0 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 CC(N)C1=CC=NC=N1 Q51822 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 CC(N)C1=CC=NN=C1 G-7533 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 CC(N)C1=CC=NN=C1 L13924 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 CC(N)C1=CN=CN=C1 G-5168 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 CC(N)C1=CN=CN=C1 Q51812 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.6 CC(N)C1=NC=CC=N1 Q55479 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.6 CC(O)C1=CN=CN=C1 Q55478 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 C[C@@H](N)C1=CN=CN=C1 I-9747 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.6 C[C@@H](N)C1=NC=CC=N1 Q57196 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.6 C[C@H](N)C1=CN=CN=C1 Q51933 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q57195 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q65669 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 NC(=O)C1=NC=NC=C1 P51213 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 OB(O)C1=CC=NC=C1 C-3686 [0,0,0,0,0,0|3,0,1]=4 36 B8R1.2 BrCC1=CC=CN=C1 P36550 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.2 C#CC1=CC=NC=C1 G-7546 [1,0,0,0,0,0|1,0,2]=4 38 B8R1.2 C#CC1=CC=NC=C1 L13525 [1,0,0,0,0,0|1,0,2]=4 39 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [1,0,0,0,0,0|2,0,0]=3 40 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [1,0,0,0,0,0|2,0,0]=3 42 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [1,0,0,0,0,0|2,0,0]=3 43 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [1,0,0,0,0,0|2,0,0]=3 44 B8R1.2 C=CC1=CC=CN=C1 O30687 [1,0,0,0,0,0|1,0,1]=3 45 B8R1.2 CNC1=CC=NC=N1 Q58573 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 CNC1=CN=CN=C1 L13923 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.2 CNC1=NN=CC=C1 O29994 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.2 COC1=CN=CN=C1 M15459 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 ICC1=CC=CC=C1 P37031 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.2 N#CC1=CC=NC=C1 Q58209 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 NCC1=CC=NC=C1 O30621 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 NNC1=CC=CN=C1 C-3227 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.2 NNC1=CC=NC=C1 C-3226 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.2 NNC1=CC=NC=C1 L19135 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 NNC1=CC=NC=C1 O31964 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [0,1,0,0,0,0|1,0,0]=2 58 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [0,1,0,0,0,0|1,0,0]=2 59 B10R1.13 CC(=O)C1=CN=C(C)N=C1 H-8030 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 Q54991 [0,1,0,0,0,0|2,0,0]=3 61 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [0,1,0,0,0,0|1,0,0]=2 62 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 G-7164 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [0,1,0,0,0,0|1,0,0]=2 65 B10R1.13 CC(=O)C1=NC=C(C)C=N1 O31005 [0,1,0,0,0,0|2,0,0]=3 66 B10R1.13 CC(=O)C1=NC=C(C)N=C1 F-4678 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 O30416 [0,1,0,0,0,0|2,0,0]=3 69 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.13 CC(=O)C1=NC=C(F)C=N1 O30210 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 L13130 [0,1,0,0,0,0|2,0,0]=3 72 B10R1.13 CC(=O)C1=NN=C(O)C=C1 P51623 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [0,1,0,0,0,0|1,0,1]=3 74 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [0,1,0,0,0,0|1,0,1]=3 75 B10R1.13 CC(C)C1=CN=C(N)C=C1 O34069 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.13 CC(C)C1=NC=C(N)C=C1 G-7522 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [0,1,0,0,0,0|1,0,1]=3 78 B10R1.13 CC(N)C1=NC=C(F)C=C1 C-3369 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [0,1,0,0,0,0|1,0,2]=4 80 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [0,1,0,0,0,0|0,0,2]=3 81 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [0,1,0,0,0,0|0,0,2]=3 82 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [0,1,0,0,0,0|1,0,2]=4 83 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [0,1,0,0,0,0|1,0,1]=3 84 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [0,1,0,0,0,0|1,0,2]=4 85 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.13 CC1=NC=C(C(=O)O)C=N1 P44549 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 I-9184 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 CN(C)C1=CC=C(Br)N=C1 O30431 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.13 CN(C)C1=NC=C(Br)C=C1 P39265 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.13 CN(C)C1=NC=C(I)C=C1 N26187 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 CN(C)C1=NC=C(N)C=C1 I-9568 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [0,1,0,0,0,0|1,0,2]=4 94 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [0,1,0,0,0,0|1,0,2]=4 95 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 O32464 [0,1,0,0,0,0|2,0,1]=4 96 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [0,1,0,0,0,0|1,0,2]=4 97 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [0,1,0,0,0,0|1,0,2]=4 98 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.13 N=C(N)C1=CC=C(Br)N=C1 Q52330 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.13 N=C(N)C1=CC=C(N)C=N1 Q58199 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.13 N=C(N)C1=CN=C(F)C=C1 G-5718 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.13 N=C(N)C1=NC=C(Br)C=C1 Q52329 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 G-5717 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.13 N=C(N)C1=NC=C(F)C=C1 C-2886 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.13 NC(=O)C1=CC=C(Br)N=C1 P35365 [0,1,0,0,0,0|2,0,0]=3 106 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 O30890 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 N24759 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 O31863 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.13 NC(=O)C1=NN=C(N)C=C1 G-7026 [0,1,0,0,0,0|3,0,0]=4 113 B10R1.13 NC1=CC=C(B(O)O)C=C1 Q66344 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [0,1,0,0,0,0|2,0,1]=4 115 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 NC1=CN=C(C(=O)O)C=N1 10608 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.13 NC1=CN=C(C(=O)O)N=C1 O33536 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.13 NC1=NN=C(C(=O)O)C=C1 G-5218 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.13 O=C(Cl)C1=NC=C(Cl)C=C1 N25108 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 Q64836 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 G-5309 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.13 O=C(O)C1=CN=C(O)N=C1 O31007 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 Q52548 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 G-7253 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 B-1219 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.13 O=C(O)C1=NC=C(F)C=N1 H-8066 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 L14250 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 B-1753 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.13 O=[N+]([O-])C1=CC=C(Br)N=C1 E-3076 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 10648 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.13 O=[N+]([O-])C1=NC=C(F)C=C1 O30344 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.13 OB(O)C1=CC=C(S)C=C1 P39473 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [0,1,0,0,0,0|0,0,1]=2 140 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [0,1,0,0,0,0|1,0,1]=3 141 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [0,1,0,0,0,0|1,0,1]=3 142 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [0,1,0,0,0,0|1,0,1]=3 143 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [0,1,0,0,0,0|1,0,0]=2 145 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [0,1,0,0,0,0|1,0,1]=3 147 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [0,1,0,0,0,0|0,0,2]=3 148 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [0,1,0,0,0,0|1,0,1]=3 149 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [0,1,0,0,0,0|1,0,1]=3 150 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [0,1,0,0,0,0|1,0,1]=3 157 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [0,1,0,0,0,0|1,0,2]=4 158 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [0,1,0,0,0,0|1,0,2]=4 159 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [0,1,0,0,0,0|1,0,2]=4 160 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [0,1,0,0,0,0|1,0,2]=4 161 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [0,1,0,0,0,0|0,0,2]=3 162 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [0,1,0,0,0,0|0,0,2]=3 163 B10R1.15 NNC(=O)C1=NC=NC=C1 O30565 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.15 O=C(CBr)C1=CN=CN=C1 Q54899 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.15 O=C(CBr)C1=NC=CC=N1 L22105 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.15 O=C(CBr)C1=NC=CC=N1 Q52568 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.15 O=C(CBr)C1=NC=NC=C1 P51516 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.15 O=C(CCl)C1=NC=CN=C1 L19661 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [0,1,0,0,0,0|1,0,2]=4 173 B10R1.28 CC(C)(N)C1=CC=CN=C1 S72454 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32487 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32488 [0,1,0,0,0,0|2,0,1]=4 176 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32489 [0,1,0,0,0,0|2,0,1]=4 177 B10R1.28 CC(C)(O)C1=NC=CC=C1 M15802 [0,1,0,0,0,0|1,0,2]=4 178 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 C-3245 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 C-3246 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.28 O=S(=O)(Cl)C1=CC=NC=C1 F-4410 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 C-3244 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 P45341 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 P51550 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [0,1,0,0,0,0|1,0,0]=2 187 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [0,1,0,0,0,0|1,0,0]=2 188 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [0,1,0,0,0,0|1,0,0]=2 189 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [0,1,0,0,0,0|1,0,0]=2 190 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.61 CC(=O)C1=CN=CN=C1C Q58769 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [0,1,0,0,0,0|1,0,0]=2 195 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.61 CC(=O)C1=NC=CN=C1Cl G-7946 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.61 CC(Br)C1=CC=CC=C1F O31043 [0,1,0,0,0,0|1,0,1]=3 198 B10R1.61 CC(C)C1=C(Br)C=NC=C1 Q54489 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.61 CC(C)C1=CC=CN=C1N O33456 [0,1,0,0,0,0|2,0,1]=4 200 B10R1.61 CC(Cl)C1=CC=CC=C1Cl P40025 [0,1,0,0,0,0|1,0,1]=3 201 B10R1.61 CC(N)C1=CC=CC=C1Br O34378 [0,1,0,0,0,0|1,0,1]=3 202 B10R1.61 CC(N)C1=CC=CC=C1Cl P38305 [0,1,0,0,0,0|1,0,1]=3 203 B10R1.61 CC(N)C1=CC=CC=C1F P36297 [0,1,0,0,0,0|1,0,1]=3 204 B10R1.61 CC(N)C1=CC=CC=C1N P38310 [0,1,0,0,0,0|1,0,1]=3 205 B10R1.61 CC(O)C1=C(F)C=NC=C1 Q65366 [0,1,0,0,0,0|1,0,2]=4 206 B10R1.61 CC(O)C1=CC=CN=C1Br O30716 [0,1,0,0,0,0|1,0,2]=4 207 B10R1.61 CC(O)C1=CC=CN=C1Cl P41711 [0,1,0,0,0,0|1,0,2]=4 208 B10R1.61 CC(O)C1=CC=CN=C1F N26796 [0,1,0,0,0,0|1,0,2]=4 209 B10R1.61 CC1=C(C(=O)O)C=CN=C1 Q56301 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.61 CC1=C(C(=O)O)C=NN=C1 G-5521 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.61 CC1=C(C(=O)O)N=NC=C1 L13035 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 C-3702 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.61 CC1=CC=CC=C1C(C)N P38147 [0,1,0,0,0,0|1,0,1]=3 214 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] G-6919 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.61 CC1=CN=CN=C1C(=O)O O33331 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] C-3336 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.61 CC1=NC=CN=C1C(=O)O G-5660 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.61 CN(C)C1=CC=CC=C1O P38469 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [0,1,0,0,0,0|0,0,2]=3 222 B10R1.61 C[C@@H](O)C1=CC=CN=C1N Q62533 [0,1,0,0,0,0|1,0,2]=4 223 B10R1.61 C[C@H](N)C1=CC=CC=C1Br P51405 [0,1,0,0,0,0|1,0,1]=3 224 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [0,1,0,0,0,0|0,0,2]=3 225 B10R1.61 C[C@H](O)C1=CC=CN=C1N Q62532 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.61 N=C(N)C1=CC=CC=C1F P51589 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.61 N=C(N)C1=NC=CC=C1F O32719 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.61 N=C(N)C1=NC=CC=C1F O32720 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 N25046 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.61 NC(=O)C1=C(N)C=CN=C1 C-3535 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.61 NC(=O)C1=CC=CN=C1F N25255 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.61 NC(=O)C1=CC=NC=C1N O34515 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.61 NC(=O)C1=CN=CN=C1O O34320 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.61 NC(=O)C1=NC=CC=C1N C-3697 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.61 NC1=C(C(=O)O)C=CN=C1 G-6779 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.61 NC1=C(C(=O)O)N=CN=C1 Q57220 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.61 NC1=CC=NC=C1N(=O)=O A-908 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.61 NC1=NC=CC=C1[N+](=O)[O-] C-3682 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.61 NC1=NN=CC=C1C(=O)O M15199 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.61 O=C(Cl)C1=CC=CN=C1Br N24418 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.61 O=C(Cl)C1=CC=CN=C1F N25171 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 G-5495 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 O=C(O)C1=C(Br)N=CN=C1 H-8378 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.61 O=C(O)C1=C(Cl)N=CN=C1 H-8380 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.61 O=C(O)C1=C(F)C=NC=C1 G-7559 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.61 O=C(O)C1=C(I)C=NC=C1 O31943 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.61 O=C(O)C1=CN=CNC1=O H-8379 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.61 O=C(O)C1=NC=CN=C1Br S70901 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.61 O=C(O)C1=NC=CN=C1Cl G-5403 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.61 O=C(O)C1=NC=CN=C1I O29988 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.61 O=C(O)C1=NC=CN=C1O C-3727 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.61 O=C(O)C1=NC=NC=C1Cl P51523 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.61 O=C(O)C1=NC=NC=C1F O33158 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.61 O=[N+]([O-])C1=C(F)C=NC=C1 O30658 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.61 O=[N+]([O-])C1=C(I)C=CN=C1 Q52538 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.61 O=[N+]([O-])C1=C(O)C=NC=C1 10600 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br C-3687 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.61 O=[N+]([O-])C1=CC=CN=C1O G-5324 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O L13797 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.61 OB(O)C1=CC=CC=C1I Q67114 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [0,1,0,0,0,0|1,0,0]=2 270 B10R1.113 CC(=O)C1=CC(C)=NC=N1 M15580 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [0,1,0,0,0,0|1,0,0]=2 273 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [0,1,0,0,0,0|1,0,0]=2 274 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [0,1,0,0,0,0|1,0,0]=2 275 B10R1.113 CC(=O)C1=NC=CC(C)=N1 Q65344 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [0,1,0,0,0,0|1,0,0]=2 277 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 Q52823 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.113 CC(C)C1=CC(O)=NC=C1 Q52824 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.113 CC(C)C1=CC=CC(I)=N1 N26566 [0,1,0,0,0,0|2,0,1]=4 280 B10R1.113 CC(C)C1=CN=CC(O)=C1 Q52825 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [0,1,0,0,0,0|1,0,1]=3 282 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [0,1,0,0,0,0|1,0,1]=3 283 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [0,1,0,0,0,0|1,0,1]=3 284 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [0,1,0,0,0,0|1,0,1]=3 285 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [0,1,0,0,0,0|1,0,1]=3 286 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [0,1,0,0,0,0|1,0,1]=3 287 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58352 [0,1,0,0,0,0|2,0,1]=4 288 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58353 [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|1,0,2]=4 290 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [0,1,0,0,0,0|1,0,2]=4 291 B10R1.113 CC1=CC(C(=O)O)=CN=N1 P49779 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.113 CC1=CC(C(=O)O)=NN=C1 L14505 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [0,1,0,0,0,0|1,0,1]=3 294 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [0,1,0,0,0,0|1,0,1]=3 295 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.113 CC1=CN=CC(C(=O)O)=N1 G-6898 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.113 CC1=NC(C(=O)O)=NC=C1 L14301 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.113 CC1=NC([C@@H](C)N)=CC=C1 Q58193 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.113 CC1=NC([C@H](C)N)=CC=C1 Q58196 [0,1,0,0,0,0|2,0,1]=4 300 B10R1.113 CC1=NC=NC(C(=O)O)=C1 I-9646 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N24376 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 M23880 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.113 CN(C)C1=NC=CC(N)=C1 M23713 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.113 C[C@@H](N)C1=CC(Cl)=NC=C1 F-4328 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 O29507 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 P43499 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [0,1,0,0,0,0|1,0,1]=3 309 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 P51219 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58426 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58427 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.113 N=C(N)C1=CC=CC(N)=N1 Q58197 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 O29660 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [0,1,0,0,0,0|1,0,0]=2 316 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 O30750 [0,1,0,0,0,0|2,0,0]=3 317 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 G-6824 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 G-7501 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.113 NC(=S)C1=NC=CC(N)=C1 Q54468 [0,1,0,0,0,0|2,1,0]=4 320 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 10638 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 O32690 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.113 NC1=NC=CC(C(=O)O)=C1 G-6760 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.113 NC1=NC=CC(C(=O)O)=N1 O31660 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 A-722 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 Q66304 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 O30825 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 Q68020 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 G-6966 [0,1,0,0,0,0|3,0,0]=4 329 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 G-7305 [0,1,0,0,0,0|3,0,0]=4 330 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [0,1,0,0,0,0|2,0,0]=3 331 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [0,1,0,0,0,0|2,0,0]=3 334 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C-2323 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 O30875 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.113 O=C(O)C1=NC(O)=NC=C1 O30222 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.113 O=C1C=C(C(=O)O)NC=N1 Q57219 [0,1,0,0,0,0|3,0,0]=4 342 B10R1.113 O=[N+]([O-])C1=CC(F)=NC=C1 O31098 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 O30304 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 O30887 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.113 O=[N+]([O-])C1=CC=NC(Br)=C1 E-3102 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.113 O=[N+]([O-])C1=NC=CC(Br)=C1 Q53333 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.113 OB(O)C1=CC=CC(I)=C1 Q66503 [0,1,0,0,0,0|2,0,1]=4 348 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [0,0,0,1,0,0|2,0,1]=4 349 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [0,0,0,1,0,0|1,0,1]=3 350 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [0,0,0,1,0,0|2,0,1]=4 351 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [0,0,0,1,0,0|1,0,1]=3 352 B8R1.7 CC(=O)C1=CNC=N1 P51504 [0,0,0,0,1,0|2,0,0]=3 353 B8R1.7 CC(=O)C1=CNN=C1 H-8406 [0,0,0,0,1,0|2,0,0]=3 354 B8R1.7 CC(=O)C1=NNC=C1 Q62132 [0,0,0,0,1,0|2,0,0]=3 355 B8R1.7 CC(C)C1=CC=CO1 A-982 [0,0,0,0,1,0|2,0,1]=4 356 B8R1.7 CC(O)C1=CSC=C1 O31068 [0,0,0,0,1,0|1,0,2]=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|3,0,0]=4 364 B8R1.7 O=C(O)C1=CNN=C1 G-5584 [0,0,0,0,1,0|3,0,0]=4 365 B8R1.7 O=C(O)C1=COC=N1 I-9284 [0,0,0,0,1,0|3,0,0]=4 366 B8R1.7 O=C(O)C1=CSN=C1 L22423 [0,0,0,0,1,0|3,0,0]=4 367 B8R1.7 O=C(O)C1=NC=CO1 F-4564 [0,0,0,0,1,0|3,0,0]=4 368 B8R1.7 O=C(O)C1=NNC=C1 I-9172 [0,0,0,0,1,0|3,0,0]=4 369 B8R1.7 O=C(O)C1=NSC=C1 O30998 [0,0,0,0,1,0|3,0,0]=4 370 B8R1.7 O=C([O-])C1=NC=CO1 K16120 [0,0,0,0,1,0|3,0,0]=4 371 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [0,0,0,0,0,1|1,0,0]=2 372 B10R1.18 CC(=O)NC1=NC=NC=C1 O29559 [0,0,0,0,0,1|2,0,0]=3 373 B10R1.18 CC(C)OC1=NC=CC=C1 N24110 [0,0,0,0,0,1|2,0,1]=4 374 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [0,0,0,0,0,1|2,1,0]=4 375 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [0,0,0,0,0,1|3,0,0]=4 376 B10R1.18 O=C(O)CC1=CN=CN=C1 O33591 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.18 O=C(O)CC1=CN=NC=C1 G-5165 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [0,0,0,0,0,1|3,0,0]=4 379 B10R1.18 O=C([O-])CC1=CC=NN=C1 L13382 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.18 O=C([O-])CC1=NC=CC=N1 Q51814 [0,0,0,0,0,1|3,0,0]=4 381 B10R1.18 O=C([O-])CC1=NN=CC=C1 L13418 [0,0,0,0,0,1|3,0,0]=4 382 B7R1.3 CC1=CC=CN=N1 G-5190 [2,0,0,0,0,0|2,0,0]=4 383 B7R1.3 CC1=CN=CN=C1 O30773 [2,0,0,0,0,0|2,0,0]=4 384 B7R1.3 CC1=CN=NC=C1 G-5111 [2,0,0,0,0,0|2,0,0]=4 385 B7R1.3 CC1=NC=CC=N1 Q60049 [2,0,0,0,0,0|2,0,0]=4 386 B7R1.3 CC1=NC=NC=C1 G-5230 [2,0,0,0,0,0|2,0,0]=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 SC1=CC=CN=C1 Q62383 [2,0,0,0,0,0|1,1,0]=4 390 B9R1.1 C#CC1=CC=C(Br)C=C1 P36174 [1,1,0,0,0,0|0,0,2]=4 391 B9R1.1 C#CC1=CC=C(Cl)C=C1 C-3288 [1,1,0,0,0,0|0,0,2]=4 392 B9R1.1 C#CC1=CC=C(I)C=C1 P36173 [1,1,0,0,0,0|0,0,2]=4 393 B9R1.1 C(=O)C1=CN=C(Cl)C=C1 E-3026 [1,1,0,0,0,0|1,0,0]=3 394 B9R1.1 C(=O)C1=CN=C(Cl)N=C1 C-3437 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.1 C=CC1=CN=C(Br)C=C1 Q62407 [1,1,0,0,0,0|1,0,1]=4 396 B9R1.1 C=CC1=CN=C(C)C=C1 L13585 [1,1,0,0,0,0|1,0,1]=4 397 B9R1.1 C=CC1=CN=C(F)C=C1 L14939 [1,1,0,0,0,0|1,0,1]=4 398 B9R1.1 C=CC1=CN=C(F)C=C1 O29601 [1,1,0,0,0,0|1,0,1]=4 399 B9R1.1 C=CC1=NC=C(Cl)C=C1 O33380 [1,1,0,0,0,0|1,0,1]=4 400 B9R1.1 CC1=CN=C(C=O)C=C1 Q67276 [1,1,0,0,0,0|1,0,0]=3 401 B9R1.1 CC1=CN=C(C=O)C=N1 O30472 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.1 CC1=CN=C(C=O)N=C1 G-6319 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.1 CC1=NC=C(C=O)C=C1 C-2363 [1,1,0,0,0,0|1,0,0]=3 404 B9R1.1 CC1=NC=C(C=O)C=N1 A-729 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.1 CCC1=CC=C(Br)N=C1 Q57112 [1,1,0,0,0,0|1,0,1]=4 406 B9R1.1 CCC1=CC=C(Cl)N=C1 Q57111 [1,1,0,0,0,0|1,0,1]=4 407 B9R1.1 CCC1=CC=C(N)C=N1 A-656 [1,1,0,0,0,0|1,0,1]=4 408 B9R1.1 CCC1=NC=C(Br)C=C1 G-6695 [1,1,0,0,0,0|1,0,1]=4 409 B9R1.1 CNC1=CC=C(Br)N=C1 Q65482 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.1 CNC1=CC=C(F)C=N1 Q58345 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [1,1,0,0,0,0|1,0,0]=3 412 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [1,1,0,0,0,0|1,0,0]=3 413 B9R1.1 CNC1=CC=C(N)N=C1 Q58290 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.1 CNC1=CC=C(N)N=C1 Q58291 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.1 CNC1=NC=C(Br)C=C1 P35851 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.1 COC1=CN=C(Br)C=C1 Q67224 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.1 COC1=CN=C(Cl)C=C1 Q67222 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.1 COC1=CN=C(F)C=C1 N24701 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.1 COC1=CN=C(N)C=C1 G-7588 [1,1,0,0,0,0|2,0,0]=4 421 B9R1.1 COC1=NC=C(C)C=C1 Q67071 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.1 COC1=NC=C(F)C=C1 P37735 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.1 COC1=NC=C(I)C=C1 Q67264 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.1 COC1=NC=C(O)C=C1 Q67584 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.1 CSC1=CN=C(Br)C=C1 N24931 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.1 CSC1=CN=C(F)C=C1 N26916 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.1 CSC1=NC=C(Br)C=C1 Q66696 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.1 CSC1=NC=C(C)C=C1 N24295 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.1 CSC1=NC=C(Cl)C=C1 N24817 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.1 N#CC1=CC=C(S)C=C1 O30392 [1,1,0,0,0,0|1,0,1]=4 431 B9R1.1 NC1=CC=C(C=O)C=N1 L13611 [1,1,0,0,0,0|1,0,0]=3 432 B9R1.1 NC1=CN=C(C=O)C=N1 P51620 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [1,1,0,0,0,0|1,0,1]=4 434 B9R1.1 NNC1=CC=C(Br)C=C1 P38159 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.1 NNC1=CC=C(F)C=C1 P38478 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.1 O=CC1=CC=C(O)C=N1 P44434 [1,1,0,0,0,0|1,0,0]=3 437 B9R1.1 O=CC1=CN=C(Br)N=C1 Q53659 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.1 O=CC1=CN=C(F)C=C1 P50975 [1,1,0,0,0,0|1,0,0]=3 439 B9R1.1 O=CC1=NC=C(Br)C=N1 G-6054 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.1 O=CC1=NC=C(Cl)C=C1 Q67275 [1,1,0,0,0,0|1,0,0]=3 441 B9R1.1 O=CC1=NC=C(Cl)N=C1 I-9606 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.1 O=CC1=NC=C(F)C=C1 O30696 [1,1,0,0,0,0|1,0,0]=3 443 B9R1.1 O=CC1=NC=C(F)C=N1 G-7866 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.1 O=CC1=NN=C(Cl)C=C1 G-7962 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.1 O=CC1=NN=C(O)C=C1 O30370 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [1,1,0,0,0,0|0,0,2]=4 447 B9R1.2 C#CC1=CC(O)=CC=C1 P42883 [1,1,0,0,0,0|0,0,2]=4 448 B9R1.2 C#CC1=CC=CC(Br)=C1 O27910 [1,1,0,0,0,0|0,0,2]=4 449 B9R1.2 C#CC1=CC=CC(C)=C1 P36176 [1,1,0,0,0,0|0,0,2]=4 450 B9R1.2 C(=O)C1=CC=CC(Br)=N1 C-3289 [1,1,0,0,0,0|1,0,0]=3 451 B9R1.2 C(=O)C1=CC=NC(Cl)=C1 C-3314 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.2 C(=O)C1=CC=NC(Cl)=N1 Q56440 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.2 C=CC1=CN=CC(C)=C1 O31501 [1,1,0,0,0,0|1,0,1]=4 454 B9R1.2 C=CC1=CN=CC(F)=C1 L21838 [1,1,0,0,0,0|1,0,1]=4 455 B9R1.2 C=CC1=NC(Br)=CC=C1 L18289 [1,1,0,0,0,0|1,0,1]=4 456 B9R1.2 CC1=CC(C=O)=NC=C1 O31911 [1,1,0,0,0,0|1,0,0]=3 457 B9R1.2 CC1=CC(C=O)=NC=N1 Q60298 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.2 CC1=CC=NC(C=O)=N1 P44430 [1,1,0,0,0,0|2,0,0]=4 459 B9R1.2 CC1=CN=CC(C=O)=C1 M15605 [1,1,0,0,0,0|1,0,0]=3 460 B9R1.2 CCC1=CC(Br)=NC=C1 P45487 [1,1,0,0,0,0|1,0,1]=4 461 B9R1.2 CCC1=CC=CC(Br)=N1 Q52717 [1,1,0,0,0,0|1,0,1]=4 462 B9R1.2 CCC1=CC=CC(Cl)=N1 Q62319 [1,1,0,0,0,0|1,0,1]=4 463 B9R1.2 CCC1=CC=CC(F)=N1 Q62318 [1,1,0,0,0,0|1,0,1]=4 464 B9R1.2 CCC1=NC=CC(N)=C1 L18226 [1,1,0,0,0,0|1,0,1]=4 465 B9R1.2 CNC1=CC(Br)=CN=C1 P51196 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.2 CNC1=CC(C)=CC=N1 Q58361 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.2 CNC1=CC(C)=CC=N1 Q58362 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.2 CNC1=CC(O)=CC=C1 P41161 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.2 CNC1=CC=CC(F)=N1 Q58333 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.2 CNC1=CC=CC(I)=C1 P37043 [1,1,0,0,0,0|1,0,0]=3 471 B9R1.2 CNC1=NC=CC(I)=C1 N26836 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.2 COC1=CC(C)=CN=C1 N25271 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.2 COC1=CC(F)=NC=C1 Q67856 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.2 COC1=CC(N)=CN=C1 Q56314 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.2 COC1=CC=CC(I)=N1 O32550 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.2 COC1=CN=CC(Cl)=C1 S70722 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.2 COC1=CN=CC(N)=C1 G-6107 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.2 COC1=CN=CC(O)=C1 O31805 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.2 COC1=NC=CC(Br)=C1 Q67517 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.2 COC1=NC=CC(Cl)=C1 Q68014 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.2 COC1=NC=CC(I)=C1 Q67717 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.2 COC1=NC=CC(N)=C1 G-5580 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.2 COC1=NC=CC(O)=C1 N25339 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.2 CSC1=CC(F)=NC=C1 N26858 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.2 CSC1=CC=CC(Br)=N1 P51643 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.2 CSC1=CN=CC(Br)=C1 Q67547 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.2 CSC1=CN=CC(Cl)=C1 N26275 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.2 CSC1=CN=CC(O)=C1 N26050 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.2 NC1=CC(C=O)=CC=C1 O30581 [1,1,0,0,0,0|0,0,0]=2 490 B9R1.2 NC1=NC(C=O)=CC=C1 Q53329 [1,1,0,0,0,0|1,0,0]=3 491 B9R1.2 NC1=NC=CC(C=O)=C1 G-5572 [1,1,0,0,0,0|1,0,0]=3 492 B9R1.2 NCC1=CC(O)=CC=C1 P36367 [1,1,0,0,0,0|1,0,1]=4 493 B9R1.2 NCC1=CC=CC(F)=C1 N26365 [1,1,0,0,0,0|1,0,1]=4 494 B9R1.2 O=CC1=CC(Cl)=CN=C1 L21834 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.2 O=CC1=CC(Cl)=NC=N1 Q52806 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.2 O=CC1=CC(F)=CN=C1 C-3502 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.2 O=CC1=CC(F)=NC=C1 Q66309 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.2 O=CC1=CC(O)=CN=C1 O31574 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.2 O=CC1=NC(Br)=CC=N1 Q56237 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.2 O=CC1=NC=CC(Cl)=C1 G-5341 [1,1,0,0,0,0|1,0,0]=3 501 B9R1.2 O=CC1=NC=CC(F)=C1 Q56665 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.2 O=CC1=NC=CC(O)=C1 Q53140 [1,1,0,0,0,0|1,0,0]=3 503 B9R1.2 O=CC1=NC=NC(O)=C1 S72508 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.2 OC1=CC=CC(CBr)=C1 O29845 [1,1,0,0,0,0|1,0,1]=4 505 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,1,0,0,0,0|1,0,1]=4 506 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,1,0,0,0,0|1,0,1]=4 507 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,1,0,0,0,0|1,0,1]=4 508 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,1,0,0,0,0|1,0,1]=4 509 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,1,0,0,0,0|1,0,1]=4 510 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,1,0,0,0,0|1,0,1]=4 511 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,1,0,0,0,0|1,0,1]=4 512 B9R1.8 O=C=NC1=NC=CC=C1 P43266 [1,1,0,0,0,0|1,0,1]=4 513 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,1,0,0,0,0|1,0,0]=3 514 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,1,0,0,0,0|1,0,1]=4 515 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,1,0,0,0,0|1,0,1]=4 516 B9R1.15 C#CC1=CC=CC=C1Br O27884 [1,1,0,0,0,0|0,0,2]=4 517 B9R1.15 C#CC1=CC=CC=C1C O28000 [1,1,0,0,0,0|0,0,2]=4 518 B9R1.15 C#CC1=CC=CC=C1N L13529 [1,1,0,0,0,0|0,0,2]=4 519 B9R1.15 C#CC1=CC=CC=C1O O30353 [1,1,0,0,0,0|0,0,2]=4 520 B9R1.15 C(=O)C1=C(O)C=CN=C1 Q57085 [1,1,0,0,0,0|1,0,0]=3 521 B9R1.15 C(=O)C1=CC=CN=C1C C-2892 [1,1,0,0,0,0|1,0,0]=3 522 B9R1.15 C(=O)C1=CC=CN=C1N E-3082 [1,1,0,0,0,0|1,0,0]=3 523 B9R1.15 C(=O)C1=CN=CC=C1C C-2893 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.15 C(=O)C1=CN=CN=C1N Q55481 [1,1,0,0,0,0|2,0,0]=4 525 B9R1.15 C(=O)C1=NC=CN=C1Cl L18467 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.15 C(=O)C1=NC=CN=C1N C-3433 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.15 C(=O)C1=NC=NC=C1N Q55482 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.15 C=CC1=C(C)N=CC=C1 L14938 [1,1,0,0,0,0|1,0,1]=4 529 B9R1.15 C=CC1=CC=CC=C1N O30540 [1,1,0,0,0,0|0,0,1]=3 530 B9R1.15 C=CC1=CC=CN=C1Br O29963 [1,1,0,0,0,0|1,0,1]=4 531 B9R1.15 CC1=C(C=O)N=CC=C1 G-5812 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.15 CC1=NC=NC=C1C=O Q60398 [1,1,0,0,0,0|2,0,0]=4 533 B9R1.15 CCC1=C(Br)C=CN=C1 G-5778 [1,1,0,0,0,0|1,0,1]=4 534 B9R1.15 CCC1=C(Br)C=CN=C1 L22190 [1,1,0,0,0,0|1,0,1]=4 535 B9R1.15 CCC1=C(Br)C=CN=C1 Q52444 [1,1,0,0,0,0|1,0,1]=4 536 B9R1.15 CCC1=C(Br)C=NC=C1 P44427 [1,1,0,0,0,0|1,0,1]=4 537 B9R1.15 CCC1=CC=CN=C1N P38117 [1,1,0,0,0,0|1,0,1]=4 538 B9R1.15 CNC1=NC=CC=C1F Q69363 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.15 CNC1=NC=CC=C1I N27017 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.15 CNC1=NC=CC=C1N M23208 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.15 COC1=C(Br)C=CN=C1 H-8447 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.15 COC1=C(Br)C=CN=C1 O30229 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.15 COC1=C(Br)C=NC=C1 O30836 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.15 COC1=C(I)C=NC=C1 N24568 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.15 COC1=C(N)C=CN=C1 I-9880 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.15 COC1=C(N)C=NC=C1 O31833 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.15 COC1=C(O)C=NC=C1 O30206 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.15 COC1=CC=CN=C1Br Q70056 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.15 COC1=CC=CN=C1Cl Q67413 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.15 COC1=CC=CN=C1F Q67464 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.15 COC1=CC=CN=C1N Q67917 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.15 COC1=NC=CC=C1Br Q66368 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.15 COC1=NC=CC=C1Cl Q67093 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.15 COC1=NC=CC=C1O Q67611 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.15 CSC1=C(Br)C=CN=C1 N25058 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.15 CSC1=C(F)C=NC=C1 N26954 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.15 CSC1=CC=CN=C1Cl N24208 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.15 CSC1=CC=CN=C1F Q67766 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.15 CSC1=NC=CC=C1Cl N27821 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.15 NC1=C(C=O)C=CN=C1 I-9640 [1,1,0,0,0,0|1,0,0]=3 561 B9R1.15 NC1=C(C=O)C=NC=C1 Q51902 [1,1,0,0,0,0|1,0,0]=3 562 B9R1.15 NC1=CC=CC=C1CO G-7793 [1,1,0,0,0,0|0,0,2]=4 563 B9R1.15 NCC1=CC=CC=C1Br P38336 [1,1,0,0,0,0|1,0,1]=4 564 B9R1.15 NCC1=CC=CC=C1I P38307 [1,1,0,0,0,0|1,0,1]=4 565 B9R1.15 O=CC1=C(Br)C=CN=C1 L14209 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.15 O=CC1=C(Br)C=CN=C1 L21843 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.15 O=CC1=C(Br)C=CN=C1 N24911 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.15 O=CC1=C(Br)C=NC=C1 Q66929 [1,1,0,0,0,0|1,0,0]=3 569 B9R1.15 O=CC1=C(Br)C=NC=C1 Q67986 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.15 O=CC1=C(Cl)C=CN=C1 G-7008 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.15 O=CC1=C(Cl)C=CN=C1 N24210 [1,1,0,0,0,0|1,0,0]=3 572 B9R1.15 O=CC1=C(Cl)C=NC=C1 N27329 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.15 O=CC1=C(Cl)N=CN=C1 Q53710 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.15 O=CC1=C(F)C=CN=C1 Q56666 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.15 O=CC1=C(I)C=CC=C1 G-5775 [1,1,0,0,0,0|0,0,0]=2 576 B9R1.15 O=CC1=NC=CC=C1Br O31907 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.15 O=CC1=NC=CC=C1Cl O31967 [1,1,0,0,0,0|1,0,0]=3 578 B9R1.15 O=CC1=NC=CC=C1F Q66589 [1,1,0,0,0,0|1,0,0]=3 579 B9R1.15 O=CC1=NC=CC=C1O L22205 [1,1,0,0,0,0|1,0,0]=3 580 B9R1.11 CNC(=O)C1=CNN=C1 L21508 [0,1,0,0,1,0|2,0,0]=4 581 B9R1.11 CNC(=O)N1C=CN=C1 F-4391 [0,1,0,0,1,0|2,0,0]=4 582 B9R1.11 COC(=O)C1=CC=CN1 G-7797 [0,1,0,0,1,0|1,0,0]=3 583 B9R1.11 COC(=O)C1=CN=CO1 O30359 [0,1,0,0,1,0|2,0,0]=4 584 B9R1.11 COC(=O)C1=CN=CS1 P48087 [0,1,0,0,1,0|2,0,0]=4 585 B9R1.11 COC(=O)C1=CNN=C1 G-7338 [0,1,0,0,1,0|2,0,0]=4 586 B9R1.11 COC(=O)C1=NC=CN1 G-6057 [0,1,0,0,1,0|2,0,0]=4 587 B9R1.11 COC(=O)C1=NC=CS1 P37422 [0,1,0,0,1,0|2,0,0]=4 588 B9R1.11 COC(=O)C1=NNC=C1 P40994 [0,1,0,0,1,0|2,0,0]=4 589 B9R1.11 O=C(CBr)C1=CC=CS1 P43533 [0,1,0,0,1,0|1,0,0]=3 590 B9R1.11 O=C(CBr)C1=CSC=C1 O31908 [0,1,0,0,1,0|1,0,0]=3 591 B9R1.11 O=C(CBr)C1=CSC=N1 O31047 [0,1,0,0,1,0|2,0,0]=4 592 B9R1.11 O=C(CBr)C1=NC=CS1 O31894 [0,1,0,0,1,0|2,0,0]=4 593 B9R1.11 O=CC(=O)C1=CC=CS1 P41441 [0,1,0,0,1,0|1,0,1]=4 594 B9R1.35 CC(=O)C1=CC(Br)=CS1 Q67343 [0,1,0,0,1,0|1,0,0]=3 595 B9R1.35 CC(=O)C1=CN(C)N=C1 O31882 [0,1,0,0,1,0|2,0,0]=4 596 B9R1.35 CC(=O)C1=CN=C(N)S1 L18220 [0,1,0,0,1,0|2,0,0]=4 597 B9R1.35 CC(=O)C1=CSC(Cl)=C1 G-5625 [0,1,0,0,1,0|1,0,0]=3 598 B9R1.35 CC(=O)C1=NC(Br)=CS1 Q68164 [0,1,0,0,1,0|2,0,0]=4 599 B9R1.35 CC(=O)C1=NC(C)=CO1 M15480 [0,1,0,0,1,0|2,0,0]=4 600 B9R1.35 CC(=O)C1=NC=C(Br)S1 I-9633 [0,1,0,0,1,0|2,0,0]=4 601 B9R1.35 CC(=O)C1=NC=C(C)S1 O31088 [0,1,0,0,1,0|2,0,0]=4 602 B9R1.35 CC(=O)C1=NN(C)C=C1 K12255 [0,1,0,0,1,0|2,0,0]=4 603 B9R1.35 CC(=O)C1=NNC(N)=C1 G-7055 [0,1,0,0,1,0|2,0,0]=4 604 B9R1.35 CC1=CC(C(=O)O)=CN1 M15493 [0,1,0,0,1,0|2,0,0]=4 605 B9R1.35 CC1=CC(C(=O)O)=CS1 I-9860 [0,1,0,0,1,0|2,0,0]=4 606 B9R1.35 CC1=COC(C(=O)O)=C1 O29596 [0,1,0,0,1,0|2,0,0]=4 607 B9R1.35 CC1=CSC(C(=O)O)=C1 G-7586 [0,1,0,0,1,0|2,0,0]=4 608 B9R1.35 NC(=O)C1=CC=C(Br)N1 G-6434 [0,1,0,0,1,0|2,0,0]=4 609 B9R1.35 O=C(O)C1=CC(Cl)=CS1 O30065 [0,1,0,0,1,0|2,0,0]=4 610 B9R1.35 O=C(O)C1=CC=C(Cl)S1 G-6814 [0,1,0,0,1,0|2,0,0]=4 611 B9R1.35 O=C(O)C1=CC=C(F)S1 G-5621 [0,1,0,0,1,0|2,0,0]=4 612 B9R1.35 O=C(O)C1=CSC(Cl)=C1 G-5624 [0,1,0,0,1,0|2,0,0]=4 613 B9R1.41 CC(=O)C1=C(Br)C=CS1 Q65588 [0,1,0,0,1,0|1,0,0]=3 614 B9R1.41 CC(=O)C1=CC=NN1C N24556 [0,1,0,0,1,0|2,0,0]=4 615 B9R1.41 CC(=O)C1=NC=CN1C C-2913 [0,1,0,0,1,0|2,0,0]=4 616 B9R1.41 CC1=CSC=C1C(=O)O L22411 [0,1,0,0,1,0|2,0,0]=4 617 B9R1.41 NC(=O)C1=CC=CN1N L13700 [0,1,0,0,1,0|2,0,0]=4 618 B9R1.41 NC1=C(C(=O)O)C=CS1 P44611 [0,1,0,0,1,0|2,0,0]=4 619 B9R1.41 O=C(O)C1=C(Br)C=CS1 G-6768 [0,1,0,0,1,0|2,0,0]=4 620 B9R1.41 O=C(O)C1=C(Cl)C=CN1 H-8302 [0,1,0,0,1,0|2,0,0]=4 621 B9R1.41 O=C(O)C1=CSC=C1Br G-7938 [0,1,0,0,1,0|2,0,0]=4 622 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 P38969 [0,1,0,0,0,1|1,0,0]=3 623 B11R1.20 CC(=O)NC1=CC=C(N)N=C1 Q58423 [0,1,0,0,0,1|1,0,0]=3 624 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 L19034 [0,1,0,0,0,1|1,0,0]=3 625 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 M15214 [0,1,0,0,0,1|1,0,0]=3 626 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 P40160 [0,1,0,0,0,1|0,0,0]=2 627 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 P41430 [0,1,0,0,0,1|0,0,0]=2 628 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 P42284 [0,1,0,0,0,1|1,0,1]=4 629 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 P36150 [0,1,0,0,0,1|1,0,1]=4 630 B11R1.20 CC(C)NC1=CC=C(F)C=C1 P36529 [0,1,0,0,0,1|1,0,1]=4 631 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Q66408 [0,1,0,0,0,1|1,0,1]=4 632 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Q67546 [0,1,0,0,0,1|1,0,1]=4 633 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [0,1,0,0,0,1|1,0,1]=4 634 B11R1.20 CC(N)CC1=CC=C(Br)C=C1 P41684 [0,1,0,0,0,1|1,0,1]=4 635 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 P43234 [0,1,0,0,0,1|1,1,0]=4 636 B11R1.20 CN(C)CC1=CC=C(N)C=C1 P36889 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 O31092 [0,1,0,0,0,1|1,0,0]=3 638 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 Q62419 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.20 O=C(O)CC1=CC=C(Br)N=C1 P38230 [0,1,0,0,0,1|2,0,0]=4 640 B11R1.20 O=C(O)CC1=CC=C(F)C=N1 I-9943 [0,1,0,0,0,1|2,0,0]=4 641 B11R1.20 O=C(O)CC1=CC=C(I)C=N1 P49243 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 L13539 [0,1,0,0,0,1|2,0,0]=4 643 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 Q52525 [0,1,0,0,0,1|2,0,0]=4 644 B11R1.36 CC(C(=O)O)C1=CC=CN=C1 O29526 [0,1,0,0,0,1|2,0,0]=4 645 B11R1.36 CC(C(=O)O)C1=NC=CC=C1 O29926 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.36 CC(C)C(C)C1=CC=CC=C1 P43269 [0,1,0,0,0,1|1,0,1]=4 647 B11R1.36 CC(C)C(N)C1=CC=CC=C1 P36744 [0,1,0,0,0,1|1,0,1]=4 648 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 P37697 [0,1,0,0,0,1|1,0,0]=3 649 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 Q63762 [0,1,0,0,0,1|2,0,0]=4 650 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 Q63763 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.36 N[C@H](C(=O)O)C1=CC=NC=C1 Q63764 [0,1,0,0,0,1|2,0,0]=4 652 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58337 [0,1,0,0,0,1|2,0,0]=4 653 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58338 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.40 C=CC(=O)NC1=CC=CC=N1 Q58307 [0,1,0,0,0,1|1,0,1]=4 655 B11R1.40 C=CC(=O)NC1=CC=CN=C1 Q58308 [0,1,0,0,0,1|1,0,1]=4 656 B11R1.40 CC(C#N)NC1=CC=CC=C1 M15456 [0,1,0,0,0,1|1,0,1]=4 657 B11R1.40 CC(CN)OC1=CC=CC=C1 P36860 [0,1,0,0,0,1|1,0,1]=4 658 B11R1.40 CCC(N)CC1=CC=CC=C1 P38928 [0,1,0,0,0,1|1,0,1]=4 659 B11R1.40 COC(=O)CC1=CC=CN=C1 P38302 [0,1,0,0,0,1|1,0,0]=3 660 B11R1.40 COC(=O)CC1=CC=NN=C1 G-6745 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.40 COC(=O)CC1=NC=NC=C1 P44252 [0,1,0,0,0,1|2,0,0]=4 662 B11R1.40 COC(=O)CC1=NN=CC=C1 G-6749 [0,1,0,0,0,1|2,0,0]=4 663 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [0,1,0,0,0,1|1,0,1]=4 664 B11R1.40 NCC(=O)NC1=CC=CC=C1 P37442 [0,1,0,0,0,1|0,0,0]=2 665 B11R1.40 NNC(=O)CC1=CC=NC=C1 P36560 [0,1,0,0,0,1|2,0,0]=4 666 B11R1.40 O=C(CBr)CC1=CC=CC=C1 O31255 [0,1,0,0,0,1|0,0,0]=2 667 B11R1.40 O=C(CBr)NC1=CC=CC=C1 P37595 [0,1,0,0,0,1|0,0,0]=2 668 B11R1.40 O=C(CC1=CC=CC=C1)NO P37592 [0,1,0,0,0,1|1,0,0]=3 669 B11R1.40 O=C(CCl)NC1=CC=CN=C1 P36081 [0,1,0,0,0,1|1,0,0]=3 670 B11R1.86 CC(=O)CC1=NC=CC=C1Br Q58439 [0,1,0,0,0,1|1,0,0]=3 671 B11R1.86 CC(=O)CC1=NC=CC=C1Cl Q58438 [0,1,0,0,0,1|1,0,0]=3 672 B11R1.86 CC(=O)OC1=CC=CC=C1Br P40333 [0,1,0,0,0,1|0,0,0]=2 673 B11R1.86 CC(C)NC1=CC=CC=C1Br P40936 [0,1,0,0,0,1|1,0,1]=4 674 B11R1.86 CC(C)NC1=CC=CC=C1Cl P36079 [0,1,0,0,0,1|1,0,1]=4 675 B11R1.86 CC(C)NC1=CC=CC=C1F P42616 [0,1,0,0,0,1|1,0,1]=4 676 B11R1.86 CC(C)NC1=CC=CC=C1N P36500 [0,1,0,0,0,1|1,0,1]=4 677 B11R1.86 CC(C)OC1=CC=CC=C1F Q67217 [0,1,0,0,0,1|1,0,1]=4 678 B11R1.86 CC(N)CC1=C(O)C=CC=C1 L19732 [0,1,0,0,0,1|1,0,1]=4 679 B11R1.86 CC1=C(CC(=O)O)C=CC=N1 H-8205 [0,1,0,0,0,1|2,0,0]=4 680 B11R1.86 CC1=CC=NC=C1CC(=O)O Q60617 [0,1,0,0,0,1|2,0,0]=4 681 B11R1.86 CN(C)CC1=CC=CC=C1Br Q68057 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.86 CN(C)CC1=CC=CC=C1N P40192 [0,1,0,0,0,1|2,0,0]=4 683 B11R1.86 FC1=CC=CC=C1C=C(Br)Br P43279 [0,1,0,0,0,1|2,0,0]=4 684 B11R1.86 NC1=CC=CC=C1CC(=O)O P38750 [0,1,0,0,0,1|1,0,0]=3 685 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 Q60647 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.86 O=C(O)CC1=CC=CN=C1Cl G-5570 [0,1,0,0,0,1|2,0,0]=4 687 B11R1.86 O=C(O)CC1=CC=NC=C1Cl Q60592 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.86 O=C(O)CC1=NC=CC=C1Br I-9578 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.86 O=C(O)CC1=NC=CC=C1O F-4648 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 Q69806 [0,1,0,0,0,1|1,0,0]=3 691 B11R1.157 CC(=O)NC1=NC=NC(Cl)=C1 O29465 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.157 CC(=O)NC1=NC=NC(N)=C1 O32446 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 P38633 [0,1,0,0,0,1|0,0,0]=2 694 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 P41926 [0,1,0,0,0,1|1,0,1]=4 695 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 P38903 [0,1,0,0,0,1|1,0,1]=4 696 B11R1.157 CC(C)NC1=CC=CC(F)=C1 P42251 [0,1,0,0,0,1|1,0,1]=4 697 B11R1.157 CC(C)OC1=CC(F)=CC=C1 Q66828 [0,1,0,0,0,1|1,0,1]=4 698 B11R1.157 CC(C)OC1=CC=CC(O)=C1 N24861 [0,1,0,0,0,1|1,0,1]=4 699 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 L21790 [0,1,0,0,0,1|2,0,0]=4 700 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 Q60602 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.157 CC1=CC(NC(C)C)=CC=C1 P42983 [0,1,0,0,0,1|1,0,1]=4 702 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 M15842 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.157 CC1=CC=NC(CC(=O)O)=C1 Q52544 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.157 CC1=NC=CC(CC(=O)O)=C1 Q52656 [0,1,0,0,0,1|2,0,0]=4 705 B11R1.157 CN(C)CC1=CC(N)=CC=C1 P39096 [0,1,0,0,0,1|2,0,0]=4 706 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 Q67698 [0,1,0,0,0,1|2,0,0]=4 707 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 C-3500 [0,1,0,0,0,1|2,0,0]=4 708 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 P42693 [0,1,0,0,0,1|2,0,0]=4 709 B11R1.157 O=C(O)CC1=NC(F)=CC=C1 L21789 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.157 O=C(O)CC1=NC(O)=CC=C1 S72816 [0,1,0,0,0,1|2,0,0]=4 711 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 Q60753 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.157 O=C(O)CC1=NC=CC(F)=C1 Q60777 [0,1,0,0,0,1|2,0,0]=4 713 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 O28118 [0,2,0,0,0,0|1,0,0]=3 714 B11R1.3 C#CC1=CC=C(C(=O)O)C=N1 Q53214 [0,2,0,0,0,0|2,0,0]=4 715 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,2,0,0,0,0|0,0,0]=2 716 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 O27944 [0,2,0,0,0,0|2,0,0]=4 717 B11R1.3 C#CC1=CC=C([N+](=O)[O-])C=C1 S86243 [0,2,0,0,0,0|2,0,0]=4 718 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,2,0,0,0,0|0,0,0]=2 719 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,2,0,0,0,0|0,0,0]=2 720 B11R1.3 CC(N)C1=CC=C(C#N)C=C1 P35710 [0,2,0,0,0,0|1,0,1]=4 721 B11R1.3 CC(N)C1=CC=C(CO)C=C1 P38103 [0,2,0,0,0,0|1,0,1]=4 722 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 P37663 [0,2,0,0,0,0|0,0,2]=4 723 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [0,2,0,0,0,0|1,0,1]=4 725 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [0,2,0,0,0,0|0,0,2]=4 726 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 Q60524 [0,2,0,0,0,0|2,0,0]=4 727 B11R1.3 CN(C)C1=CC=C(CN)C=C1 P40156 [0,2,0,0,0,0|2,0,0]=4 728 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O28119 [0,2,0,0,0,0|2,0,0]=4 729 B11R1.3 CNC1=CC=C(N(C)C)C=C1 P37575 [0,2,0,0,0,0|2,0,0]=4 730 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 P50006 [0,2,0,0,0,0|2,0,0]=4 731 B11R1.3 COC1=CN=C(C(=O)O)C=C1 Q68348 [0,2,0,0,0,0|2,0,0]=4 732 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 N24630 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 P43237 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 P38941 [0,2,0,0,0,0|1,0,0]=3 735 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 P43253 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 E-3027 [0,2,0,0,0,0|2,0,0]=4 737 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 P37128 [0,2,0,0,0,0|1,0,0]=3 738 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 O28757 [0,2,0,0,0,0|1,0,0]=3 739 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 P50970 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 G-5405 [0,2,0,0,0,0|2,0,0]=4 741 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 A-701 [0,2,0,0,0,0|2,0,0]=4 742 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 P44354 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [0,2,0,0,0,0|1,0,0]=3 744 B11R1.3 O=CC1=CC=C(C(=O)O)C=N1 Q62284 [0,2,0,0,0,0|2,0,0]=4 745 B11R1.3 O=CC1=CN=C(C(=O)O)C=C1 Q60215 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P40451 [0,2,0,0,0,0|1,0,1]=4 747 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P42464 [0,2,0,0,0,0|1,0,1]=4 748 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 P40452 [0,2,0,0,0,0|1,0,1]=4 749 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 O30550 [0,2,0,0,0,0|1,0,1]=4 750 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 P42234 [0,2,0,0,0,0|1,0,1]=4 751 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 P39871 [0,2,0,0,0,0|0,0,2]=4 752 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 P36818 [0,2,0,0,0,0|1,0,1]=4 753 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1765 [0,2,0,0,0,0|2,0,0]=4 754 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1766 [0,2,0,0,0,0|2,0,0]=4 755 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 G-6636-1 [0,2,0,0,0,0|2,0,0]=4 756 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H-8848 [0,2,0,0,0,0|2,0,0]=4 757 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 L14045 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O32785 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P45972 [0,2,0,0,0,0|2,0,0]=4 760 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P48341 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P50560 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q54491 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56087 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56091 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q69557 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 G-7786 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.19 CS(=N)(=O)C1=CC=C(Cl)C=C1 F-4632 [0,2,0,0,0,0|1,0,0]=3 768 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=C1 S72495 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 M15585 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.21 CC(=O)C1=CC(Cl)=C(C)N=C1 O29923 [0,2,0,0,0,0|1,0,0]=3 771 B11R1.21 CC(=O)C1=CC=C(Br)C(Cl)=C1 M15796 [0,2,0,0,0,0|0,0,0]=2 772 B11R1.21 CC(=O)C1=CC=C(Cl)C(Br)=C1 Q66292 [0,2,0,0,0,0|0,0,0]=2 773 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 N25331 [0,2,0,0,0,0|0,0,0]=2 774 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 N25776 [0,2,0,0,0,0|1,0,1]=4 775 B11R1.21 CC(C)C1=CC=C(Cl)C(Br)=C1 Q67346 [0,2,0,0,0,0|1,0,1]=4 776 B11R1.21 CC(C)C1=CC=C(Cl)C(O)=C1 Q67377 [0,2,0,0,0,0|1,0,1]=4 777 B11R1.21 CC(C)C1=CC=C(I)C(Br)=C1 Q67564 [0,2,0,0,0,0|1,0,1]=4 778 B11R1.21 CC(C)C1=CC=C(O)C(Br)=C1 Q67536 [0,2,0,0,0,0|1,0,1]=4 779 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 P36289 [0,2,0,0,0,0|1,0,1]=4 780 B11R1.21 CC(N)C1=CC=C(Cl)C(F)=C1 P36050 [0,2,0,0,0,0|1,0,1]=4 781 B11R1.21 CC(N)C1=CC=C(F)C(F)=C1 P39119 [0,2,0,0,0,0|1,0,1]=4 782 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 Q67058 [0,2,0,0,0,0|0,0,2]=4 783 B11R1.21 CC1=C(Br)N=C(C(=O)O)C=C1 Q53116 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=N1 Q60858 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.21 CC1=C(O)C=C(C(=O)O)C=N1 Q60795 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.21 CC1=C(O)N=CC(C(=O)O)=C1 L19518 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.21 CC1=CC(C(=O)Cl)=NC=C1Br N27305 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.21 CC1=CC(C(=O)O)=CN=C1Br Q66669 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q68802 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q69971 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.21 CC1=CC(C(=O)O)=CN=C1Cl N25124 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.21 CC1=CC(C(=O)O)=CN=C1F Q66670 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br Q67785 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.21 CC1=CC(C(N)=O)=CC=C1N M15755 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br N25351 [0,2,0,0,0,0|2,0,0]=4 796 B11R1.21 CC1=CC=C(C(C)O)C=C1C M22902 [0,2,0,0,0,0|0,0,2]=4 797 B11R1.21 CC1=CC=C(N(C)C)C=C1Br N25454 [0,2,0,0,0,0|2,0,0]=4 798 B11R1.21 CC1=CN=C(C(=O)O)C=C1C Q60799 [0,2,0,0,0,0|2,0,0]=4 799 B11R1.21 CC1=CN=C(C(=O)O)C=C1Cl Q52680 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.21 CC1=CN=C(C(=O)O)C=C1N Q53529 [0,2,0,0,0,0|2,0,0]=4 801 B11R1.21 CC1=NC(C(=O)Cl)=CC=C1Br N27313 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br Q67308 [0,2,0,0,0,0|2,0,0]=4 803 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br N25229 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br P51094 [0,2,0,0,0,0|2,0,0]=4 805 B11R1.21 CC1=NC=C(C(=O)O)C=C1N G-6537 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.21 CN1C=C(C(=O)O)C=CC1=O G-5206 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.21 CN1C=CC(C(=O)O)=CC1=O C-2302 [0,2,0,0,0,0|2,0,0]=4 808 B11R1.21 CN1C=CC(C(N)=O)=CC1=O I-9710 [0,2,0,0,0,0|2,0,0]=4 809 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 O30355 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 O30426 [0,2,0,0,0,0|2,0,0]=4 811 B11R1.21 NC(=O)C1=CC(F)=C(Cl)N=C1 O29836 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.21 NC(=O)C1=NC(Br)=C(F)C=C1 O31506 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.21 NC1=C(O)C=C(C(=O)O)C=N1 L19943 [0,2,0,0,0,0|2,0,0]=4 814 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 A-871 [0,2,0,0,0,0|1,0,0]=3 815 B11R1.21 NC1=C(S)C=CC(C(=O)O)=C1 H-8774 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.21 NC1=CC(C(=O)O)=CC=C1S K16116 [0,2,0,0,0,0|1,0,0]=3 817 B11R1.21 NC1=CC(C(=O)O)=NC=C1Br L13873 [0,2,0,0,0,0|2,0,0]=4 818 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1S K12275 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 C-3764 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.21 O=C(O)C1=CC(F)=C(Cl)N=C1 O31712 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 P37038 [0,2,0,0,0,0|1,0,0]=3 822 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 K13440 [0,2,0,0,0,0|1,0,0]=3 823 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 L13055 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 O31936 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 O33279 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 L18290 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 F-4046 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.21 O=C(O)C1=NC(O)=C(F)C=C1 Q60811 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 Q65591 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.21 O=C(O)C1=NC=C(Cl)C(Cl)=C1 Q60752 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 P45931 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.21 O=[N+]([O-])C1=CC=C(Br)C(O)=C1 O31196 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.22 C#CC(=O)C1=CC=C(Cl)C=C1 P39524 [0,2,0,0,0,0|0,0,1]=3 834 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [0,2,0,0,0,0|1,0,1]=4 835 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [0,2,0,0,0,0|1,0,1]=4 836 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [0,2,0,0,0,0|1,0,1]=4 837 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [0,2,0,0,0,0|1,0,1]=4 838 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [0,2,0,0,0,0|1,0,1]=4 839 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [0,2,0,0,0,0|1,0,1]=4 840 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 P40808 [0,2,0,0,0,0|0,0,1]=3 841 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [0,2,0,0,0,0|0,0,0]=2 842 B11R1.22 CC1=CC=C(C(=O)NN)C=N1 P40085 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,2,0,0,0,0|1,0,1]=4 844 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,2,0,0,0,0|0,0,2]=4 845 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,2,0,0,0,0|1,0,1]=4 846 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,2,0,0,0,0|1,0,1]=4 847 B11R1.22 CC1=NC=C(C(=O)CBr)C=C1 Q52597 [0,2,0,0,0,0|1,0,0]=3 848 B11R1.22 CCC(=O)C1=NC=C(C)C=N1 O29473 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [0,2,0,0,0,0|1,0,1]=4 850 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [0,2,0,0,0,0|1,0,1]=4 851 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [0,2,0,0,0,0|1,0,1]=4 852 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,2,0,0,0,0|0,0,2]=4 853 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.22 CNC(=O)C1=CC=C(Br)N=C1 P35629 [0,2,0,0,0,0|1,0,0]=3 855 B11R1.22 CNC(=O)C1=CC=C(N)N=C1 S72671 [0,2,0,0,0,0|1,0,0]=3 856 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 P50985 [0,2,0,0,0,0|1,0,0]=3 857 B11R1.22 CNC(=O)C1=NC=C(O)C=C1 O30530 [0,2,0,0,0,0|1,0,0]=3 858 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 C-3212 [0,2,0,0,0,0|1,0,0]=3 859 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 C-3291 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.22 COC(=O)C1=CC=C(N)C=N1 C-2286 [0,2,0,0,0,0|1,0,0]=3 861 B11R1.22 COC(=O)C1=CC=C(O)N=N1 C-2379 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.22 COC(=O)C1=CC=C(S)N=C1 H-8392 [0,2,0,0,0,0|1,0,0]=3 863 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 Q64835 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.22 COC(=O)C1=CN=C(C)N=C1 L13555 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 C-2772 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.22 COC(=O)C1=CN=C(F)C=C1 Q66489 [0,2,0,0,0,0|1,0,0]=3 867 B11R1.22 COC(=O)C1=CN=C(N)C=N1 C-3306 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.22 COC(=O)C1=CN=C(O)C=C1 G-5577 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 O30862 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.22 COC(=O)C1=NC=C(C)C=N1 G-5731 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 G-5538 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.22 COC(=O)C1=NC=C(F)C=C1 Q54927 [0,2,0,0,0,0|1,0,0]=3 873 B11R1.22 COC(=O)C1=NC=C(F)C=N1 O34307 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.22 COC(=O)C1=NC=C(N)C=N1 C-2775 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.22 COC(=O)C1=NC=C(N)C=N1 G-5008 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.22 COC(=O)C1=NC=C(N)N=C1 O31116 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.22 COC(=O)C1=NC=C(O)C=C1 G-5601 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.22 COC(=O)C1=NC=C(O)C=N1 Q55461 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.22 COC(=O)C1=NN=C(N)C=C1 G-5477 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,2,0,0,0,0|1,0,1]=4 881 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,2,0,0,0,0|1,0,1]=4 882 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,2,0,0,0,0|1,0,1]=4 883 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [0,2,0,0,0,0|0,0,0]=2 884 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,2,0,0,0,0|0,0,2]=4 885 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,2,0,0,0,0|0,0,2]=4 886 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,2,0,0,0,0|0,0,2]=4 887 B11R1.22 NNC(=O)C1=CC=[N+]([O-])C=C1 L19826 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,2,0,0,0,0|1,0,1]=4 889 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,2,0,0,0,0|1,0,1]=4 890 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,2,0,0,0,0|1,0,1]=4 891 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,2,0,0,0,0|1,0,1]=4 892 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,2,0,0,0,0|1,0,1]=4 893 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,2,0,0,0,0|1,0,1]=4 894 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 O31201 [0,2,0,0,0,0|0,0,0]=2 895 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 P35986 [0,2,0,0,0,0|0,0,1]=3 896 B11R1.166 C=C(C)C1=CN=C(Cl)C=C1Cl O32627 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.166 CC(=O)C1=C(C)C=C(C)N=C1 O31353 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.166 CC(=O)C1=CC=C(C)C=C1Br P42929 [0,2,0,0,0,0|0,0,0]=2 899 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl O30258 [0,2,0,0,0,0|1,0,0]=3 900 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1N Q69764 [0,2,0,0,0,0|1,0,0]=3 901 B11R1.166 CC(=O)C1=CC=C(N)C=C1Cl O32522 [0,2,0,0,0,0|0,0,0]=2 902 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl Q62398 [0,2,0,0,0,0|1,0,0]=3 903 B11R1.166 CC(=O)C1=CN=C(Cl)N=C1Cl G-7473 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C O31315 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.166 CC(=O)C1=NC=C(Br)C=C1Cl O31321 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Br O30236 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1C O29675 [0,2,0,0,0,0|1,0,0]=3 908 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1F O30130 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.166 CC(=O)C1=NC=C(F)C=C1Br O31291 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.166 CC(=O)C1=NC=C(F)C=C1Cl O29749 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.166 CC(=O)C1=NC=C(F)C=C1F O32686 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.166 CC(C)C1=C(I)C=C(Cl)C=C1 N26662 [0,2,0,0,0,0|1,0,1]=4 913 B11R1.166 CC(C)C1=CC=C(Cl)C=C1N Q68189 [0,2,0,0,0,0|1,0,1]=4 914 B11R1.166 CC(N)C1=CC=C(F)C=C1F P37148 [0,2,0,0,0,0|1,0,1]=4 915 B11R1.166 CC1=CC(=O)NC=C1C(=O)O Q57090 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.166 CC1=CC(Br)=CN=C1C(=O)Cl N24228 [0,2,0,0,0,0|2,0,0]=4 917 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O N25137 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.166 CC1=CC(Br)=NC=C1C(=O)O N26124 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O N25656 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 Q60789 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.166 CC1=CC(F)=NC=C1C(=O)O Q67322 [0,2,0,0,0,0|2,0,0]=4 922 B11R1.166 CC1=CC(O)=CN=C1C(=O)O Q60879 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 L13612 [0,2,0,0,0,0|2,0,0]=4 924 B11R1.166 CC1=CC=C(C(C)N)C(C)=C1 P42949 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=C1 Q67791 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 O31836 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 O31096 [0,2,0,0,0,0|2,0,0]=4 928 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 I-9719 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 O31639 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.166 CC1=NC(Br)=CC=C1C(=O)O N26103 [0,2,0,0,0,0|2,0,0]=4 931 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 P51309 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 Q60943 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.166 CC1=NC(Cl)=CC=C1C(=O)O N25033 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.166 CC1=NC(F)=C(C(=O)O)C=C1 N24616 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.166 CC1=NC(F)=CC=C1C(=O)O Q67993 [0,2,0,0,0,0|2,0,0]=4 936 B11R1.166 CC1=NC(O)=CC=C1C(=O)O Q52564 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 M15159 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 N26369 [0,2,0,0,0,0|2,0,0]=4 939 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl O30415 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.166 NC(=O)C1=C(Cl)C=C(Cl)N=C1 H-8999 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.166 NC(=O)C1=C(F)C=C(Br)C=C1 N24181 [0,2,0,0,0,0|1,0,0]=3 942 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 F-4223 [0,2,0,0,0,0|1,0,0]=3 943 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 O32779 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl Q68006 [0,2,0,0,0,0|1,0,0]=3 945 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Br Q68008 [0,2,0,0,0,0|1,0,0]=3 946 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl Q67952 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.166 NC(=O)C1=CC=C(O)C=C1F O30471 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.166 NC(=O)C1=NC=C(Br)C=C1F O31169 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N C-3698 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1F O30034 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O C-2276 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6102 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O G-6103 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O I-9422 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.166 NC1=CC(F)=C(C(=O)O)N=C1 Q55031 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.166 NC1=CC(F)=CN=C1C(=O)O O33092 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.166 NC1=CC(F)=NC=C1C(=O)O G-7587 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.166 NC1=CC(I)=CC=C1C(=O)O O32287 [0,2,0,0,0,0|1,0,0]=3 959 B11R1.166 NC1=CC=C(C(=O)O)C(Br)=N1 Q64646 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.166 NC1=NC(Cl)=CC=C1C(=O)O C-2357 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.166 NC1=NC(O)=CC=C1C(=O)O L19692 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Q67951 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 F-4417 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=N1 Q60904 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 G-6764 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=N1 Q60786 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br P37092 [0,2,0,0,0,0|1,0,0]=3 968 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br Q51864 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl N26004 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1F O30248 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.166 O=C(O)C1=CC=C(F)C=C1O M22934 [0,2,0,0,0,0|1,0,0]=3 972 B11R1.166 O=C(O)C1=CC=C(I)C=C1F P43484 [0,2,0,0,0,0|1,0,0]=3 973 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl Q66502 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl O32638 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.166 O=C(O)C1=CN=C(Br)C=C1I Q52323 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1I N27822 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl Q68112 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F G-7561 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br Q67790 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F O30677 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl O31562 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.166 O=C(O)C1=NC=C(O)C=C1F O29407 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.166 O=[N+]([O-])C1=CC=C(O)C=C1Br P50972 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.7 CC(C)(CN)C1=CC=CC=C1 P39760 [0,2,0,0,0,0|1,0,1]=4 985 B11R1.7 CC(N)(CO)C1=CC=CC=C1 P35233 [0,2,0,0,0,0|0,0,2]=4 986 B11R1.7 CNS(=O)(=O)C1=CC=CN=C1 Q52495 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 M15334 [0,2,0,0,0,0|1,0,0]=3 988 B11R1.16 CC(CCN)C1=CC=CC=C1 P38414 [0,2,0,0,0,0|1,0,1]=4 989 B11R1.16 CCCC(=O)C1=CC=CN=C1 P40625 [0,2,0,0,0,0|1,0,0]=3 990 B11R1.16 CCCC(N)C1=CC=CC=C1 P39016 [0,2,0,0,0,0|1,0,1]=4 991 B11R1.16 CCOC(=N)C1=CC=NC=C1 O30241 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.16 CNCC(C)C1=CC=CC=C1 P37180 [0,2,0,0,0,0|1,0,1]=4 993 B11R1.16 COCC(N)C1=CC=CC=C1 P40515 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 P35167 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.16 COC[C@H](N)C1=CC=CC=C1 P36845 [0,2,0,0,0,0|1,0,1]=4 996 B11R1.16 CONC(=O)C1=CC=CC=C1 Q65648 [0,2,0,0,0,0|0,0,0]=2 997 B11R1.16 N#CCC(=O)C1=CC=CN=C1 P38931 [0,2,0,0,0,0|1,0,0]=3 998 B11R1.16 N#CCC(=O)C1=CC=NC=C1 P39466 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.16 N#CCC(=O)C1=NC=CC=C1 M15816 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.16 NCCC(O)C1=CC=CC=C1 P37784 [0,2,0,0,0,0|0,0,2]=4 1001 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 P35908 [0,2,0,0,0,0|1,0,1]=4 1002 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 P40616 [0,2,0,0,0,0|1,0,1]=4 1003 B11R1.23 C#CC(=O)C1=CC=CC(Cl)=C1 P38720 [0,2,0,0,0,0|0,0,1]=3 1004 B11R1.23 CC1=CC(C(=O)CBr)=CC=C1 O28559 [0,2,0,0,0,0|0,0,0]=2 1005 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,2,0,0,0,0|1,0,1]=4 1006 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,2,0,0,0,0|0,0,2]=4 1007 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,2,0,0,0,0|1,0,1]=4 1008 B11R1.23 CC1=CC=CC(C(=O)NN)=N1 S72497 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.23 CC1=CN=CC(C(=O)NN)=C1 O30082 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.23 CCC(N)C1=CC=CC(Cl)=C1 P38298 [0,2,0,0,0,0|1,0,1]=4 1011 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,2,0,0,0,0|0,0,2]=4 1012 B11R1.23 COC(=O)C1=CC(C)=CN=C1 Q66697 [0,2,0,0,0,0|1,0,0]=3 1013 B11R1.23 COC(=O)C1=CC(C)=CN=N1 L22161 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 G-7304 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.23 COC(=O)C1=CC(F)=CN=C1 C-2951 [0,2,0,0,0,0|1,0,0]=3 1016 B11R1.23 COC(=O)C1=CC(N)=NC=N1 I-9515 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.23 COC(=O)C1=CC(O)=CN=C1 P45785 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 Q66806 [0,2,0,0,0,0|0,0,0]=2 1019 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 C-3476 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 G-5883 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.23 COC(=O)C1=NC(F)=CC=C1 Q68381 [0,2,0,0,0,0|1,0,0]=3 1022 B11R1.23 COC(=O)C1=NC(O)=NC=C1 S72664 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 E-3030 [0,2,0,0,0,0|1,0,0]=3 1024 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M15778 [0,2,0,0,0,0|1,0,0]=3 1025 B11R1.23 COC(=O)C1=NC=CC(C)=N1 L14173 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.23 COC(=O)C1=NC=CC(F)=C1 L22462 [0,2,0,0,0,0|1,0,0]=3 1027 B11R1.23 COC(=O)C1=NC=CC(N)=C1 G-6744 [0,2,0,0,0,0|1,0,0]=3 1028 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M23610 [0,2,0,0,0,0|1,0,0]=3 1029 B11R1.23 COC(=O)C1=NC=NC(C)=C1 P44278 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 L14015 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,2,0,0,0,0|1,0,1]=4 1032 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,2,0,0,0,0|1,0,1]=4 1034 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,2,0,0,0,0|0,0,0]=2 1035 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,2,0,0,0,0|0,0,0]=2 1036 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,2,0,0,0,0|0,0,0]=2 1037 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,2,0,0,0,0|0,0,0]=2 1038 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,2,0,0,0,0|0,0,2]=4 1039 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,2,0,0,0,0|0,0,2]=4 1040 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,2,0,0,0,0|0,0,2]=4 1041 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,2,0,0,0,0|0,0,2]=4 1042 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 C-3315 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,2,0,0,0,0|1,0,1]=4 1044 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,2,0,0,0,0|1,0,1]=4 1045 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,2,0,0,0,0|1,0,1]=4 1046 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,2,0,0,0,0|1,0,1]=4 1047 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,2,0,0,0,0|1,0,1]=4 1048 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,2,0,0,0,0|1,0,1]=4 1049 B11R1.23 O=C(CBr)C1=NC=CC(Cl)=C1 O30189 [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.23 O=C(CCl)C1=NC=CC(Cl)=C1 O29576 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.222 C#CC(=O)C1=CC=CC=C1Cl M23022 [0,2,0,0,0,0|0,0,1]=3 1052 B11R1.222 CC1=CC=CC=C1C(=O)CBr O28087 [0,2,0,0,0,0|0,0,0]=2 1053 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,2,0,0,0,0|1,0,1]=4 1054 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,2,0,0,0,0|0,0,2]=4 1055 B11R1.222 CC1=CC=CN=C1C(=O)CCl O30165 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.222 CCC(N)C1=CC=CC=C1C P37948 [0,2,0,0,0,0|1,0,1]=4 1057 B11R1.222 CCC(N)C1=CC=CC=C1Cl Q66027 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.222 CNC(=O)C1=CC=CC=C1Br P37075 [0,2,0,0,0,0|0,0,0]=2 1059 B11R1.222 CNC(=O)C1=CC=CC=C1C O32523 [0,2,0,0,0,0|0,0,0]=2 1060 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 N25636 [0,2,0,0,0,0|1,0,0]=3 1061 B11R1.222 COC(=O)C1=C(Br)N=CN=C1 H-8377 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.222 COC(=O)C1=C(C)C=NC=C1 G-7865 [0,2,0,0,0,0|1,0,0]=3 1063 B11R1.222 COC(=O)C1=C(C)C=NN=C1 G-7306 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.222 COC(=O)C1=C(C)N=CC=C1 I-9174 [0,2,0,0,0,0|1,0,0]=3 1065 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 N25043 [0,2,0,0,0,0|1,0,0]=3 1066 B11R1.222 COC(=O)C1=C(F)C=NC=C1 G-7746 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.222 COC(=O)C1=C(F)N=CC=C1 Q66492 [0,2,0,0,0,0|1,0,0]=3 1068 B11R1.222 COC(=O)C1=C(I)C=NC=C1 G-6795 [0,2,0,0,0,0|1,0,0]=3 1069 B11R1.222 COC(=O)C1=C(N)C=NC=N1 Q65333 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.222 COC(=O)C1=C(O)C=NC=C1 O30771 [0,2,0,0,0,0|1,0,0]=3 1071 B11R1.222 COC(=O)C1=CC=CN=C1Br Q67675 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.222 COC(=O)C1=CC=CN=C1I O30553 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.222 COC(=O)C1=CC=NC=C1N C-3596 [0,2,0,0,0,0|1,0,0]=3 1074 B11R1.222 COC(=O)C1=CC=NNC1=O L14296 [0,2,0,0,0,0|2,0,0]=4 1075 B11R1.222 COC(=O)C1=CN=CN=C1Cl H-8381 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.222 COC(=O)C1=NC=CC=C1Cl Q68224 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.222 COC(=O)C1=NC=CC=C1F Q68214 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.222 COC(=O)C1=NC=CN=C1Br Q51827 [0,2,0,0,0,0|2,0,0]=4 1079 B11R1.222 COC(=O)C1=NC=CN=C1Cl C-3373 [0,2,0,0,0,0|2,0,0]=4 1080 B11R1.222 COC(=O)C1=NC=CN=C1F L18388 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,2,0,0,0,0|1,0,1]=4 1084 B11R1.222 NCC(=O)C1=CC=CC=C1Br P35565 [0,2,0,0,0,0|0,0,0]=2 1085 B11R1.222 NCC(=O)C1=CC=CC=C1Cl P40753 [0,2,0,0,0,0|0,0,0]=2 1086 B11R1.222 NCC(=O)C1=CC=CC=C1O P37785 [0,2,0,0,0,0|0,0,0]=2 1087 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,2,0,0,0,0|0,0,2]=4 1088 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,2,0,0,0,0|0,0,2]=4 1089 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,2,0,0,0,0|0,0,2]=4 1090 B11R1.222 NNC(=O)C1=CC=CN=C1N O30046 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,2,0,0,0,0|1,0,1]=4 1092 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.222 O=C(CBr)C1=CC=CC=C1Br P37875 [0,2,0,0,0,0|0,0,0]=2 1094 B11R1.222 O=C(CCl)C1=NC=CC=C1F O32003 [0,2,0,0,0,0|1,0,0]=3 1095 B11R1.222 O=C(CF)C1=CC=CC=C1F P51651 [0,2,0,0,0,0|0,0,0]=2 1096 B11R1.87 CC(C)(C)C1=CC=CC=C1F Q69360 [0,2,0,0,0,0|1,0,1]=4 1097 B11R1.87 CC(C)(N)C1=CC=CC=C1Br P40555 [0,2,0,0,0,0|1,0,1]=4 1098 B11R1.87 CC(C)(N)C1=CC=CC=C1Cl P37789 [0,2,0,0,0,0|1,0,1]=4 1099 B11R1.87 CC(C)(N)C1=CC=CC=C1F P36303 [0,2,0,0,0,0|1,0,1]=4 1100 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 D-2711 [0,2,0,0,0,0|0,0,2]=4 1101 B11R1.87 CC(C)(O)C1=CC=CC=C1I Q69151 [0,2,0,0,0,0|0,0,2]=4 1102 B11R1.87 CC1=CC=CC=C1C(C)(C)N P38926 [0,2,0,0,0,0|1,0,1]=4 1103 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Br P51334 [0,2,0,0,0,0|1,0,0]=3 1104 B11R1.87 CS(=O)(=O)C1=CC=CN=C1Cl G-5534 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.87 CS(=O)(=O)C1=CC=CN=C1F N24500 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.87 CS(=O)(=O)C1=CC=NC=C1N Q58284 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.87 CS(=O)(=O)C1=CC=NC=C1N Q58285 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.155 CC(C)(N)C1=CC=CC(Br)=C1 O32516 [0,2,0,0,0,0|1,0,1]=4 1109 B11R1.155 CC(C)(N)C1=CC=CC(Cl)=C1 P40456 [0,2,0,0,0,0|1,0,1]=4 1110 B11R1.155 CC(C)(N)C1=CC=CC(F)=C1 P36302 [0,2,0,0,0,0|1,0,1]=4 1111 B11R1.155 CC1=CC(C(C)(C)N)=CC=C1 P38927 [0,2,0,0,0,0|1,0,1]=4 1112 B11R1.155 CS(=O)(=O)C1=CN=CC(Br)=C1 O30451 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.155 CS(=O)(=O)C1=NC=CC(Br)=C1 Q62499 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.155 CS(=O)(=O)C1=NC=CC(N)=C1 S72746 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.53 C#CC1=CC=CC=C1C(=O)O O28760 [0,2,0,0,0,0|1,0,0]=3 1116 B11R1.53 C#CC1=CC=CC=C1C(C)=O O29479 [0,2,0,0,0,0|0,0,0]=2 1117 B11R1.53 C#CC1=CC=CC=C1C(N)=O O29403 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.53 C#CC1=CC=CC=C1[N+](=O)[O-] O27867 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.53 CC(C)C1=CC=CC=C1CBr I-9078 [0,2,0,0,0,0|1,0,1]=4 1120 B11R1.53 CCC1=CN=CC=C1C(=O)O Q60755 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.53 CN(C)C1=CC=CC=C1C=O Q68631 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.53 COC1=C(C(C)=O)C=NC=C1 O33511 [0,2,0,0,0,0|1,0,0]=3 1123 B11R1.53 COC1=C(C(C)=O)N=CC=C1 Q62300 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.53 COC1=CC=CC=C1C(C)N P38299 [0,2,0,0,0,0|1,0,1]=4 1125 B11R1.53 COC1=CC=CC=C1C(N)=O P39422 [0,2,0,0,0,0|1,0,0]=3 1126 B11R1.53 COC1=CC=CN=C1C(=O)O O31773 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.53 COC1=NC=CC=C1C(C)=O P41710 [0,2,0,0,0,0|1,0,0]=3 1128 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 Q60785 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.53 N#CC1=CC=CN=C1C(=O)O G-7848 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.53 N#CC1=CC=NC=C1C(=O)O G-7849 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.53 N#CC1=CN=CC=C1C(=O)O Q60903 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.53 NCC1=CC=CC=C1C(=O)O O28742 [0,2,0,0,0,0|1,0,0]=3 1133 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] P39381 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.53 O=C(O)C1=CC=CC=C1CO O34075 [0,2,0,0,0,0|1,0,0]=3 1135 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 P44466 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.53 O=CC1=C(C(=O)O)N=CC=C1 Q60211 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.53 O=CC1=CN=CC=C1C(=O)O Q60210 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.53 O=CC1=NC=CC=C1C(=O)O Q60213 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl Q68333 [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.156 CC(=O)C1=C(Cl)N=CN=C1Cl L18393 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.156 CC(=O)C1=C(I)C=CN=C1F N27716 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.156 CC1=C(C(=O)O)C(Br)=CN=C1 Q64763 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 I-9230 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=N1 Q60700 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.156 CC1=C(C(=O)O)C(Cl)=NC=C1 Q52933 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.156 CC1=C(C(=O)O)C(F)=CN=C1 Q60648 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.156 CC1=C(C(=O)O)C(F)=NC=C1 N26390 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.156 CC1=CN=CC(C)=C1C(=O)O Q60782 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.156 CC1=CN=CC(N)=C1C(=O)O Q63314 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.156 CC1=NC=CC(C)=C1C(=O)O G-7850 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.156 NC(=O)C1=C(Cl)C=NC=C1Cl O29200 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.156 NC(=O)C1=C(F)C=CN=C1Cl Q62283 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 L14459 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.156 NC1=C([N+](=O)[O-])C(F)=CC=C1 E-3042 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.156 NC1=CC=CC(Br)=C1[N+](=O)[O-] E-3034 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.156 NC1=CC=CC(I)=C1C(=O)O O32252 [0,2,0,0,0,0|1,0,0]=3 1157 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Br Q67512 [0,2,0,0,0,0|1,0,0]=3 1158 B11R1.156 O=C(Cl)C1=C(Cl)C=NC=C1Cl O29012 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br Q67183 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F C-3485 [0,2,0,0,0,0|1,0,0]=3 1161 B11R1.156 O=C(O)C1=C(Br)C=CN=C1F O30907 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.156 O=C(O)C1=C(Br)C=NC=C1Br Q66331 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F N24768 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O Q66580 [0,2,0,0,0,0|1,0,0]=3 1165 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1O Q60761 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Br N27720 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Cl Q67313 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1F Q57224 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1Br Q67320 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F O30790 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1I P43249 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.156 O=C(O)C1=C(F)C=CN=C1Br O29983 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.156 O=C(O)C1=C(F)N=CC=C1I A-622 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.156 O=C(O)C1=C(I)C=NC=C1Br N26737 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1F O30650 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 N26896 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 M23816 [0,2,0,0,0,0|0,0,0]=2 1178 B11R1.159 CC(O)C1=CC=CC(Cl)=C1Cl P37496 [0,2,0,0,0,0|0,0,2]=4 1179 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O P49354 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.159 CC1=C(C(=O)O)C=CN=C1F N26427 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.159 CC1=C(C(=O)O)C=NC=C1Br N25194 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.159 CC1=C(C(=O)O)C=NC=C1Cl Q60529 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.159 CC1=C(C(=O)O)C=NC=C1F Q60749 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br N24536 [0,2,0,0,0,0|1,0,0]=3 1185 B11R1.159 CC1=C(C(N)=O)C=NC=C1Br N25587 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.159 CC1=C(C)C(C(=O)O)=CC=N1 Q60787 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 Q67898 [0,2,0,0,0,0|1,0,0]=3 1188 B11R1.159 CC1=C(N)C(C(C)C)=CC=C1 F-4250 [0,2,0,0,0,0|1,0,1]=4 1189 B11R1.159 CC1=C(N)C(C(N)=O)=CC=C1 O30695 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.159 CC1=NC=CC(C(=O)O)=C1N Q64766 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.159 CN1C=CC=C(C(=O)O)C1=O G-7544 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=NC=C1 N25264 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 O31275 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.159 NC(=O)C1=CC=CC(N)=C1N G-7463 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O L14675 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl O31474 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 P35150 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.159 NC1=C(I)C=CC=C1C(=O)O O32276 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.159 NC1=NC=CC(C(=O)O)=C1N Q58195 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 O29217 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CN=C1 N26393 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 Q66969 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.159 O=C(O)C1=C(Cl)C(F)=CN=C1 N26255 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.159 O=C(O)C1=C(Cl)C(F)=NC=C1 Q66538 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 E-3012 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 N24320 [0,2,0,0,0,0|1,0,0]=3 1207 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O P51774 [0,2,0,0,0,0|1,0,0]=3 1208 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O Q66616 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.159 O=C(O)C1=CC=CC(I)=C1F Q67650 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.159 O=C(O)C1=CC=NC(F)=C1F F-4045 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl S72554 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.159 O=[N+]([O-])C1=C(Br)C(O)=CC=C1 O34477 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.159 O=[N+]([O-])C1=C(F)C(O)=CC=C1 H-8862 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br P40178 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 Q54706 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F G-7719 [0,2,0,0,0,0|1,0,0]=3 1217 B11R1.167 CC(=O)C1=CC(C)=CC=C1Br O29725 [0,2,0,0,0,0|0,0,0]=2 1218 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N26923 [0,2,0,0,0,0|1,0,0]=3 1219 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F P37541 [0,2,0,0,0,0|0,0,0]=2 1220 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1Br O31310 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.167 CC(=O)C1=CC(O)=CC=C1C N26381 [0,2,0,0,0,0|0,0,0]=2 1222 B11R1.167 CC(=O)C1=NC(Cl)=CN=C1N O32037 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.167 CC(C)C1=C(Cl)C=CC(Br)=C1 N25225 [0,2,0,0,0,0|1,0,1]=4 1224 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N24267 [0,2,0,0,0,0|1,0,1]=4 1225 B11R1.167 CC(C)C1=CC(Br)=CC=C1I Q67805 [0,2,0,0,0,0|1,0,1]=4 1226 B11R1.167 CC(C)C1=CC(Br)=CC=C1O Q67880 [0,2,0,0,0,0|1,0,1]=4 1227 B11R1.167 CC(C)C1=CC(O)=CC=C1Br N25884 [0,2,0,0,0,0|1,0,1]=4 1228 B11R1.167 CC(O)C1=CC(Br)=CC=C1F Q66925 [0,2,0,0,0,0|0,0,2]=4 1229 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 P43289 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 L18299 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 P44204 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 Q60931 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 Q60684 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 Q60686 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 Q51924 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.167 CC1=CC=C(F)C(C(=O)O)=N1 O30076 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.167 CC1=CC=C(I)C=C1C(=O)O P43248 [0,2,0,0,0,0|1,0,0]=3 1238 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 L22360 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.167 CC1=CC=C(N)C=C1C(=O)O P43309 [0,2,0,0,0,0|1,0,0]=3 1240 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 N24563 [0,2,0,0,0,0|2,0,0]=4 1241 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 N25261 [0,2,0,0,0,0|2,0,0]=4 1242 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 L18300 [0,2,0,0,0,0|2,0,0]=4 1243 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 Q60885 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 G-5635 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.167 CC1=NC=C(N)C=C1C(=O)O Q58346 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.167 NC(=O)C1=C(F)C=NC(Br)=C1 Q62405 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Br N26093 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Q67299 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F N24843 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl N25426 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N O31569 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.167 NC(=O)C1=CC(F)=CC=C1Br P43107 [0,2,0,0,0,0|1,0,0]=3 1253 B11R1.167 NC(=O)C1=NC(Br)=CC=C1F Q62404 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.167 NC1=C(C(=O)O)C=C(Cl)N=C1 C-3440 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 L22147 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 G-6804 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O O34588 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O G-5404 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O O34386 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.167 NC1=NC=C(F)C=C1C(=O)O L18306 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1F Q67078 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl N25174 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1F N27324 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.167 O=C(Cl)C1=CC(Cl)=NC=C1Cl N27773 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 Q66324 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 Q67587 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 Q67957 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl C-3392 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O C-3696 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br Q67187 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl L22357 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F K12095 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F E-3037 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl E-3057 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br O31572 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C-3699 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.167 O=C(O)C1=CC(F)=CN=C1F Q62473 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.167 O=C(O)C1=CC(F)=NC=C1Br N26408 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.167 O=C(O)C1=CC(F)=NC=C1F H-8387 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br G-7754 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F P44595 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl Q60687 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.167 O=[N+]([O-])C1=C(S)C=CC(Br)=C1 H-8777 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 P43442 [0,2,0,0,0,0|0,0,0]=2 1285 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 N24889 [0,2,0,0,0,0|0,0,0]=2 1286 B11R1.74 CC(=O)C1=CC(Cl)=NC(Cl)=C1 O31877 [0,2,0,0,0,0|1,0,0]=3 1287 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 O30551 [0,2,0,0,0,0|0,0,0]=2 1288 B11R1.74 CC(=O)C1=NC(C)=CC(Cl)=C1 Q53148 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.74 CC(C)C1=CC(Br)=CC(Br)=C1 P43231 [0,2,0,0,0,0|1,0,1]=4 1290 B11R1.74 CC(C)C1=CC(Br)=CC(I)=C1 N27290 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.74 CC(C)C1=CC(Cl)=CC(Cl)=C1 N26874 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.74 CC(C)C1=CC(O)=CC(Br)=C1 N25795 [0,2,0,0,0,0|1,0,1]=4 1293 B11R1.74 CC(O)C1=CC(Cl)=CC(Cl)=C1 P40306 [0,2,0,0,0,0|0,0,2]=4 1294 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 P37229 [0,2,0,0,0,0|1,0,0]=3 1295 B11R1.74 CC1=CC(Br)=CC(C(C)N)=C1 P43562 [0,2,0,0,0,0|1,0,1]=4 1296 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 O31676 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 G-6688 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 O31886 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.74 CC1=CC(C(=O)O)=NC(O)=C1 Q60690 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.74 CC1=CC(C)=NC(C(=O)O)=C1 Q60526 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 O32304 [0,2,0,0,0,0|1,0,0]=3 1302 B11R1.74 CN(C)C1=CC(F)=CC(Br)=C1 N24299 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.74 CN(C)C1=CC(F)=CC(I)=C1 N26585 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.74 CN(C)C1=CC(F)=CC(O)=C1 N27265 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 O30715 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 Q67696 [0,2,0,0,0,0|1,0,0]=3 1307 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 Q67950 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.74 NC1=CC(C(=O)O)=NC(Br)=C1 Q53661 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 Q67948 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.74 O=C(Cl)C1=CC(F)=CC(Br)=C1 O29004 [0,2,0,0,0,0|1,0,0]=3 1311 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 G-6615 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 Q67862 [0,2,0,0,0,0|1,0,0]=3 1313 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 Q62337 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 O30874 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.74 O=C(O)C1=NC(F)=CC(Cl)=C1 Q62427 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.74 O=C(O)C1=NC(F)=CC(F)=C1 Q62424 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.74 O=C([O-])C1=NC(F)=CC(F)=C1 O33117 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 O30417 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(O)=C1 O32687 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 O28043 [0,2,0,0,0,0|1,0,0]=3 1321 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 O28811 [0,2,0,0,0,0|0,0,0]=2 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|2,0,0]=4 1324 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 P39070 [0,2,0,0,0,0|1,0,0]=3 1325 B11R1.266 CC(C)C1=CC(C=O)=CC=C1 Q68460 [0,2,0,0,0,0|1,0,1]=4 1326 B11R1.266 CC(C)C1=CC(CBr)=CC=C1 I-9079 [0,2,0,0,0,0|1,0,1]=4 1327 B11R1.266 CC(C)C1=CC(CO)=CC=C1 Q68461 [0,2,0,0,0,0|1,0,1]=4 1328 B11R1.266 CCC1=CC(C(=O)O)=CC=C1 P37036 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.266 CCC1=CC(C(=O)O)=NC=C1 Q60534 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 Q60685 [0,2,0,0,0,0|2,0,0]=4 1331 B11R1.266 CNC1=CC(C(=O)O)=CC=C1 P37710 [0,2,0,0,0,0|1,0,0]=3 1332 B11R1.266 COC1=CC(C(=O)O)=CN=C1 Q67568 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.266 COC1=CC(C(C)=O)=NC=C1 O30173 [0,2,0,0,0,0|1,0,0]=3 1334 B11R1.266 COC1=CC=CC(C(=O)O)=N1 P39197 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.266 COC1=CC=CC(C(C)C)=C1 N26938 [0,2,0,0,0,0|1,0,1]=4 1336 B11R1.266 COC1=NC=CC(C(C)=O)=C1 O30294 [0,2,0,0,0,0|1,0,0]=3 1337 B11R1.266 CSC1=CN=CC(C(=O)O)=C1 N26072 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.266 N#CC1=CC(C(=O)O)=NC=C1 O31274 [0,2,0,0,0,0|2,0,0]=4 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|1,0,0]=3 1343 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 O28911 [0,2,0,0,0,0|1,0,0]=3 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|2,0,0]=4 1347 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 Q60757 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.266 O=C(O)C1=CC=CC(CS)=C1 P39077 [0,2,0,0,0,0|1,0,0]=3 1349 B11R1.266 O=CC1=NC(C(=O)O)=CC=C1 Q62315 [0,2,0,0,0,0|2,0,0]=4 1350 B11R2.4 NC1CC1C2=CC=CC=C2 Q54793 [0,0,0,1,0,1|1,0,1]=4 1351 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 L14213 [0,0,0,1,0,1|1,0,1]=4 1352 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 L22363 [0,0,0,1,0,1|1,0,1]=4 1353 B11R2.10 CC1=CC2=C(C=CN=C2)N1 L13043 [0,0,0,1,0,1|2,0,0]=4 1354 B11R2.10 CC1=CC2=C(C=NC=C2)N1 O33438 [0,0,0,1,0,1|2,0,0]=4 1355 B11R2.10 CC1=CC2=CC=CN=C2N1 C-3671 [0,0,0,1,0,1|2,0,0]=4 1356 B11R2.10 CC1=CC2=NC=CC=C2N1 O32885 [0,0,0,1,0,1|2,0,0]=4 1357 B11R2.10 CC1=NC2=C(C=CN=C2)O1 O34256 [0,0,0,1,0,1|1,0,1]=4 1358 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 L14886 [0,0,0,1,0,1|1,0,1]=4 1359 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 I-9534 [0,0,0,1,0,1|1,0,1]=4 1360 B11R2.10 ClC1=CC2=CC=CC=C2N1 D-2538 [0,0,0,1,0,1|1,0,1]=4 1361 B11R2.10 NC1=CC2=C(C=CC=C2)N1 O29924 [0,0,0,1,0,1|1,0,1]=4 1362 B11R2.10 NC1=NC2=CC=CC=C2S1 O30669 [0,0,0,1,0,1|1,1,0]=4 1363 B11R2.10 O=C1CC2=C(C=NC=C2)N1 L14128 [0,0,0,1,0,1|1,0,0]=3 1364 B11R2.10 O=C1CC2=CC=CN=C2N1 C-2476 [0,0,0,1,0,1|1,0,0]=3 1365 B11R2.10 O=C1CC2=CC=CN=C2N1 C-2476-01 [0,0,0,1,0,1|1,0,0]=3 1366 B11R2.10 O=C1CC2=CC=NC=C2N1 C-2345 [0,0,0,1,0,1|1,0,0]=3 1367 B11R2.10 O=C1CC2=CN=CC=C2N1 C-3239 [0,0,0,1,0,1|1,0,0]=3 1368 B11R2.10 O=C1CC2=CN=CN=C2N1 L13290 [0,0,0,1,0,1|2,0,0]=4 1369 B11R2.10 O=C1CC2=NC=CC=C2N1 C-2343 [0,0,0,1,0,1|1,0,0]=3 1370 B11R2.10 O=C1CN2C=CC=CC2=N1 O31095 [0,0,0,1,0,1|1,0,0]=3 1371 B11R2.10 O=C1NC2=C(C=NC=C2)N1 Q65490 [0,0,0,1,0,1|2,0,0]=4 1372 B11R2.10 O=C1NC2=CC=CN=C2N1 Q70155 [0,0,0,1,0,1|2,0,0]=4 1373 B11R2.238 C1=CC=C(NC2CC2)C=C1 M22854 [0,0,0,1,0,1|1,0,1]=4 1374 B11R2.34 BrC1=CC=C(C2CC2)C=C1 O30566 [0,1,0,1,0,0|1,0,1]=4 1375 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [0,1,0,1,0,0|0,0,2]=4 1376 B11R2.34 CC1=CC=C(C2CN2)C=C1 P36371 [0,1,0,1,0,0|1,0,1]=4 1377 B11R2.34 ClC1=CC=C(C2CN2)C=C1 P36104 [0,1,0,1,0,0|1,0,1]=4 1378 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [0,1,0,1,0,0|0,0,2]=4 1379 B11R2.34 NC1=CC=C(C2CC2)C=C1 P38877 [0,1,0,1,0,0|1,0,1]=4 1380 B11R2.34 OC1=CC=C(C2CC2)C=C1 P42947 [0,1,0,1,0,0|1,0,1]=4 1381 B11R2.1 BrC1=COC2=CC=CC=C12 O30635 [0,1,0,1,0,0|1,0,1]=4 1382 B11R2.1 BrC1=NNC2=CC=CC=C21 C-2069 [0,1,0,1,0,0|2,0,0]=4 1383 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,1,0,1,0,0|1,0,0]=3 1384 B11R2.1 CC1=CNC2=C1C=CN=C2 P44359 [0,1,0,1,0,0|2,0,0]=4 1385 B11R2.1 CC1=CNC2=C1C=NC=C2 L21593 [0,1,0,1,0,0|2,0,0]=4 1386 B11R2.1 CC1=CNC2=CC=CN=C12 O30970 [0,1,0,1,0,0|2,0,0]=4 1387 B11R2.1 CC1=CNC2=NC=CC=C12 G-5971 [0,1,0,1,0,0|2,0,0]=4 1388 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,1,0,1,0,0|1,0,0]=3 1389 B11R2.1 CC1=NNC2=C1C=NC=C2 L13764 [0,1,0,1,0,0|2,0,0]=4 1390 B11R2.1 CC1=NNC2=CC=CN=C21 C-3453 [0,1,0,1,0,0|2,0,0]=4 1391 B11R2.1 CC1=NNC2=CN=CC=C21 P44265 [0,1,0,1,0,0|2,0,0]=4 1392 B11R2.1 CC1=NNC2=NC=CC=C12 C-3338 [0,1,0,1,0,0|2,0,0]=4 1393 B11R2.1 CC1=NOC2=CC=CC=C21 O30125 [0,1,0,1,0,0|0,0,1]=3 1394 B11R2.1 ClC1=CNC2=C1C=CC=C2 L14683 [0,1,0,1,0,0|1,0,1]=4 1395 B11R2.1 IC1=NNC2=C1C=CC=C2 Q67919 [0,1,0,1,0,0|2,0,0]=4 1396 B11R2.1 NC1=CNC2=C1C=CC=C2 O32345 [0,1,0,1,0,0|1,0,1]=4 1397 B11R2.1 NC1=CNC2=C1C=CC=C2 O32346 [0,1,0,1,0,0|1,0,1]=4 1398 B11R2.1 NC1=CSC2=CC=CC=C12 O29978 [0,1,0,1,0,0|1,0,1]=4 1399 B11R2.1 NC1=NNC2=C1C=CC=C2 P35582 [0,1,0,1,0,0|2,0,0]=4 1400 B11R2.1 O=C1CCC2=C1C=CN=C2 L22316 [0,1,0,1,0,0|1,0,0]=3 1401 B11R2.1 O=C1CCC2=NC=CC=C12 G-6870 [0,1,0,1,0,0|1,0,0]=3 1402 B11R2.1 O=C1NCC2=C1C=CC=C2 I-9101 [0,1,0,1,0,0|0,0,0]=2 1403 B11R2.1 O=C1NCC2=C1CC=CC2 L18214 [0,1,0,1,0,0|0,0,2]=4 1404 B11R2.1 O=C1NCC2=CC=NC=C12 C-2838 [0,1,0,1,0,0|1,0,0]=3 1405 B11R2.1 O=C1SNC2=CC=CC=C12 L18705 [0,1,0,1,0,0|1,0,0]=3 1406 B11R2.1 OC1=CNC2=CC=CC=C12 Q52523 [0,1,0,1,0,0|0,0,2]=4 1407 B11R2.40 NC1(C2=CC=CC=C2)CC1 P38187 [0,1,0,1,0,0|1,0,1]=4 1408 B11R2.239 C1=CC=C(C2CCN2)C=C1 O28163 [0,1,0,1,0,0|1,0,1]=4 1409 B11R2.239 C1=CC=C(C2CNC2)C=C1 10749 [0,1,0,1,0,0|1,0,1]=4 1410 B11R2.239 C1=CC=C(C2CNC2)C=C1 M22666 [0,1,0,1,0,0|1,0,1]=4 1411 B11R2.55 BrC1=CC=CC=C1C2CO2 P36453 [0,1,0,1,0,0|0,0,2]=4 1412 B11R2.55 ClC1=CC=CC=C1C2CO2 P36976 [0,1,0,1,0,0|0,0,2]=4 1413 B11R2.55 FC1=CC=CC=C1C2CO2 Q66192 [0,1,0,1,0,0|0,0,2]=4 1414 B11R2.55 NC1=CC=CC=C1C2CC2 N24777 [0,1,0,1,0,0|1,0,1]=4 1415 B11R2.55 NC1=CC=CC=C1C2CC2 P51441 [0,1,0,1,0,0|1,0,1]=4 1416 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [0,1,0,1,0,0|0,0,2]=4 1417 B11R2.35 BrC1=CC=CC(C2CC2)=C1 O31879 [0,1,0,1,0,0|1,0,1]=4 1418 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [0,1,0,1,0,0|0,0,2]=4 1419 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [0,1,0,1,0,0|0,0,2]=4 1420 B11R2.35 OC1=CC=CC(C2CC2)=C1 O30101 [0,1,0,1,0,0|1,0,1]=4 1421 B7R1.1 C(=O)C1=CN=CS1 Q52103 [1,0,0,0,1,0|2,0,0]=4 1422 B7R1.1 CSC1=CC=CS1 Q67758 [1,0,0,0,1,0|2,0,0]=4 1423 B7R1.1 O=CC1=CN=CO1 I-9061 [1,0,0,0,1,0|2,0,0]=4 1424 B7R1.1 O=CC1=CNN=C1 C-2878 [1,0,0,0,1,0|2,0,0]=4 1425 B7R1.1 O=CC1=CNN=C1 G-5044 [1,0,0,0,1,0|2,0,0]=4 1426 B7R1.1 O=CC1=COC=N1 K12239 [1,0,0,0,1,0|2,0,0]=4 1427 B7R1.1 O=CC1=CSC=N1 Q68013 [1,0,0,0,1,0|2,0,0]=4 1428 B7R1.1 O=CC1=NNC=C1 O31194 [1,0,0,0,1,0|2,0,0]=4 1429 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P40366 [0,0,0,0,0,2|0,0,0]=2 1430 B11R1.91 CC(N)COC1=CC=CC=C1 P38614 [0,0,0,0,0,2|1,0,1]=4 1431 B11R1.91 NC(=O)COC1=CC=CC=C1 P51047 [0,0,0,0,0,2|1,0,0]=3 1432 B11R1.91 O=C(O)CCC1=CC=CN=C1 P38473 [0,0,0,0,0,2|2,0,0]=4 1433 B11R1.91 O=C(O)CCC1=CC=NC=C1 P36936 [0,0,0,0,0,2|2,0,0]=4 1434 B11R1.91 O=C(O)CCC1=NC=CC=C1 P41024 [0,0,0,0,0,2|2,0,0]=4 1435 B11R1.91 O=C(O)CNC1=NC=CC=C1 P37612 [0,0,0,0,0,2|2,0,0]=4 1436 B11R1.91 O=C(O)COC1=CC=CC=N1 P50811 [0,0,0,0,0,2|2,0,0]=4 1437 B11R1.91 O=C(O)COC1=CC=CC=N1 Q60650 [0,0,0,0,0,2|2,0,0]=4 1438 B11R1.91 O=C(O)COC1=CC=CN=C1 P35673 [0,0,0,0,0,2|2,0,0]=4