,0,0,1,0|2,0,0]=4 1397 B7R1.1 O=CC1=CNN=C1 G-5044 [1,0,0,0,1,0|2,0,0]=4 1398 B7R1.1 O=CC1=COC=N1 K12239 [1,0,0,0,1,0|2,0,0]=4 1399 B7R1.1 O=CC1=CSC=N1 Q68013 [1,0,0,0,1,0|2,0,0]=4 1400 B7R1.1 O=CC1=NNC=C1 O31194 [1,0,0,0,1,0|2,0,0]=4 1401 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P40366 [0,0,0,0,0,2|1,0,0]=3 1402 B11R1.91 NC(=O)COC1=CC=CC=C1 P51047 [0,0,0,0,0,2|1,0,0]=3 1403 B11R1.91 O=C(O)CCC1=CC=CN=C1 P38473 [0,0,0,0,0,2|1,0,0]=3 1404 B11R1.91 O=C(O)CCC1=CC=NC=C1 P36936 [0,0,0,0,0,2|1,0,0]=3 1405 B11R1.91 O=C(O)CCC1=CC=NN=C1 O33206 [0,0,0,0,0,2|2,0,0]=4 1406 B11R1.91 O=C(O)CCC1=NC=CC=C1 P41024 [0,0,0,0,0,2|1,0,0]=3 1407 B11R1.91 O=C(O)CCC1=NC=CC=N1 Q60533 [0,0,0,0,0,2|2,0,0]=4 1408 B11R1.91 O=C(O)CCC1=NC=NC=C1 Q60531 [0,0,0,0,0,2|2,0,0]=4 1409 B11R1.91 O=C(O)CCC1=NN=CC=C1 P45064 [0,0,0,0,0,2|2,0,0]=4 1410 B11R1.91 O=C(O)CNC1=NC=CC=C1 P37612 [0,0,0,0,0,2|1,0,0]=3 1411 B11R1.91 O=C(O)CNC1=NC=CC=N1 P36004 [0,0,0,0,0,2|2,0,0]=4 1412 B11R1.91 O=C(O)COC1=CC=CC=N1 P50811 [0,0,0,0,0,2|1,0,0]=3 1413 B11R1.91 O=C(O)COC1=CC=CC=N1 Q60650 [0,0,0,0,0,2|1,0,0]=3 1414 B11R1.91 O=C(O)COC1=CC=CN=C1 P35673 [0,0,0,0,0,2|1,0,0]=3 1415 B11R1.91 O=C(O)COC1=NC=CC=N1 Q60596 [0,0,0,0,0,2|2,0,0]=4 1416 B11R1.91 O=C(O)\C=C\C1=CC=NC=N1 Q58672 [0,0,0,0,0,2|2,0,0]=4 1417 B11R1.91 O=C(O)\C=C\C1=CN=CN=C1 Q60664 [0,0,0,0,0,2|2,0,0]=4 1418 B11R1.91 O=C(O)\C=C\C1=NC=CC=N1 O32453 [0,0,0,0,0,2|2,0,0]=4 1419 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P50961 [0,0,0,0,0,2|1,0,1]=4