0 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.113 CC(=O)C1=CC(C)=NC=N1 M15580 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.113 CC(=O)C1=NC=CC(C)=N1 Q65344 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.113 CC(C)C1=CC(O)=NC=C1 Q52824 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.113 CC(C)C1=CN=CC(O)=C1 Q52825 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.113 CC(O)C1=CC(Cl)=NC=C1 P42079 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.113 CC1=CC(C(=O)O)=CN=N1 P49779 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.113 CC1=CC(C(=O)O)=NN=C1 L14505 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.113 CC1=CN=CC(C(=O)O)=N1 G-6898 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.113 CC1=NC(C(=O)O)=NC=C1 L14301 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.113 CC1=NC=CC(B(O)O)=C1 O30330 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.113 CC1=NC=NC(C(=O)O)=C1 I-9646 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 P51219 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58426 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.113 N=C(N)C1=CC(N)=CC=N1 Q58427 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.113 N=C(N)C1=CC=CC(N)=N1 Q58197 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 O29660 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 O30750 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 G-6824 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 G-7501 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.113 NC(=S)C1=NC=CC(N)=C1 Q54468 [0,0,0,0,0,0|3,1,0]=4 41 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 10638 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 O32690 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.113 NC1=CN=CC(B(O)O)=C1 Q68878 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.113 NC1=NC=CC(B(O)O)=C1 Q52829 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.113 NC1=NC=CC(C(=O)O)=C1 G-6760 [0,0,0,0,0,0|2,0,0]=2 46 B10R1.113 NC1=NC=CC(C(=O)O)=N1 O31660 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 A-722 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 Q66304 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 O30825 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 Q68020 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 G-6966 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 G-7305 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [0,0,0,0,0,0|2,0,0]=2 55 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [0,0,0,0,0,0|1,1,0]=2 56 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C-2323 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [0,0,0,0,0,0|1,0,0]=1 59 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 O30875 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.113 O=C(O)C1=NC(O)=NC=C1 O30222 [0,0,0,0,0,0|2,0,0]=2 61 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [0,0,0,0,0,0|2,0,0]=2 62 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.113 O=C1C=C(C(=O)O)NC=N1 Q57219 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.113 O=[N+]([O-])C1=CC(F)=NC=C1 O31098 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 O30304 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 O30887 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.113 O=[N+]([O-])C1=CC=NC(Br)=C1 E-3102 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.113 O=[N+]([O-])C1=NC=CC(Br)=C1 Q53333 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.113 OB(O)C1=CC(Br)=CN=C1 P38023 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.113 OB(O)C1=CC(Cl)=CC=N1 Q53792 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.113 OB(O)C1=CC(F)=NC=C1 Q66308 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.113 OB(O)C1=CC(O)=CN=C1 Q68880 [0,0,0,0,0,0|2,0,1]=3 74 B10R1.113 OB(O)C1=CC=CC(I)=C1 Q66503 [0,0,0,0,0,0|2,0,1]=3 75 B10R1.113 OB(O)C1=CC=NC(O)=C1 Q53788 [0,0,0,0,0,0|2,0,1]=3 76 B10R1.113 OB(O)C1=CN=CC(F)=C1 F-4263 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.113 OB(O)C1=NC(Br)=CC=C1 Q53725 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.113 OB(O)C1=NC(Cl)=CC=C1 A-717 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.113 OC1=CC(C(F)F)=NC=C1 O31481 [0,0,0,0,0,0|3,0,1]=4 80 B9R1.2 C#CC1=CC(O)=CC=C1 P42883 [1,0,0,0,0,0|1,0,1]=3 81 B9R1.2 C#CC1=CC=CC(Br)=C1 O27910 [1,0,0,0,0,0|2,0,1]=4 82 B9R1.2 C#CC1=CC=CC(C)=C1 P36176 [1,0,0,0,0,0|2,0,1]=4 83 B9R1.2 C(=O)C1=CC=CC(Br)=N1 C-3289 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.2 C(=O)C1=CC=NC(Cl)=C1 C-3314 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.2 C(=O)C1=CC=NC(Cl)=N1 Q56440 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 C=CC1=CN=CC(C)=C1 O31501 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 C=CC1=CN=CC(F)=C1 L21838 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.2 C=CC1=NC(Br)=CC=C1 L18289 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.2 CC1=CC(C=O)=NC=C1 O31911 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.2 CC1=CC(C=O)=NC=N1 Q60298 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.2 CC1=CC=NC(C=O)=N1 P44430 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.2 CC1=CN=CC(C=O)=C1 M15605 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.2 CC1=CN=CC(CO)=C1 I-9425 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.2 CC1=NC=CC(CO)=C1 O30864 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.2 CNC1=CC(O)=CC=C1 P41161 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.2 CNC1=CC=CC(I)=C1 P37043 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.2 COC1=CN=CC(O)=C1 O31805 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.2 COC1=NC=CC(O)=C1 N25339 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.2 CSC1=CN=CC(O)=C1 N26050 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.2 N#CC1=CC(O)=CN=C1 E-3095 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.2 N#CC1=CC(O)=NC=C1 S72686 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.2 N#CC1=NC=CC(O)=C1 O29686 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.2 NC1=CC(C=O)=CC=C1 O30581 [1,0,0,0,0,0|1,0,0]=2 104 B9R1.2 NC1=CC(CO)=NC=C1 P43136 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.2 NC1=NC(C=O)=CC=C1 Q53329 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.2 NC1=NC=CC(C=O)=C1 G-5572 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.2 NC1=NC=CC(CO)=C1 G-7574 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.2 NCC1=CC(O)=CC=C1 P36367 [1,0,0,0,0,0|1,0,1]=3 109 B9R1.2 NCC1=CC=CC(F)=C1 N26365 [1,0,0,0,0,0|2,0,1]=4 110 B9R1.2 NCC1=NC=CC(O)=C1 O29566 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.2 O=C1C=C(CO)C=CN1 C-2797 [1,0,0,0,0,0|1,0,2]=4 112 B9R1.2 O=C1C=CC=C(CO)N1 Q52489 [1,0,0,0,0,0|1,0,2]=4 113 B9R1.2 O=CC1=CC(Cl)=CN=C1 L21834 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.2 O=CC1=CC(Cl)=NC=N1 Q52806 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.2 O=CC1=CC(F)=CN=C1 C-3502 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.2 O=CC1=CC(F)=NC=C1 Q66309 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.2 O=CC1=CC(O)=CN=C1 O31574 [1,0,0,0,0,0|1,0,0]=2 118 B9R1.2 O=CC1=NC(Br)=CC=N1 Q56237 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.2 O=CC1=NC=CC(Cl)=C1 G-5341 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.2 O=CC1=NC=CC(F)=C1 Q56665 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.2 O=CC1=NC=CC(O)=C1 Q53140 [1,0,0,0,0,0|1,0,0]=2 122 B9R1.2 O=CC1=NC=NC(O)=C1 S72508 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.2 OC1=CC=CC(CBr)=C1 O29845 [1,0,0,0,0,0|1,0,1]=3 124 B9R1.2 OCC1=CC(Cl)=CN=C1 P39543 [1,0,0,0,0,0|2,0,1]=4 125 B9R1.2 OCC1=CC(Cl)=NC=C1 Q67739 [1,0,0,0,0,0|2,0,1]=4 126 B9R1.2 OCC1=CC(F)=CN=C1 C-3496 [1,0,0,0,0,0|2,0,1]=4 127 B9R1.2 OCC1=CC(F)=NC=C1 P41706 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.2 OCC1=CN=CC(Br)=C1 P38449 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.2 OCC1=NC(Br)=CC=C1 P38733 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.2 OCC1=NC(F)=CC=C1 P38880 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.2 OCC1=NC=CC(Br)=C1 B-1208 [1,0,0,0,0,0|2,0,1]=4 132 B9R1.2 OCC1=NC=CC(F)=C1 O29281 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.6 NC(=O)C1=NC=NC=C1 P51213 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.6 OB(O)C1=CC=NC=C1 C-3686 [1,0,0,0,0,0|2,0,1]=4 152 B11R1.21 CC(=O)C1=CC(Cl)=C(C)N=C1 O29923 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.21 CC(=O)C1=CC=C(Br)C(Cl)=C1 M15796 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.21 CC(=O)C1=CC=C(Cl)C(Br)=C1 Q66292 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 N25331 [0,1,0,0,0,0|1,0,0]=2 156 B11R1.21 CC(C)C1=CC=C(Cl)C(O)=C1 Q67377 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 Q67058 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 N24268 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.21 CC1=C(Br)N=C(C(=O)O)C=C1 Q53116 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=N1 Q60858 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 N25142 [0,1,0,0,0,0|1,0,1]=3 162 B11R1.21 CC1=C(O)C=C(C(=O)O)C=N1 Q60795 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 N26054 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.21 CC1=C(O)N=CC(C(=O)O)=C1 L19518 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl Q66430 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.21 CC1=CC(C(=O)Cl)=NC=C1Br N27305 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.21 CC1=CC(C(=O)O)=CN=C1Br Q66669 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q68802 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.21 CC1=CC(C(=O)O)=CN=C1C Q69971 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.21 CC1=CC(C(=O)O)=CN=C1Cl N25124 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.21 CC1=CC(C(=O)O)=CN=C1F Q66670 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br Q67785 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.21 CC1=CC(C(N)=O)=CC=C1N M15755 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br N25351 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Q67305 [0,1,0,0,0,0|2,0,1]=4 176 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66342 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66343 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.21 CC1=CC=C(C(C)O)C=C1C M22902 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.21 CC1=CN=C(C(=O)O)C=C1C Q60799 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.21 CC1=CN=C(C(=O)O)C=C1Cl Q52680 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.21 CC1=CN=C(C(=O)O)C=C1N Q53529 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.21 CC1=NC(C(=O)Cl)=CC=C1Br N27313 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br Q67308 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br N25229 [0,1,0,0,0,0|3,0,0]=4 185 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br P51094 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.21 CC1=NC=C(C(=O)O)C=C1N G-6537 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1O Q56568 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.21 CN1C=C(C(=O)O)C=CC1=O G-5206 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.21 CN1C=CC(C(=O)O)=CC1=O C-2302 [0,1,0,0,0,0|1,0,1]=3 190 B11R1.21 CN1C=CC(C(N)=O)=CC1=O I-9710 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.21 CN1N=C(C(=O)O)C=CC1=O L21788 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 O30355 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 O30426 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.21 NC(=O)C1=CC(F)=C(Cl)N=C1 O29836 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.21 NC(=O)C1=NC(Br)=C(F)C=C1 O31506 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.21 NC1=C(Br)N=C(C(=O)O)C=N1 C-2776 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.21 NC1=C(O)C=C(C(=O)O)C=N1 L19943 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 A-871 [0,1,0,0,0,0|0,1,0]=2 199 B11R1.21 NC1=C(S)C=CC(C(=O)O)=C1 H-8774 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66341 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66772 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.21 NC1=CC(C(=O)O)=CC=C1S K16116 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.21 NC1=CC(C(=O)O)=NC=C1Br L13873 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1S K12275 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10924 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10938 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 C-3764 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.21 O=C(O)C1=CC(F)=C(Cl)N=C1 O31712 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 P37038 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 K13440 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 L13055 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 O31936 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 O33279 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 L18290 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 F-4046 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.21 O=C(O)C1=NC(O)=C(F)C=C1 Q60811 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 Q65591 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.21 O=C(O)C1=NC=C(Cl)C(Cl)=C1 Q60752 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 P45931 [0,1,0,0,0,0|1,0,1]=3 220 B11R1.21 O=[N+]([O-])C1=CC=C(Br)C(O)=C1 O31196 [0,1,0,0,0,0|1,0,1]=3 221 B11R1.21 OB(O)C1=CC(Br)=C(Cl)C=C1 N24750 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.21 OB(O)C1=CC(Br)=C(F)C=C1 N25430 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.21 OB(O)C1=CC(Cl)=C(Br)C=C1 N25064 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 P44661 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 N24197 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.21 OB(O)C1=CC(O)=C(Br)C=C1 N25862 [0,1,0,0,0,0|1,0,1]=3 227 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 N25249 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 N24560 [0,1,0,0,0,0|1,0,1]=3 229 B11R1.21 OB(O)C1=CC=C(O)C(Cl)=C1 Q66714 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.21 OB(O)C1=CC=C(O)C(F)=C1 O31813 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.23 C#CC(=O)C1=CC=CC(Cl)=C1 P38720 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.23 C#CC(O)C1=CC=CC(Cl)=C1 P38984 [0,1,0,0,0,0|2,0,1]=4 233 B11R1.23 C#CC(O)C1=CC=CC(F)=C1 O31432 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.23 CC1=CC(C(=O)CBr)=CC=C1 O28559 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.23 CC1=CC=CC(C(=O)NN)=N1 S72497 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.23 CC1=CN=CC(C(=O)NN)=C1 O30082 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.23 COC(=O)C1=CC(C)=CN=C1 Q66697 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.23 COC(=O)C1=CC(C)=CN=N1 L22161 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 G-7304 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.23 COC(=O)C1=CC(F)=CN=C1 C-2951 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.23 COC(=O)C1=CC(N)=NC=N1 I-9515 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.23 COC(=O)C1=CC(O)=CN=C1 P45785 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 Q66806 [0,1,0,0,0,0|1,0,0]=2 248 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 C-3476 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 G-5883 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.23 COC(=O)C1=NC(F)=CC=C1 Q68381 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.23 COC(=O)C1=NC(O)=NC=C1 S72664 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 E-3030 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M15778 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.23 COC(=O)C1=NC=CC(C)=N1 L14173 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.23 COC(=O)C1=NC=CC(F)=C1 L22462 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.23 COC(=O)C1=NC=CC(N)=C1 G-6744 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M23610 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.23 COC(=O)C1=NC=NC(C)=C1 P44278 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 L14015 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,1,0,0,0,0|1,0,0]=2 267 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 C-3315 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.23 O=C(CBr)C1=NC=CC(Cl)=C1 O30189 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.23 O=C(CCl)C1=NC=CC(Cl)=C1 O29576 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 P43442 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 N24889 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.74 CC(=O)C1=CC(Cl)=NC(Cl)=C1 O31877 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 O30551 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.74 CC(=O)C1=NC(C)=CC(Cl)=C1 Q53148 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.74 CC(C)C1=CC(O)=CC(Br)=C1 N25795 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.74 CC(O)C1=CC(Cl)=CC(Cl)=C1 P40306 [0,1,0,0,0,0|2,0,1]=4 287 B11R1.74 CC1=CC(B(O)O)=CC(O)=C1 N26309 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.74 CC1=CC(Br)=CC(B(O)O)=C1 Q66359 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 P37229 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 O31676 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 G-6688 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 O31886 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.74 CC1=CC(C(=O)O)=NC(O)=C1 Q60690 [0,1,0,0,0,0|1,0,0]=2 294 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 Q66609 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.74 CC1=CC(C)=NC(C(=O)O)=C1 Q60526 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.74 CC1=CC(C)=NC(C(=O)O)=N1 Q65314 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 Q66831 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 O32304 [0,1,0,0,0,0|0,0,0]=1 299 B11R1.74 CC1=NC(O)=CC(C(=O)O)=N1 P51502 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.74 CN(C)C1=CC(F)=CC(O)=C1 N27265 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 O30715 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 Q67696 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 Q67950 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.74 NC1=CC(C(=O)O)=NC(Br)=C1 Q53661 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.74 NC1=NC(Br)=CC(C(=O)O)=N1 Q53410 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.74 NC1=NC(Cl)=CC(C(=O)O)=N1 Q53411 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.74 NC1=NC(O)=CC(C(=O)O)=N1 M15195 [0,1,0,0,0,0|2,0,0]=3 308 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 Q67948 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.74 O=C(Cl)C1=CC(F)=CC(Br)=C1 O29004 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 G-6615 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 Q67862 [0,1,0,0,0,0|0,0,0]=1 312 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 Q62337 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 O30874 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 10758 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.74 O=C(O)C1=NC(F)=CC(Cl)=C1 Q62427 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.74 O=C(O)C1=NC(F)=CC(F)=C1 Q62424 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.74 O=C([O-])C1=NC(F)=CC(F)=C1 O33117 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 O30417 [0,1,0,0,0,0|1,0,1]=3 319 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(O)=C1 O32687 [0,1,0,0,0,0|1,0,1]=3 320 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 P42451 [0,1,0,0,0,0|2,0,1]=4 321 B11R1.74 OB(O)C1=CC(Cl)=CC(Br)=C1 Q67379 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.74 OB(O)C1=CC(F)=CC(Cl)=C1 Q66814 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.74 OB(O)C1=CC(O)=CC(Cl)=C1 N25649 [0,1,0,0,0,0|1,0,1]=3 324 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 Q66713 [0,1,0,0,0,0|1,0,1]=3 325 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 N26896 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 M23816 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.159 CC(O)C1=CC=CC(Cl)=C1Cl P37496 [0,1,0,0,0,0|2,0,1]=4 328 B11R1.159 CC1=C(B(O)O)C=CC=C1F N24187 [0,1,0,0,0,0|2,0,1]=4 329 B11R1.159 CC1=C(B(O)O)C=CC=C1O N27745 [0,1,0,0,0,0|1,0,1]=3 330 B11R1.159 CC1=C(Br)C=CC=C1B(O)O Q67304 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O P49354 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.159 CC1=C(C(=O)O)C=CN=C1F N26427 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.159 CC1=C(C(=O)O)C=NC=C1Br N25194 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.159 CC1=C(C(=O)O)C=NC=C1Cl Q60529 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.159 CC1=C(C(=O)O)C=NC=C1F Q60749 [0,1,0,0,0,0|2,0,0]=3 336 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br N24536 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.159 CC1=C(C(N)=O)C=NC=C1Br N25587 [0,1,0,0,0,0|3,0,0]=4 338 B11R1.159 CC1=C(C)C(C(=O)O)=CC=N1 Q60787 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O Q66298 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 Q66499 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 Q67898 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.159 CC1=C(N)C(C(N)=O)=CC=C1 O30695 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.159 CC1=CC=CC(B(O)O)=C1O N24258 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.159 CC1=NC=CC(C(=O)O)=C1N Q64766 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.159 CC1=NC=NC(C(=O)O)=C1C Q60491 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.159 CN1C=CC=C(C(=O)O)C1=O G-7544 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=NC=C1 N25264 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 O31275 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.159 NC(=O)C1=CC=CC(N)=C1N G-7463 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O L14675 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl O31474 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 P35150 [0,1,0,0,0,0|1,0,0]=2 353 B11R1.159 NC1=C(I)C=CC=C1C(=O)O O32276 [0,1,0,0,0,0|1,0,0]=2 354 B11R1.159 NC1=NC=CC(C(=O)O)=C1N Q58195 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 O29217 [0,1,0,0,0,0|2,0,0]=3 356 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CN=C1 N26393 [0,1,0,0,0,0|2,0,0]=3 357 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 Q66969 [0,1,0,0,0,0|2,0,0]=3 358 B11R1.159 O=C(O)C1=C(Cl)C(F)=CN=C1 N26255 [0,1,0,0,0,0|2,0,0]=3 359 B11R1.159 O=C(O)C1=C(Cl)C(F)=NC=C1 Q66538 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 E-3012 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 N24320 [0,1,0,0,0,0|0,0,0]=1 362 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O P51774 [0,1,0,0,0,0|1,0,0]=2 363 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O Q66616 [0,1,0,0,0,0|1,0,0]=2 364 B11R1.159 O=C(O)C1=CC=CC(I)=C1F Q67650 [0,1,0,0,0,0|1,0,0]=2 365 B11R1.159 O=C(O)C1=CC=NC(F)=C1F F-4045 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl S72554 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.159 O=C(O)C1=NC=NC(Cl)=C1F Q53531 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.159 O=[N+]([O-])C1=C(Br)C(O)=CC=C1 O34477 [0,1,0,0,0,0|1,0,1]=3 369 B11R1.159 O=[N+]([O-])C1=C(F)C(O)=CC=C1 H-8862 [0,1,0,0,0,0|1,0,1]=3 370 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br P40178 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.159 OB(O)C1=C(Br)C(F)=CC=C1 N26461 [0,1,0,0,0,0|2,0,1]=4 372 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 N25968 [0,1,0,0,0,0|1,0,1]=3 373 B11R1.159 OB(O)C1=CC=CC(Br)=C1F Q66366 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O Q66633 [0,1,0,0,0,0|2,0,1]=4 375 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl G-7117 [0,1,0,0,0,0|2,0,1]=4 376 B11R1.159 OB(O)C1=CC=CC(F)=C1O Q66632 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.159 OB(O)C1=CC=CC(I)=C1F Q66484 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=N1 Q54706 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F G-7719 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.167 CC(=O)C1=CC(C)=CC=C1Br O29725 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N26923 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F P37541 [0,1,0,0,0,0|2,0,0]=3 383 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1Br O31310 [0,1,0,0,0,0|3,0,0]=4 384 B11R1.167 CC(=O)C1=CC(O)=CC=C1C N26381 [0,1,0,0,0,0|1,0,0]=2 385 B11R1.167 CC(C)C1=CC(O)=CC=C1Br N25884 [0,1,0,0,0,0|2,0,1]=4 386 B11R1.167 CC(O)C1=CC(Br)=CC=C1F Q66925 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 P43289 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 L18299 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 P44204 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 Q60931 [0,1,0,0,0,0|2,0,0]=3 391 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 Q60684 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 Q60686 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 Q51924 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.167 CC1=CC=C(Br)C(B(O)O)=C1 N26851 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.167 CC1=CC=C(Br)C=C1B(O)O N25858 [0,1,0,0,0,0|2,0,1]=4 396 B11R1.167 CC1=CC=C(Cl)C(B(O)O)=C1 Q66271 [0,1,0,0,0,0|2,0,1]=4 397 B11R1.167 CC1=CC=C(F)C(C(=O)O)=N1 O30076 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.167 CC1=CC=C(I)C=C1C(=O)O P43248 [0,1,0,0,0,0|1,0,0]=2 399 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 L22360 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.167 CC1=CC=C(N)C=C1C(=O)O P43309 [0,1,0,0,0,0|1,0,0]=2 401 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 N24688 [0,1,0,0,0,0|2,0,1]=4 402 B11R1.167 CC1=CC=C(O)C=C1B(O)O N25272 [0,1,0,0,0,0|1,0,1]=3 403 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 N24563 [0,1,0,0,0,0|2,0,0]=3 404 B11R1.167 CC1=CN=C(Cl)N=C1C(=O)O Q53304 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 N25261 [0,1,0,0,0,0|2,0,0]=3 406 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 L18300 [0,1,0,0,0,0|2,0,0]=3 407 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 Q60885 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 G-7847 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 G-5635 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.167 CC1=NC=C(N)C=C1C(=O)O Q58346 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 O30799 [0,1,0,0,0,0|3,0,0]=4 412 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 O30885 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.167 NC(=O)C1=C(F)C=NC(Br)=C1 Q62405 [0,1,0,0,0,0|3,0,0]=4 414 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Br N26093 [0,1,0,0,0,0|3,0,0]=4 415 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Q67299 [0,1,0,0,0,0|3,0,0]=4 416 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F N24843 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl N25426 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1N O31569 [0,1,0,0,0,0|3,0,0]=4 419 B11R1.167 NC(=O)C1=CC(F)=CC=C1Br P43107 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.167 NC(=O)C1=NC(Br)=CC=C1F Q62404 [0,1,0,0,0,0|3,0,0]=4 421 B11R1.167 NC1=C(C(=O)O)C=C(Cl)N=C1 C-3440 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.167 NC1=C(C(=O)O)C=C(F)N=C1 L22147 [0,1,0,0,0,0|2,0,0]=3 423 B11R1.167 NC1=CC(C(=O)O)=C(Cl)N=C1 G-6804 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O O34588 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O G-5404 [0,1,0,0,0,0|2,0,0]=3 426 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O O34386 [0,1,0,0,0,0|2,0,0]=3 427 B11R1.167 NC1=CC=C(F)C(B(O)O)=C1 N25572 [0,1,0,0,0,0|2,0,1]=4 428 B11R1.167 NC1=CN=C(Cl)N=C1C(=O)O P51239 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O P37901 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 M15563 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.167 NC1=NC=C(F)C=C1C(=O)O L18306 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1F Q67078 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1Cl N25174 [0,1,0,0,0,0|3,0,0]=4 434 B11R1.167 O=C(Cl)C1=CC(Br)=CN=C1F N27324 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.167 O=C(Cl)C1=CC(Cl)=NC=C1Cl N27773 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.167 O=C(O)C1=C(Br)N=CC(Br)=C1 Q66324 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 Q67587 [0,1,0,0,0,0|2,0,0]=3 438 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 C-3726 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 Q67957 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl C-3392 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O C-3696 [0,1,0,0,0,0|2,0,0]=3 442 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br Q67187 [0,1,0,0,0,0|2,0,0]=3 443 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl L22357 [0,1,0,0,0,0|2,0,0]=3 444 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F K12095 [0,1,0,0,0,0|2,0,0]=3 445 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F E-3037 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl E-3057 [0,1,0,0,0,0|2,0,0]=3 447 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br O31572 [0,1,0,0,0,0|2,0,0]=3 448 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C-3699 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.167 O=C(O)C1=CC(F)=CN=C1F Q62473 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.167 O=C(O)C1=CC(F)=NC=C1Br N26408 [0,1,0,0,0,0|2,0,0]=3 451 B11R1.167 O=C(O)C1=CC(F)=NC=C1F H-8387 [0,1,0,0,0,0|2,0,0]=3 452 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br Q52652 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br G-7754 [0,1,0,0,0,0|2,0,0]=3 454 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F P44595 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br L21544 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl Q60687 [0,1,0,0,0,0|1,0,0]=2 457 B11R1.167 O=[N+]([O-])C1=C(S)C=CC(Br)=C1 H-8777 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.167 OB(O)C1=CC(Br)=CC=C1Br Q66796 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.167 OB(O)C1=CC(Br)=CC=C1O N24388 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.167 OB(O)C1=CC(Cl)=CC=C1Br N24945 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.167 OB(O)C1=CC(Cl)=CC=C1O Q66631 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.167 OB(O)C1=CC(F)=CC=C1Br Q66800 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.167 OB(O)C1=CC(F)=CC=C1O Q66483 [0,1,0,0,0,0|2,0,1]=4 464 B11R1.167 OB(O)C1=CC(I)=CC=C1Br N24772 [0,1,0,0,0,0|2,0,1]=4 465 B11R1.167 OB(O)C1=CC(O)=CC=C1Br Q67431 [0,1,0,0,0,0|1,0,1]=3 466 B11R1.167 OB(O)C1=CC(O)=CC=C1F N24783 [0,1,0,0,0,0|1,0,1]=3 467 B11R1.266 C#CC1=CC(B(O)O)=CC=C1 G-5867 [0,1,0,0,0,0|2,0,1]=4 468 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 O28043 [0,1,0,0,0,0|1,0,0]=2 469 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 O28811 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.266 C#CC1=CC(C(N)=O)=CC=C1 M23346 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.266 C#CC1=CC=CC([N+](=O)[O-])=C1 O28041 [0,1,0,0,0,0|2,0,1]=4 472 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 P39070 [0,1,0,0,0,0|1,0,0]=2 473 B11R1.266 CC(C)C1=CC(CO)=CC=C1 Q68461 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.266 CCC1=CC(B(O)O)=CC=C1 Q67300 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.266 CCC1=CC(C(=O)O)=CC=C1 P37036 [0,1,0,0,0,0|1,0,0]=2 476 B11R1.266 CCC1=CC(C(=O)O)=NC=C1 Q60534 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 Q60685 [0,1,0,0,0,0|2,0,0]=3 478 B11R1.266 CNC1=CC(C(=O)O)=CC=C1 P37710 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.266 COC1=CC(C(=O)O)=CN=C1 Q67568 [0,1,0,0,0,0|1,0,0]=2 480 B11R1.266 COC1=CC(C(C)=O)=NC=C1 O30173 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.266 COC1=CC=CC(C(=O)O)=N1 P39197 [0,1,0,0,0,0|1,0,0]=2 482 B11R1.266 COC1=CC=CC(C(C)C)=C1 N26938 [0,1,0,0,0,0|2,0,1]=4 483 B11R1.266 COC1=CN=CC(B(O)O)=C1 N24201 [0,1,0,0,0,0|2,0,1]=4 484 B11R1.266 COC1=NC(C(=O)O)=CC=N1 Q62605 [0,1,0,0,0,0|2,0,0]=3 485 B11R1.266 COC1=NC(C(=O)O)=NC=C1 Q60646 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.266 COC1=NC=CC(B(O)O)=C1 P36205 [0,1,0,0,0,0|2,0,1]=4 487 B11R1.266 COC1=NC=CC(C(C)=O)=C1 O30294 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.266 COC1=NN=CC(C(=O)O)=C1 L14279 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.266 CSC1=CN=CC(C(=O)O)=C1 N26072 [0,1,0,0,0,0|1,1,0]=3 490 B11R1.266 N#CC1=CC(C(=O)O)=NC=C1 O31274 [0,1,0,0,0,0|2,0,0]=3 491 B11R1.266 N#CC1=CC(C(N)=O)=CC=C1 P38673 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.266 NC(=O)C1=CC(CBr)=CN=C1 Q66568 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 P41901 [0,1,0,0,0,0|1,0,1]=3 494 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 10633 [0,1,0,0,0,0|1,0,0]=2 495 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 O28911 [0,1,0,0,0,0|1,0,0]=2 496 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 O28730 [0,1,0,0,0,0|2,0,0]=3 497 B11R1.266 NCC1=CC(C(N)=O)=NC=C1 Q62435 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.266 NNC1=CC(C(=O)O)=NC=C1 Q62382 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 Q60757 [0,1,0,0,0,0|1,0,0]=2 500 B11R1.266 O=C(O)C1=CC=CC(CS)=C1 P39077 [0,1,0,0,0,0|0,1,0]=2 501 B11R1.266 O=CC1=NC(C(=O)O)=CC=C1 Q62315 [0,1,0,0,0,0|1,0,1]=3 502 B11R1.266 O=[N+]([O-])C1=CC(CO)=NC=C1 L13751 [0,1,0,0,0,0|2,0,1]=4 503 B11R1.266 OB(O)C1=CC=CC(CBr)=C1 P37725 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.266 OCC1=CN=CC(B(O)O)=C1 Q52446 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.266 OCC1=NC=CC(B(O)O)=C1 Q53511 [0,1,0,0,0,0|2,0,1]=4 506 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [0,0,0,1,0,0|2,0,1]=4 507 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [0,0,0,1,0,0|2,0,1]=4 508 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [0,0,0,1,0,0|2,0,1]=4 509 B11R2.35 OC1=CC=CC(C2CC2)=C1 O30101 [0,0,0,1,0,0|2,0,1]=4 510 B9R1.35 CC(=O)C1=CC(Br)=CS1 Q67343 [0,0,0,0,1,0|3,0,0]=4 511 B9R1.35 CC(=O)C1=CSC(Cl)=C1 G-5625 [0,0,0,0,1,0|3,0,0]=4 512 B9R1.35 CC1=CC(C(=O)O)=CN1 M15493 [0,0,0,0,1,0|2,0,0]=3 513 B9R1.35 CC1=CC(C(=O)O)=CS1 I-9860 [0,0,0,0,1,0|2,0,0]=3 514 B9R1.35 CC1=CC(C(=O)O)=NN1 G-6037 [0,0,0,0,1,0|3,0,0]=4 515 B9R1.35 CC1=COC(C(=O)O)=C1 O29596 [0,0,0,0,1,0|2,0,0]=3 516 B9R1.35 CC1=CSC(C(=O)O)=C1 G-7586 [0,0,0,0,1,0|2,0,0]=3 517 B9R1.35 CC1=NOC(C(=O)O)=C1 O30705 [0,0,0,0,1,0|3,0,0]=4 518 B9R1.35 CN1C=C(C(=O)O)C=N1 G-5543 [0,0,0,0,1,0|3,0,0]=4 519 B9R1.35 CN1C=CC(C(=O)O)=N1 K12250 [0,0,0,0,1,0|3,0,0]=4 520 B9R1.35 CN1C=NC(C(=O)O)=C1 G-5691 [0,0,0,0,1,0|3,0,0]=4 521 B9R1.35 NC(=O)C1=CC=C(Br)N1 G-6434 [0,0,0,0,1,0|3,0,0]=4 522 B9R1.35 NC1=CN=C(C(=O)O)S1 G-5065 [0,0,0,0,1,0|3,0,0]=4 523 B9R1.35 NC1=NC(C(=O)O)=CO1 G-7158 [0,0,0,0,1,0|3,0,0]=4 524 B9R1.35 NC1=NC(C(=O)O)=CS1 O30841 [0,0,0,0,1,0|3,0,0]=4 525 B9R1.35 O=C(O)C1=CC(Br)=NN1 H-8098 [0,0,0,0,1,0|3,0,0]=4 526 B9R1.35 O=C(O)C1=CC(Cl)=CS1 O30065 [0,0,0,0,1,0|2,0,0]=3 527 B9R1.35 O=C(O)C1=CC=C(Cl)S1 G-6814 [0,0,0,0,1,0|2,0,0]=3 528 B9R1.35 O=C(O)C1=CC=C(F)S1 G-5621 [0,0,0,0,1,0|2,0,0]=3 529 B9R1.35 O=C(O)C1=CN=C(Cl)S1 O31901 [0,0,0,0,1,0|3,0,0]=4 530 B9R1.35 O=C(O)C1=COC(Cl)=N1 O30387 [0,0,0,0,1,0|3,0,0]=4 531 B9R1.35 O=C(O)C1=CSC(Cl)=C1 G-5624 [0,0,0,0,1,0|2,0,0]=3 532 B9R1.35 O=C(O)C1=NC(Br)=CS1 G-6045 [0,0,0,0,1,0|3,0,0]=4 533 B9R1.35 O=C(O)C1=NC=C(Br)S1 I-9912 [0,0,0,0,1,0|3,0,0]=4 534 B9R1.35 O=C(O)C1=NC=C(Cl)S1 I-9904 [0,0,0,0,1,0|3,0,0]=4 535 B9R1.35 O=C(O)C1=NNC(Br)=C1 H-8089 [0,0,0,0,1,0|3,0,0]=4 536 B9R1.35 O=C(O)C1=NNC(Cl)=C1 O34355 [0,0,0,0,1,0|3,0,0]=4 537 B9R1.35 O=C(O)C1=NNC(F)=C1 Q52440 [0,0,0,0,1,0|3,0,0]=4 538 B9R1.35 O=C1C=C(C(=O)O)CC1 O30224 [0,0,0,0,1,0|0,0,3]=4 539 B9R1.35 O=C1NC=C(C(=O)O)N1 O34427 [0,0,0,0,1,0|2,0,1]=4 540 B9R1.41 CC(=O)C1=C(Br)C=CS1 Q65588 [0,0,0,0,1,0|3,0,0]=4 541 B9R1.41 CC1=C(C(=O)O)N=CO1 O31842 [0,0,0,0,1,0|3,0,0]=4 542 B9R1.41 CC1=C(C(=O)O)N=CS1 10657 [0,0,0,0,1,0|3,0,0]=4 543 B9R1.41 CC1=C(C(=O)O)NC=N1 L20560 [0,0,0,0,1,0|3,0,0]=4 544 B9R1.41 CC1=CSC=C1C(=O)O L22411 [0,0,0,0,1,0|2,0,0]=3 545 B9R1.41 CN1C=NC=C1C(=O)O G-7569 [0,0,0,0,1,0|3,0,0]=4 546 B9R1.41 CN1N=CC=C1C(=O)O G-5544 [0,0,0,0,1,0|3,0,0]=4 547 B9R1.41 NC(=O)C1=CC=CN1N L13700 [0,0,0,0,1,0|3,0,0]=4 548 B9R1.41 NC1=C(C(=O)O)C=CS1 P44611 [0,0,0,0,1,0|2,0,0]=3 549 B9R1.41 NC1=C(C(=O)O)C=NN1 A-808 [0,0,0,0,1,0|3,0,0]=4 550 B9R1.41 O=C(O)C1=C(Br)C=CS1 G-6768 [0,0,0,0,1,0|2,0,0]=3 551 B9R1.41 O=C(O)C1=C(Br)N=CN1 H-8119 [0,0,0,0,1,0|3,0,0]=4 552 B9R1.41 O=C(O)C1=C(Br)N=CS1 Q68781 [0,0,0,0,1,0|3,0,0]=4 553 B9R1.41 O=C(O)C1=C(Br)SC=N1 O34437 [0,0,0,0,1,0|3,0,0]=4 554 B9R1.41 O=C(O)C1=C(Cl)C=CN1 H-8302 [0,0,0,0,1,0|2,0,0]=3 555 B9R1.41 O=C(O)C1=CNN=C1Br Q61498 [0,0,0,0,1,0|3,0,0]=4 556 B9R1.41 O=C(O)C1=CNNC1=O F-4837 [0,0,0,0,1,0|2,0,1]=4 557 B9R1.41 O=C(O)C1=CSC=C1Br G-7938 [0,0,0,0,1,0|2,0,0]=3 558 B9R1.41 O=C(O)C1=NNC=C1F Q64164 [0,0,0,0,1,0|3,0,0]=4 559 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 Q69806 [0,0,0,0,0,1|3,0,0]=4 560 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 P38633 [0,0,0,0,0,1|2,0,0]=3 561 B11R1.157 CC(C)OC1=CC=CC(O)=C1 N24861 [0,0,0,0,0,1|2,0,1]=4 562 B11R1.157 CC1=CC(CB(O)O)=CC=C1 L20484 [0,0,0,0,0,1|2,0,1]=4 563 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 L21790 [0,0,0,0,0,1|2,0,0]=3 564 B11R1.157 CC1=CC(CC(=O)O)=NC=C1 Q60602 [0,0,0,0,0,1|2,0,0]=3 565 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 M15842 [0,0,0,0,0,1|2,0,0]=3 566 B11R1.157 CC1=CC=NC(CC(=O)O)=C1 Q52544 [0,0,0,0,0,1|2,0,0]=3 567 B11R1.157 CC1=NC=CC(CC(=O)O)=C1 Q52656 [0,0,0,0,0,1|2,0,0]=3 568 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 C-3500 [0,0,0,0,0,1|2,0,0]=3 569 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 P42693 [0,0,0,0,0,1|2,0,0]=3 570 B11R1.157 O=C(O)CC1=NC(F)=CC=C1 L21789 [0,0,0,0,0,1|2,0,0]=3 571 B11R1.157 O=C(O)CC1=NC(O)=CC=C1 S72816 [0,0,0,0,0,1|1,0,0]=2 572 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 Q60753 [0,0,0,0,0,1|2,0,0]=3 573 B11R1.157 O=C(O)CC1=NC=CC(F)=C1 Q60777 [0,0,0,0,0,1|2,0,0]=3 574 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [2,0,0,0,0,0|2,0,0]=4 575 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [2,0,0,0,0,0|2,0,0]=4 576 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [2,0,0,0,0,0|2,0,0]=4 578 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [2,0,0,0,0,0|2,0,0]=4 579 B8R1.2 C=CC1=CC=CN=C1 O30687 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|1,0,1]=4 581 B8R1.4 CC1=CN=CC(O)=C1 O30725 [2,0,0,0,0,0|1,0,1]=4 582 B8R1.4 NC1=CC(=O)NC=C1 C-3231 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.4 NC1=NC(O)=CC=C1 Q68106 [2,0,0,0,0,0|2,0,0]=4 584 B8R1.4 NC1=NC=CC(O)=C1 E-3010 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.4 O=C1C=C(Br)C=CN1 G-7401 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.4 O=C1C=CC=C(F)N1 F-4400 [2,0,0,0,0,0|2,0,0]=4 587 B8R1.4 O=C1C=CC=C(I)N1 Q69521 [2,0,0,0,0,0|2,0,0]=4 588 B8R1.4 O=C1C=CNC(Br)=C1 Q52479 [2,0,0,0,0,0|2,0,0]=4 589 B8R1.4 OC1=CC(F)=NC=C1 E-3009 [2,0,0,0,0,0|2,0,0]=4 590 B8R1.4 OC1=CN=CC(F)=C1 E-3008 [2,0,0,0,0,0|2,0,0]=4 591 B8R1.4 OC1=NC=CC(F)=C1 S72531 [2,0,0,0,0,0|2,0,0]=4 592 B10R1.2 CC1=C(Br)C=CC=C1C=O N24620 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.2 CC1=C(Br)C=CC=C1CO P35887 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.2 CC1=C(Br)C=NC=C1C=O N25722 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.2 CC1=C(C)C(C=O)=CN=C1 Q60295 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.2 CC1=C(C=O)C=CC=C1O N24855 [1,1,0,0,0,0|0,0,0]=2 597 B10R1.2 CC1=C(C=O)C=CN=C1F N27705 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.2 CC1=C(CO)C=CC=C1Cl N24882 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.2 CC1=C(Cl)C(C=O)=CC=N1 Q60345 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.2 CC1=C(Cl)C=CC=C1C=O Q67349 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.2 CC1=C(F)C(CO)=CC=C1 Q67892 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.2 CC1=C(I)C=CC=C1C=O N27701 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.2 CC1=C(O)C(CO)=CC=C1 P39563 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.2 CC1=NC=CC(C=O)=C1C O29443 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.2 CN1C(=O)C=CC=C1C=O Q60456 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.2 COC1=C(Br)C(O)=CC=C1 O31968 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.2 CSC1=CC=CC(O)=C1F N25513 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.2 NC1=C(Br)C=CC=C1C=O M15514 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.2 NC1=C(Br)C=CC=C1CO O32343 [1,1,0,0,0,0|1,0,1]=4 610 B10R1.2 NCC1=C(O)C(O)=CC=C1 P36464 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 N25236 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.2 O=CC1=C(Br)C(Cl)=NC=C1 Q67645 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.2 O=CC1=C(Cl)C(Br)=NC=C1 Q67220 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.2 O=CC1=C(Cl)C(Cl)=CN=C1 L14672 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.2 O=CC1=C(Cl)C(Cl)=NC=C1 N24622 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.2 O=CC1=C(Cl)C(F)=NC=C1 Q67582 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.2 O=CC1=C(F)C(Br)=NC=C1 O31823 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.2 O=CC1=C(F)C(Cl)=NC=C1 Q67221 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.2 O=CC1=CC=CC(Cl)=C1O Q67707 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.2 O=CC1=CC=CC(I)=C1F Q67649 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.2 O=CC1=CC=CC(I)=C1O O30480 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.2 O=CC1=CC=CC(O)=C1Br Q66620 [1,1,0,0,0,0|0,0,0]=2 623 B10R1.2 O=CC1=CC=CC(O)=C1F Q66733 [1,1,0,0,0,0|0,0,0]=2 624 B10R1.2 O=CC1=CN=CC(Br)=C1Cl N25909 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.2 O=CC1=CN=CC(Br)=C1Cl N26075 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.2 O=CC1=CN=CC(F)=C1Cl N25846 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.2 O=CC1=CN=CC(F)=C1Cl N27377 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.2 OCC1=C(Br)C(F)=CC=C1 N25113 [1,1,0,0,0,0|1,0,1]=4 629 B10R1.2 OCC1=CC=CC(Cl)=C1Br P42134 [1,1,0,0,0,0|1,0,1]=4 630 B10R1.2 OCC1=CC=CC(Cl)=C1Cl Q68410 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.2 OCC1=CC=CC(Cl)=C1F Q68242 [1,1,0,0,0,0|1,0,1]=4 632 B10R1.2 OCC1=CC=CC(Cl)=C1O N27736 [1,1,0,0,0,0|1,0,1]=4 633 B10R1.2 OCC1=CC=CC(F)=C1I O31062 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.2 OCC1=CC=CC(I)=C1F N26895 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.8 CC1=CC(Br)=CC(C=O)=C1 Q66838 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.8 CC1=CC(Br)=CC(C=O)=N1 Q53408 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.8 CC1=CC(Br)=CC(CO)=C1 N24555 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.8 CC1=CC(C)=CC(CO)=C1 Q67964 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.8 CC1=CC(C=O)=CC(C)=N1 O29790 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.8 CC1=CC(C=O)=CC(O)=C1 N24404 [1,1,0,0,0,0|0,0,0]=2 641 B10R1.8 CC1=CC(Cl)=CC(C=O)=C1 N24755 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.8 CC1=CC(Cl)=CC(CO)=C1 N26490 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.8 CC1=CC(I)=CC(CO)=C1 O29298 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.8 CC1=CC(N)=CC(C=O)=N1 Q53479 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.8 COC1=CC(Br)=CC(O)=C1 N25535 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.8 COC1=CC(F)=CC(O)=C1 Q67667 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.8 COC1=CC(O)=CC(Cl)=C1 N24186 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.8 CSC1=CC(F)=CC(O)=C1 N27715 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.8 N#CC1=CC(O)=CC(Br)=C1 F-4622 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.8 O=CC1=CC(Br)=NC(Br)=C1 N26438 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.8 O=CC1=CC(Cl)=CC(Br)=C1 Q67022 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.8 O=CC1=CC(Cl)=NC(Cl)=C1 Q66693 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.8 O=CC1=CC(O)=CC(Br)=C1 Q68324 [1,1,0,0,0,0|0,0,0]=2 654 B10R1.8 O=CC1=CC(O)=CC(Cl)=C1 Q68089 [1,1,0,0,0,0|0,0,0]=2 655 B10R1.8 OC1=CC(O)=CC(CBr)=C1 P38735 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.8 OCC1=CC(Br)=CC(Br)=C1 Q67938 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.8 OCC1=CC(Cl)=CC(Br)=C1 Q67835 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.8 OCC1=CC(F)=CC(Br)=C1 P39698 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.8 OCC1=CC(F)=CC(Cl)=C1 Q68066 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.10 CNCC1=CC(O)=CC=C1 P42117 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.10 COCC1=CC(Br)=CC=C1 Q67458 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.10 NC1=CC(CCO)=CC=C1 O31199 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.10 NCCC1=CC(O)=CC=C1 M23068 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.10 OCCC1=CC=CC(O)=C1 P41607 [1,1,0,0,0,0|0,0,1]=3 665 B10R1.30 CC1=C(C=O)C=C(I)C=C1 N24708 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.30 CC1=CC(C=O)=C(Cl)C=N1 Q60367 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.30 CC1=CC=C(Br)C(C=O)=C1 Q66721 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.30 CC1=CC=C(Br)C(CO)=C1 N24927 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.30 CC1=CC=C(Br)C=C1C=O Q66367 [1,1,0,0,0,0|1,0,0]=3 670 B10R1.30 CC1=CC=C(Br)C=C1CO O34085 [1,1,0,0,0,0|1,0,1]=4 671 B10R1.30 CC1=CC=C(C)C(CO)=C1 P37558 [1,1,0,0,0,0|1,0,1]=4 672 B10R1.30 CC1=CC=C(Cl)C(C=O)=C1 Q67759 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.30 CC1=CC=C(Cl)C=C1C=O N24758 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.30 CC1=CC=C(Cl)C=C1CO P37211 [1,1,0,0,0,0|1,0,1]=4 675 B10R1.30 CC1=CC=C(F)C(CO)=C1 Q68220 [1,1,0,0,0,0|1,0,1]=4 676 B10R1.30 CC1=CC=C(F)C=C1CO Q67532 [1,1,0,0,0,0|1,0,1]=4 677 B10R1.30 CC1=CC=C(O)C(CO)=C1 N26156 [1,1,0,0,0,0|1,0,1]=4 678 B10R1.30 CC1=CC=C(O)C=C1C=O Q67573 [1,1,0,0,0,0|0,0,0]=2 679 B10R1.30 CC1=CC=C(O)C=C1CO N24525 [1,1,0,0,0,0|0,0,1]=3 680 B10R1.30 CC1=CN=C(Cl)C(C=O)=C1 N25126 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.30 CC1=CN=C(F)C(C=O)=C1 N25335 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.30 CC1=NC(C=O)=C(F)C=C1 L22459 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.30 CC1=NC=C(Cl)C=C1C=O Q60371 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.30 COC1=C(C)C=CC(O)=C1 N24341 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.30 COC1=C(Cl)C=CC(O)=C1 N24761 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.30 COC1=CC(O)=CC=C1Br Q67374 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.30 NC1=CC=C(Br)C=C1C=O G-7659 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.30 NC1=CC=C(Br)C=C1CO G-7692 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.30 O=C1C=CC(=O)C(CO)=C1 P43227 [1,1,0,0,0,0|0,0,2]=4 690 B10R1.30 O=CC1=C(Br)N=CC(Br)=C1 Q66657 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.30 O=CC1=C(F)N=CC(Cl)=C1 P43188 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.30 O=CC1=CC(Br)=CC=C1Br Q67129 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.30 O=CC1=CC(Br)=CN=C1Cl L13548 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.30 O=CC1=CC(Br)=CN=C1F C-2352 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.30 O=CC1=CC(Br)=NC=C1Br Q67225 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.30 O=CC1=CC(Br)=NC=C1Cl N25049 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.30 O=CC1=CC(Br)=NC=C1F L21793 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.30 O=CC1=CC(Cl)=CN=C1Br N26185 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.30 O=CC1=CC(Cl)=CN=C1Cl Q67459 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.30 O=CC1=CC(Cl)=NC=C1Br Q67223 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.30 O=CC1=CC(Cl)=NC=C1Cl N24266 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.30 O=CC1=CC(Cl)=NC=C1F N24660 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.30 O=CC1=CC(Cl)=NC=C1O Q57091 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.30 O=CC1=CC(F)=CN=C1Cl I-9133 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.30 O=CC1=CC(F)=NC=C1Br N27816 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.30 O=CC1=CC(F)=NC=C1Cl O30148 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.30 O=CC1=CC(F)=NC=C1F H-8386 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.30 O=CC1=CC(I)=CC=C1Br N24623 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.30 O=CC1=CC(O)=CC=C1F Q66734 [1,1,0,0,0,0|0,0,0]=2 710 B10R1.30 O=CC1=NC(Br)=CC=C1F I-9355 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.30 O=CC1=NC(Cl)=CC=C1Br O31369 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.30 OCC1=C(F)C=CC(I)=C1 N27718 [1,1,0,0,0,0|1,0,1]=4 713 B10R1.30 OCC1=CC(Cl)=CC=C1F P40230 [1,1,0,0,0,0|1,0,1]=4 714 B10R1.172 C#CC1=CC(C=O)=CC=C1 O27970 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.172 C=CC1=NC(C=O)=CC=C1 Q52934 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.172 C=CC1=NC(OC)=CC=C1 Q65665 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.172 CCC1=CC(C=O)=CC=C1 Q67834 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.172 CCC1=CC=CC(CO)=C1 N25577 [1,1,0,0,0,0|1,0,1]=4 719 B10R1.172 CCC1=NC(C=O)=CC=C1 Q60374 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.172 COC1=CC(C=O)=NC=C1 O30611 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.172 COC1=CC=CC(C=O)=N1 Q67244 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.172 COC1=CN=CC(C=O)=C1 G-6116 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.172 COC1=CN=CC(CO)=C1 N24537 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.172 COC1=NC=CC(C=O)=C1 G-5573 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.172 COC1=NC=CC(CO)=C1 C-3669 [1,1,0,0,0,0|1,0,1]=4 726 B10R1.172 N#CC1=CC(C=O)=CN=C1 L22398 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.172 N#CC1=CC(C=O)=NC=C1 Q60335 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.172 N#CC1=NC(C=O)=CC=C1 Q56667 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.172 N#CC1=NC=CC(C=O)=C1 L21968 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.172 O=CC1=CC=CC(CO)=C1 O34201 [1,1,0,0,0,0|0,0,0]=2 731 B10R1.172 O=CC1=NC(CO)=CC=C1 O30452 [1,1,0,0,0,0|1,0,0]=3 732 B10R1.172 OCC1=CC=CC(CBr)=C1 P35928 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.172 OCC1=CC=CC(CCl)=C1 P40497 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.176 C=CC1=CC=C(F)C(F)=C1 P38224 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.176 CC1=C(Br)N=CC(C=O)=C1 N24668 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.176 CC1=C(C)N=CC(C=O)=C1 Q67397 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 N25889 [1,1,0,0,0,0|1,0,1]=4 738 B10R1.176 CC1=C(Cl)N=CC(C=O)=C1 Q66671 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.176 CC1=C(F)C=CC(C=O)=N1 L14295 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.176 CC1=C(F)N=CC(C=O)=C1 O30685 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.176 CC1=C(O)C=C(C=O)C=C1 N25292 [1,1,0,0,0,0|0,0,0]=2 742 B10R1.176 CC1=CC(C=O)=CC=C1Br K13407 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.176 CC1=CC(C=O)=CC=C1Cl Q67363 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.176 CC1=CC(C=O)=CC=C1O Q68150 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.176 CC1=CC(C=O)=CN=C1O Q60238 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.176 CC1=CC(C=O)=NC=C1Br N24978 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.176 CC1=CC(C=O)=NC=C1Cl N25470 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.176 CC1=CC(CO)=CC=C1Br N24431 [1,1,0,0,0,0|1,0,1]=4 749 B10R1.176 CC1=CC=C(C=O)C=C1Br Q67254 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.176 CC1=CC=C(C=O)C=C1Cl Q67635 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.176 CC1=CC=C(C=O)N=C1C Q60347 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.176 CC1=CC=C(CO)C=C1Br Q67930 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.176 CC1=CN=C(C=O)C=C1Br H-8137 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.176 CC1=NC(C=O)=CC=C1Br N24846 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.176 CN1C=C(C=O)C=CC1=O S72506 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.176 CN1C=CC(C=O)=CC1=O I-9722 [1,1,0,0,0,0|1,0,1]=4 757 B10R1.176 COC1=CC=C(Br)C(O)=C1 Q66993 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.176 COC1=CC=C(C)C(O)=C1 Q67987 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.176 COC1=CC=C(F)C(O)=C1 Q67529 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.176 COC1=CC=C(N)C(O)=C1 M15200 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.176 COC1=CC=C(N)C(O)=C1 M15201 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.176 CSC1=CC(O)=C(C)C=C1 N26961 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.176 CSC1=CC(O)=C(F)C=C1 N27741 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.176 NC1=C(Cl)N=C(C=O)C=C1 Q52637 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.176 NC1=CC=C(CO)C=C1Cl O27969 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.176 O=CC1=CC(Cl)=C(Cl)N=C1 N24947 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.176 O=CC1=CC(Cl)=C(F)C=N1 Q60409 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.176 O=CC1=CC=C(F)C(O)=C1 Q67727 [1,1,0,0,0,0|0,0,0]=2 769 B10R1.176 O=CC1=NC(Cl)=C(Br)C=C1 O29867 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.176 OCC1=CC(O)=C(F)C=C1 N25036 [1,1,0,0,0,0|0,0,1]=3 771 B10R1.176 OCC1=CC=C(Br)C(Cl)=C1 Q67931 [1,1,0,0,0,0|1,0,1]=4 772 B10R1.176 OCC1=CC=C(Cl)C(O)=C1 N25640 [1,1,0,0,0,0|0,0,1]=3 773 B10R1.176 OCC1=CC=C(O)C(Br)=C1 Q68849 [1,1,0,0,0,0|1,0,1]=4 774 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,1,0,0,0,0|1,0,1]=4 783 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,1,0,0,0,0|1,0,1]=4 784 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.13 CC1=NC=C(C(=O)O)C=N1 P44549 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.13 NC(=O)C1=CC=C(Br)N=C1 P35365 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 O30890 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 N24759 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.13 NC1=CC=C(B(O)O)C=C1 Q66344 [1,1,0,0,0,0|1,0,1]=4 794 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.13 NC1=CN=C(C(=O)O)C=N1 10608 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.13 NC1=CN=C(C(=O)O)N=C1 O33536 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.13 NC1=NN=C(C(=O)O)C=C1 G-5218 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.13 O=C(Cl)C1=NC=C(Cl)C=C1 N25108 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.13 O=C(O)C1=CN=C(Br)N=C1 Q64836 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 G-5309 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.13 O=C(O)C1=CN=C(O)N=C1 O31007 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [1,1,0,0,0,0|1,0,0]=3 806 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 Q52548 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 G-7253 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 B-1219 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [1,1,0,0,0,0|1,0,0]=3 810 B10R1.13 O=C(O)C1=NC=C(F)C=N1 H-8066 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 L14250 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 B-1753 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.13 OB(O)C1=CC=C(S)C=C1 P39473 [1,1,0,0,0,0|1,0,1]=4 815 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [1,1,0,0,0,0|1,0,1]=4 823 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [1,1,0,0,0,0|1,0,1]=4 829 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.61 CC1=C(C(=O)O)C=CN=C1 Q56301 [1,1,0,0,0,0|1,0,0]=3 845 B10R1.61 CC1=C(C(=O)O)C=NN=C1 G-5521 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.61 CC1=C(C(=O)O)N=NC=C1 L13035 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.61 CC1=CN=CN=C1C(=O)O O33331 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [1,1,0,0,0,0|1,0,0]=3 850 B10R1.61 CC1=NC=CN=C1C(=O)O G-5660 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [1,1,0,0,0,0|1,0,1]=4 852 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [1,1,0,0,0,0|1,0,1]=4 853 B10R1.61 N=C(N)C1=CC=CC=C1F P51589 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 N25046 [1,1,0,0,0,0|2,0,0]=4 855 B10R1.61 NC(=O)C1=C(N)C=CN=C1 C-3535 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.61 NC(=O)C1=CC=CN=C1F N25255 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.61 NC(=O)C1=CC=NC=C1N O34515 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.61 NC(=O)C1=NC=CC=C1N C-3697 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.61 NC1=C(C(=O)O)C=CN=C1 G-6779 [1,1,0,0,0,0|1,0,0]=3 860 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.61 NC1=C(C(=O)O)N=CN=C1 Q57220 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.61 NC1=NN=CC=C1C(=O)O M15199 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.61 O=C(Cl)C1=CC=CN=C1Br N24418 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.61 O=C(Cl)C1=CC=CN=C1F N25171 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 G-5495 [1,1,0,0,0,0|1,0,0]=3 868 B10R1.61 O=C(O)C1=C(Br)N=CN=C1 H-8378 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [1,1,0,0,0,0|1,0,0]=3 870 B10R1.61 O=C(O)C1=C(Cl)N=CN=C1 H-8380 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.61 O=C(O)C1=C(F)C=NC=C1 G-7559 [1,1,0,0,0,0|1,0,0]=3 872 B10R1.61 O=C(O)C1=C(I)C=NC=C1 O31943 [1,1,0,0,0,0|1,0,0]=3 873 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [1,1,0,0,0,0|1,0,0]=3 874 B10R1.61 O=C(O)C1=CN=CNC1=O H-8379 [1,1,0,0,0,0|2,0,0]=4 875 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.61 O=C(O)C1=NC=CN=C1Br S70901 [1,1,0,0,0,0|2,0,0]=4 878 B10R1.61 O=C(O)C1=NC=CN=C1Cl G-5403 [1,1,0,0,0,0|2,0,0]=4 879 B10R1.61 O=C(O)C1=NC=CN=C1I O29988 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.61 O=C(O)C1=NC=CN=C1O C-3727 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.61 O=C(O)C1=NC=NC=C1Cl P51523 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.61 O=C(O)C1=NC=NC=C1F O33158 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.61 OB(O)C1=CC=CC=C1I Q67114 [1,1,0,0,0,0|1,0,1]=4 884 B10R1.14 COC(=O)C1=CC(Br)=CS1 G-5587 [0,1,0,0,1,0|2,0,0]=4 885 B10R1.14 COC(=O)C1=CC(Cl)=CN1 Q53057 [0,1,0,0,1,0|2,0,0]=4 886 B10R1.14 COC(=O)C1=CC(Cl)=CS1 L22458 [0,1,0,0,1,0|2,0,0]=4 887 B10R1.14 COC(=O)C1=CC=C(Br)N1 O30342 [0,1,0,0,1,0|2,0,0]=4 888 B10R1.14 COC(=O)C1=CC=C(Br)S1 G-5588 [0,1,0,0,1,0|2,0,0]=4 889 B10R1.14 COC(=O)C1=CC=C(N)O1 G-7080 [0,1,0,0,1,0|2,0,0]=4 890 B10R1.14 COC(=O)C1=CNC(Br)=C1 A-983 [0,1,0,0,1,0|2,0,0]=4 891 B10R1.14 COC(=O)C1=CSC(Cl)=C1 G-6180 [0,1,0,0,1,0|2,0,0]=4 892 B10R1.31 CCC1=CC=C(C(=O)O)S1 Q68130 [0,1,0,0,1,0|2,0,0]=4 893 B10R1.31 COC1=CSC(C(=O)O)=C1 O30204 [0,1,0,0,1,0|1,0,0]=3 894 B10R1.31 N#CC1=CC=C(C(=O)O)O1 Q69824 [0,1,0,0,1,0|2,0,0]=4 895 B10R1.31 O=CC1=CC=C(C(=O)O)S1 O31938 [0,1,0,0,1,0|1,0,1]=4 896 B10R1.58 CC1=C(Br)C=C(C(=O)O)O1 L19302 [0,1,0,0,1,0|2,0,0]=4 897 B10R1.58 CN1N=C(C(=O)O)C=C1O H-8034 [0,1,0,0,1,0|2,0,0]=4 898 B10R1.58 O=C(O)C1=CC(Br)=C(Cl)S1 O30383 [0,1,0,0,1,0|2,0,0]=4 899 B10R1.59 O=C(O)C1=C(Br)C=C(Br)S1 Q67324 [0,1,0,0,1,0|2,0,0]=4 900 B10R1.194 CC1=C(C(=O)O)SC=C1Br Q65603 [0,1,0,0,1,0|2,0,0]=4 901 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 O30456 [0,1,0,0,1,0|2,0,0]=4 902 B10R1.194 CC1=CNC(C(=O)O)=C1C C-3353 [0,1,0,0,1,0|2,0,0]=4 903 B10R1.194 CN1C(Br)=CC=C1C(=O)O O30276 [0,1,0,0,1,0|2,0,0]=4 904 B10R1.194 O=C(O)C1=C(F)C(F)=CN1 Q70074 [0,1,0,0,1,0|2,0,0]=4 905 B10R1.39 CSC1=C(C(=O)O)C=CS1 N25635 [0,1,0,0,1,0|1,1,0]=4 906 B10R1.149 COC(=O)C1=C(Br)C=CN1 G-6702 [0,1,0,0,1,0|2,0,0]=4 907 B10R1.149 COC(=O)C1=C(C)C=CN1 G-7400 [0,1,0,0,1,0|2,0,0]=4 908 B10R1.149 COC(=O)C1=C(Cl)C=CN1 G-6436 [0,1,0,0,1,0|2,0,0]=4 909 B10R1.149 COC(=O)C1=C(N)C=CO1 I-9332 [0,1,0,0,1,0|2,0,0]=4 910 B10R1.149 COC(=O)C1=C(N)C=CO1 L14050 [0,1,0,0,1,0|2,0,0]=4 911 B10R1.149 COC(=O)C1=CNC=C1C L22330 [0,1,0,0,1,0|2,0,0]=4 912 B10R1.149 COC(=O)C1=CSC=C1Br O34448 [0,1,0,0,1,0|2,0,0]=4 913 B10R1.149 COC(=O)C1=CSC=C1C N26170 [0,1,0,0,1,0|2,0,0]=4 914 B10R1.149 COC(=O)C1=CSC=C1N Q52828 [0,1,0,0,1,0|2,0,0]=4 915 B10R1.192 CC1=CSC(C)=C1C(=O)O Q68492 [0,1,0,0,1,0|2,0,0]=4 916 B12R1.19 CC1=CC(CC(=O)O)=CC=C1N P51427 [0,1,0,0,0,1|1,0,0]=3 917 B12R1.19 O=C(O)CC1=CC=C(Br)C(Cl)=C1 P41923 [0,1,0,0,0,1|1,0,0]=3 918 B12R1.19 O=C(O)CC1=CC=C(Br)C(F)=C1 S70897 [0,1,0,0,0,1|1,0,0]=3 919 B12R1.19 O=C(O)CC1=CC=C(O)C(I)=C1 K12031 [0,1,0,0,0,1|1,0,0]=3 920 B12R1.50 C=CC(=O)NC1=CC(O)=CC=C1 P48889 [0,1,0,0,0,1|1,0,0]=3 921 B12R1.50 C=CC(=O)NC1=CC=CC(N)=C1 P47752 [0,1,0,0,0,1|2,0,0]=4 922 B12R1.50 CCC(=O)CC1=CC=CC(C)=C1 P40770 [0,1,0,0,0,1|2,0,0]=4 923 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 P37115 [0,1,0,0,0,1|2,0,0]=4 924 B12R1.50 COC(=O)CC1=CC(C)=CN=C1 L14271 [0,1,0,0,0,1|2,0,0]=4 925 B12R1.50 COC(=O)CC1=CC=CC(F)=N1 N25800 [0,1,0,0,0,1|2,0,0]=4 926 B12R1.50 COC(=O)CC1=CC=CC(I)=C1 M22875 [0,1,0,0,0,1|1,0,0]=3 927 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 P38153 [0,1,0,0,0,1|0,0,0]=2 928 B12R1.50 COC(=O)CC1=NC(C)=CC=C1 M15820 [0,1,0,0,0,1|2,0,0]=4 929 B12R1.50 NNC(=O)CC1=CC=CC(Cl)=C1 P36762 [0,1,0,0,0,1|2,0,0]=4 930 B12R1.50 O=C(CBr)CC1=CC=CC(Br)=C1 O32163 [0,1,0,0,0,1|2,0,0]=4 931 B12R1.50 O=C(CBr)CC1=CC=CC(Cl)=C1 O29302 [0,1,0,0,0,1|2,0,0]=4 932 B12R1.127 CC(=O)NC1=CC(C)=CC=C1C P43337 [0,1,0,0,0,1|2,0,0]=4 933 B12R1.127 CC1=CC=C(Br)C=C1CC(=O)O P35765 [0,1,0,0,0,1|1,0,0]=3 934 B12R1.127 O=C(O)CC1=CC(Br)=CC=C1Br Q52414 [0,1,0,0,0,1|1,0,0]=3 935 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1Cl P37555 [0,1,0,0,0,1|1,0,0]=3 936 B12R1.127 O=C(O)CC1=CC(F)=CN=C1Cl Q64325 [0,1,0,0,0,1|2,0,0]=4 937 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 N24844 [0,1,0,0,0,1|2,0,0]=4 938 B12R1.224 CC1=C(N)C(CC(=O)O)=CC=C1 O32083 [0,1,0,0,0,1|1,0,0]=3 939 B12R1.224 CC1=C(N)C=CC=C1CC(=O)O O31221 [0,1,0,0,0,1|1,0,0]=3 940 B12R1.224 CC1=CC=CN(CC(=O)O)C1=O Q60812 [0,1,0,0,0,1|2,0,0]=4 941 B12R1.224 O=C(O)CC1=CC=CC(O)=C1O P40027 [0,1,0,0,0,1|0,0,0]=2 942 B12R1.225 CC1=CC(C(=O)C(=O)O)=CC=C1 P37051 [0,1,0,0,0,1|1,0,0]=3 943 B12R1.225 CC1=CC(C(N)C(=O)O)=CC=C1 P37582 [0,1,0,0,0,1|1,0,0]=3 944 B12R1.225 CC1=CC(C(O)C(=O)O)=CC=C1 P36822 [0,1,0,0,0,1|1,0,0]=3 945 B12R1.225 CC1=CC([C@@H](N)C(=O)O)=CC=C1 P40243 [0,1,0,0,0,1|1,0,0]=3 946 B12R1.225 CC1=CC([C@H](N)C(=O)O)=CC=C1 P42369 [0,1,0,0,0,1|1,0,0]=3 947 B12R1.225 NC(C(=O)O)C1=CC=CC(Br)=C1 O30706 [0,1,0,0,0,1|1,0,0]=3 948 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 P36389 [0,1,0,0,0,1|1,0,0]=3 949 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 O28864 [0,1,0,0,0,1|0,0,0]=2 950 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 O28938 [0,1,0,0,0,1|1,0,0]=3 951 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 P39302 [0,1,0,0,0,1|1,0,0]=3 952 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(O)=C1 O28464 [0,1,0,0,0,1|0,0,0]=2 953 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Br)=C1 P41079 [0,1,0,0,0,1|1,0,0]=3 954 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Cl)=C1 O28946 [0,1,0,0,0,1|1,0,0]=3 955 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(F)=C1 P40985 [0,1,0,0,0,1|1,0,0]=3 956 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(O)=C1 O28477 [0,1,0,0,0,1|0,0,0]=2 957 B12R1.225 O=C(O)C(=O)C1=CC=CC(Br)=C1 P36439 [0,1,0,0,0,1|1,0,0]=3 958 B12R1.225 O=C(O)C(=O)C1=CC=CC(Cl)=C1 P39209 [0,1,0,0,0,1|1,0,0]=3 959 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 P36019 [0,1,0,0,0,1|1,0,0]=3 960 B12R1.225 O=C(O)C(=O)C1=CC=CC(I)=C1 P39211 [0,1,0,0,0,1|1,0,0]=3 961 B12R1.225 O=C(O)C(O)C1=CC=CC(Br)=C1 M23024 [0,1,0,0,0,1|1,0,0]=3 962 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 P38344 [0,1,0,0,0,1|1,0,0]=3 963 B12R1.438 C#CC1=CC(NC(C)=O)=CC=C1 P36498 [0,1,0,0,0,1|2,0,0]=4 964 B12R1.438 CC(=O)NC1=CC=CC(CN)=C1 P39463 [0,1,0,0,0,1|2,0,0]=4 965 B12R1.438 COC1=CC(CC(C)=O)=CC=C1 P38947 [0,1,0,0,0,1|1,0,0]=3 966 B12R1.438 COC1=CC=CC(CC(=O)O)=N1 S72733 [0,1,0,0,0,1|1,0,0]=3 967 B12R1.438 COC1=CC=CC(CC(C)=O)=N1 Q58463 [0,1,0,0,0,1|2,0,0]=4 968 B12R1.48 CC1=C(C=O)C=CC(C(=O)O)=C1 N24734 [0,2,0,0,0,0|1,0,0]=3 969 B12R1.48 CCC1=CN=C(C(=O)O)C=C1C S72490 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.48 CNC1=CC=C(C(C)=O)C=C1N O31571 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 P44401 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.48 COC1=C(Br)N=C(C(=O)O)C=C1 A-739 [0,2,0,0,0,0|2,0,0]=4 973 B12R1.48 COC1=C(F)C=C(C(=O)O)C=N1 S72635 [0,2,0,0,0,0|2,0,0]=4 974 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 N26398 [0,2,0,0,0,0|1,0,1]=4 975 B12R1.48 COC1=C(O)C=C(C(=O)O)C=N1 Q60788 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.48 COC1=CC=C(C(C)=O)C=C1C Q67903 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.48 COC1=CN=C(C(=O)O)C=C1Cl L21805 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.48 COC1=NC=C(C(=O)O)C=C1C N26013 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.48 CSC1=C(Cl)C=C(C(=O)O)C=C1 N25372 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.48 CSC1=NC=C(C(=O)O)C=C1C N25880 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.48 NCC1=CC=C(C(=O)O)C=C1Cl P40738 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 N26294 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.48 O=CC1=CC=C(C(=O)O)C=C1O P37037 [0,2,0,0,0,0|0,0,0]=2 984 B12R1.48 O=CC1=CC=C([N+](=O)[O-])C=C1O P39403 [0,2,0,0,0,0|1,0,1]=4 985 B12R1.56 CC1=C(C#N)C=C(C(=O)O)C=C1 L20132 [0,2,0,0,0,0|1,0,0]=3 986 B12R1.56 CC1=C(C=O)C=C(C(=O)O)C=C1 N24874 [0,2,0,0,0,0|0,0,1]=3 987 B12R1.56 CC1=CC=C(B(O)O)C=C1CO Q66938 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.56 CC1=NC=C(C(=O)O)C=C1C#N Q60502 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.56 CCC1=C(Cl)C=CC(C(=O)O)=C1 N25337 [0,2,0,0,0,0|1,0,0]=3 990 B12R1.56 COC1=C(Br)C=CC(B(O)O)=C1 N25139 [0,2,0,0,0,0|1,0,1]=4 991 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=N1 Q53213 [0,2,0,0,0,0|1,0,0]=3 992 B12R1.56 COC1=C(Cl)N=CC(C(N)=O)=C1 O29866 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 N25905 [0,2,0,0,0,0|1,0,1]=4 994 B12R1.56 COC1=CC(B(O)O)=CC=C1Cl Q67284 [0,2,0,0,0,0|1,0,1]=4 995 B12R1.56 COC1=CC(B(O)O)=CC=C1F Q66981 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.56 COC1=CC(C(=O)O)=CC=C1Br Q66050 [0,2,0,0,0,0|0,0,0]=2 997 B12R1.56 COC1=CC(C(=O)O)=CC=C1Cl Q66690 [0,2,0,0,0,0|0,0,0]=2 998 B12R1.56 COC1=CC(C(=O)O)=CC=C1F I-9256 [0,2,0,0,0,0|0,0,0]=2 999 B12R1.56 COC1=CC(C(=O)O)=CN=C1Br N26442 [0,2,0,0,0,0|1,0,0]=3 1000 B12R1.56 COC1=CC(C(=O)O)=CN=C1Cl N25510 [0,2,0,0,0,0|1,0,0]=3 1001 B12R1.56 COC1=CC(C(=O)O)=CN=C1F N27051 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.56 COC1=CC(C(C)=O)=CC=C1F N24115 [0,2,0,0,0,0|1,0,0]=3 1003 B12R1.56 COC1=CC(C(C)=O)=CN=C1Br N27081 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.56 CSC1=CC(C(=O)O)=CC=C1Br Q68596 [0,2,0,0,0,0|0,1,0]=3 1005 B12R1.56 CSC1=CC(C(=O)O)=CC=C1F N26479 [0,2,0,0,0,0|0,1,0]=3 1006 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1Br P43210 [0,2,0,0,0,0|0,0,1]=3 1007 B12R1.56 OCC1=CC(B(O)O)=CC=C1F Q67013 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.232 CC(=O)C1=CC(Br)=C(Cl)C=C1N O32577 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O Q65601 [0,2,0,0,0,0|2,0,0]=4 1010 B12R1.232 CC(=O)C1=CC(Cl)=C(Br)C=C1O Q69474 [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1O P39550 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(F)=C1 N24864 [0,2,0,0,0,0|1,0,0]=3 1013 B12R1.232 CC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 N26358 [0,2,0,0,0,0|1,0,0]=3 1014 B12R1.232 CC1=C(Cl)C=C(F)C(C(=O)O)=C1 N26027 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.232 CC1=C(N)C=C(C(=O)O)C(Br)=C1 O34469 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.232 CC1=CC(Br)=C(Cl)C=C1C(=O)O N25847 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.232 CC1=CC(Br)=C(F)C=C1C(=O)O Q68706 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1Br N24915 [0,2,0,0,0,0|1,0,0]=3 1019 B12R1.232 CC1=CC(C(=O)O)=C(O)N=C1C Q60518 [0,2,0,0,0,0|2,0,0]=4 1020 B12R1.232 CC1=CC(C)=C(Br)C=C1C(=O)O O34019 [0,2,0,0,0,0|1,0,0]=3 1021 B12R1.232 CC1=CC(C)=C([N+](=O)[O-])C=C1O O31427 [0,2,0,0,0,0|1,0,1]=4 1022 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O O29561 [0,2,0,0,0,0|1,0,0]=3 1023 B12R1.232 CC1=NC(Cl)=C(Cl)C=C1C(=O)O Q62347 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.232 NC(=O)C1=CC(F)=C(Br)C=C1F Q67969 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.232 NC(=O)C1=CC(F)=C(F)C=C1F P34764 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.232 NC1=CC(Br)=C(Cl)C=C1C(=O)O K16111 [0,2,0,0,0,0|1,0,0]=3 1027 B12R1.232 NC1=CC(Cl)=C(Br)C=C1C(=O)O H-8923 [0,2,0,0,0,0|1,0,0]=3 1028 B12R1.232 NC1=CC(F)=C(C(=O)O)C=C1N H-8817 [0,2,0,0,0,0|1,0,0]=3 1029 B12R1.232 O=C(Cl)C1=CC(F)=C(Br)C=C1F N27818 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(I)=N1 P45531 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Br)=C1 N24640 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.232 O=C(O)C1=C(F)C=C(F)C(F)=N1 Q52218 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1Cl O29098 [0,2,0,0,0,0|1,0,0]=3 1034 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Br N26034 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1F P39072 [0,2,0,0,0,0|1,0,0]=3 1036 B12R1.232 O=C(O)C1=CC(F)=C(O)C=C1F N25280 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1Br M15182 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.367 COC(=O)C1=CC(=O)N(C)C=C1 G-5326 [0,2,0,0,0,0|1,0,1]=4 1039 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=N1 Q62410 [0,2,0,0,0,0|2,0,0]=4 1040 B12R1.367 COC(=O)C1=CC(Br)=C(F)N=C1 Q52498 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.367 COC(=O)C1=CC(C)=C(O)C=N1 Q55500 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)N=C1 O30060 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=N1 Q53688 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.367 COC(=O)C1=CC(F)=C(Br)N=C1 O31959 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.367 COC(=O)C1=CC(F)=C(Cl)N=C1 O30110 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.367 COC(=O)C1=CC(I)=C(Cl)N=C1 O30656 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.367 COC(=O)C1=CC(S)=C(N)C=C1 A-872 [0,2,0,0,0,0|0,1,0]=3 1048 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=N1 N24924 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.367 COC(=O)C1=CC=C(Br)C(Cl)=C1 Q68563 [0,2,0,0,0,0|1,0,0]=3 1050 B12R1.367 COC(=O)C1=CC=C(C)C(F)=C1 Q68321 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.367 COC(=O)C1=CC=C(C)C(O)=C1 Q67777 [0,2,0,0,0,0|0,0,0]=2 1052 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=C1 Q68119 [0,2,0,0,0,0|1,0,0]=3 1053 B12R1.367 COC(=O)C1=CC=C(Cl)C(F)=C1 Q67920 [0,2,0,0,0,0|1,0,0]=3 1054 B12R1.367 COC(=O)C1=CC=C(F)C(Br)=C1 P35910 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.367 COC(=O)C1=CC=C(I)C(Br)=C1 P39374 [0,2,0,0,0,0|1,0,0]=3 1056 B12R1.367 COC(=O)C1=CC=C(I)C(O)=C1 O31949 [0,2,0,0,0,0|0,0,0]=2 1057 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 O32280 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.367 COC(=O)C1=CC=C(O)C(O)=N1 G-5826 [0,2,0,0,0,0|1,0,0]=3 1059 B12R1.367 COC(=O)C1=CC=C(S)C(N)=C1 H-8775 [0,2,0,0,0,0|1,0,0]=3 1060 B12R1.367 COC(=O)C1=CC=C(S)C(N)=C1 K16122 [0,2,0,0,0,0|1,0,0]=3 1061 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 C-3708 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.367 COC(=O)C1=CN=C(C)C(Br)=C1 O34001 [0,2,0,0,0,0|2,0,0]=4 1063 B12R1.367 COC(=O)C1=CN=C(C)C(C)=C1 Q68803 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.367 COC(=O)C1=CN=C(C)C(N)=C1 Q52518 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=C1 N25901 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.367 COC(=O)C1=CN=C(Cl)C(Cl)=C1 Q68217 [0,2,0,0,0,0|2,0,0]=4 1067 B12R1.367 COC(=O)C1=CN=C(F)C(C)=C1 N24133 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.367 COC(=O)C1=CN=C(I)C(O)=C1 P44343 [0,2,0,0,0,0|1,0,0]=3 1069 B12R1.367 COC(=O)C1=CN=C(N)C(O)=C1 Q53133 [0,2,0,0,0,0|1,0,0]=3 1070 B12R1.367 COC(=O)C1=CN=C(O)C(O)=C1 G-7788 [0,2,0,0,0,0|1,0,0]=3 1071 B12R1.367 COC(=O)C1=CNC(=O)C(C)=C1 Q54997 [0,2,0,0,0,0|2,0,0]=4 1072 B12R1.367 COC(=O)C1=NC(Br)=C(Cl)C=C1 O30031 [0,2,0,0,0,0|2,0,0]=4 1073 B12R1.367 COC(=O)C1=NC(Br)=C(F)C=C1 O30005 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.367 COC(=O)C1=NC(C)=C(C)C=C1 Q52559 [0,2,0,0,0,0|2,0,0]=4 1075 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 L14114 [0,2,0,0,0,0|2,0,0]=4 1076 B12R1.367 COC(=O)C1=NC(C)=C(N)C=C1 F-4330 [0,2,0,0,0,0|2,0,0]=4 1077 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 O31548 [0,2,0,0,0,0|2,0,0]=4 1078 B12R1.367 COC(=O)C1=NC(I)=C(N)C=C1 O30008 [0,2,0,0,0,0|2,0,0]=4 1079 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 O34344 [0,2,0,0,0,0|2,0,0]=4 1080 B12R1.367 COC(=O)C1=NC(O)=C(C)C=C1 M15463 [0,2,0,0,0,0|1,0,0]=3 1081 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 N24813 [0,2,0,0,0,0|2,0,0]=4 1082 B12R1.367 COC(=O)C1=NC=C(N)C(C)=C1 G-6494 [0,2,0,0,0,0|2,0,0]=4 1083 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 G-5827 [0,2,0,0,0,0|1,0,0]=3 1084 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 P38157 [0,2,0,0,0,0|2,0,0]=4 1085 B12R1.367 NCC(=O)C1=CC=C(F)C(F)=C1 P42286 [0,2,0,0,0,0|2,0,0]=4 1086 B12R1.893 CC(=O)C1=CC=C(F)C(F)=C1Br P43171 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.893 CC1=C(C(=O)O)C=CC(Br)=C1Cl N26904 [0,2,0,0,0,0|1,0,0]=3 1088 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1Br Q68239 [0,2,0,0,0,0|1,0,0]=3 1089 B12R1.893 CC1=C(Cl)C(C)=C(C(=O)O)C=C1 N27468 [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.893 CC1=C(Cl)C(Cl)=C(C(=O)O)C=C1 N26009 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1C N26199 [0,2,0,0,0,0|1,0,0]=3 1092 B12R1.893 CC1=C(Cl)C=CC(C(=O)O)=C1F N27139 [0,2,0,0,0,0|1,0,0]=3 1093 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1Br M15788 [0,2,0,0,0,0|1,0,0]=3 1094 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1F Q68366 [0,2,0,0,0,0|1,0,0]=3 1095 B12R1.893 CC1=C(F)C(Cl)=CC=C1C(=O)O Q68516 [0,2,0,0,0,0|1,0,0]=3 1096 B12R1.893 CC1=C(F)C(F)=CC=C1C(=O)O Q68145 [0,2,0,0,0,0|1,0,0]=3 1097 B12R1.893 CC1=CC=C(C(=O)Cl)C(F)=C1F Q68232 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.893 CC1=CC=C(C(=O)O)C(C)=C1F O29103 [0,2,0,0,0,0|1,0,0]=3 1099 B12R1.893 CC1=CC=C(C(N)=O)C(F)=C1F Q68233 [0,2,0,0,0,0|2,0,0]=4 1100 B12R1.893 CC1=NC=C(C(=O)O)C(C)=C1Cl Q60527 [0,2,0,0,0,0|2,0,0]=4 1101 B12R1.893 CN1C(=O)C=CC(C(=O)O)=C1Cl Q53132 [0,2,0,0,0,0|2,0,0]=4 1102 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F L14645 [0,2,0,0,0,0|1,0,0]=3 1103 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Br)C=C1 N26329 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(Cl)N=C1 L18326 [0,2,0,0,0,0|2,0,0]=4 1105 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(F)C=C1 N25497 [0,2,0,0,0,0|1,0,0]=3 1106 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(F)N=C1 D-2712 [0,2,0,0,0,0|2,0,0]=4 1107 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(Br)C=C1 N24966 [0,2,0,0,0,0|1,0,0]=3 1108 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1Cl Q69535 [0,2,0,0,0,0|1,0,0]=3 1109 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1F Q68384 [0,2,0,0,0,0|1,0,0]=3 1110 B12R1.893 O=C(O)C1=CC=C(Br)C(I)=C1F N26582 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.893 O=C(O)C1=CC=C(Cl)C(Cl)=C1F Q68659 [0,2,0,0,0,0|1,0,0]=3 1112 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1Cl Q68315 [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1F Q68361 [0,2,0,0,0,0|1,0,0]=3 1114 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1O Q68475 [0,2,0,0,0,0|1,0,0]=3 1115 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1O Q67575 [0,2,0,0,0,0|1,0,0]=3 1116 B12R1.893 O=C(O)C1=CC=C(O)C(F)=C1F K13413 [0,2,0,0,0,0|1,0,0]=3 1117 B12R1.893 O=C(O)C1=CN=C(Cl)C(Br)=C1Cl Q52586 [0,2,0,0,0,0|2,0,0]=4 1118 B12R1.893 O=C(O)C1=CN=C(Cl)C(Cl)=C1Cl N26355 [0,2,0,0,0,0|2,0,0]=4 1119 B12R1.893 OB(O)C1=C(F)C(O)=C(Cl)C=C1 N24833 [0,2,0,0,0,0|1,0,1]=4 1120 B12R1.1005 CC(=O)C1=CC(Br)=C(N)C(Br)=C1 P51269 [0,2,0,0,0,0|2,0,0]=4 1121 B12R1.1005 CC(=O)C1=CC(O)=C(F)C(Br)=C1 Q68544 [0,2,0,0,0,0|1,0,0]=3 1122 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1Br Q68126 [0,2,0,0,0,0|1,0,0]=3 1123 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1F Q68269 [0,2,0,0,0,0|1,0,0]=3 1124 B12R1.1005 CC1=CC(C(=O)O)=CC(=O)N1C S72603 [0,2,0,0,0,0|1,0,1]=4 1125 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br N24980 [0,2,0,0,0,0|1,0,0]=3 1126 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Cl N24535 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1F Q67678 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.1005 CC1=CC(C(=O)O)=CN(C)C1=O Q60683 [0,2,0,0,0,0|2,0,0]=4 1129 B12R1.1005 CN1C=C(C(=O)O)C=C(Cl)C1=O Q60643 [0,2,0,0,0,0|2,0,0]=4 1130 B12R1.1005 NC1=C(Cl)C(Cl)=CC(C(=O)O)=C1 L20638 [0,2,0,0,0,0|1,0,0]=3 1131 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 N25181 [0,2,0,0,0,0|1,0,0]=3 1132 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 Q68663 [0,2,0,0,0,0|1,0,0]=3 1133 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 N25180 [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(F)=C1 N26409 [0,2,0,0,0,0|1,0,0]=3 1135 B12R1.1005 O=C(O)C1=CC(F)=C(Cl)C(Br)=C1 Q68593 [0,2,0,0,0,0|1,0,0]=3 1136 B12R1.1005 O=C(O)C1=CC(F)=C(Cl)C(F)=C1 Q67975 [0,2,0,0,0,0|1,0,0]=3 1137 B12R1.1005 O=C(O)C1=CC(I)=C(O)C(I)=C1 P37039 [0,2,0,0,0,0|1,0,0]=3 1138 B12R1.1005 O=[N+]([O-])C1=CC(F)=C(F)C(O)=C1 M23452 [0,2,0,0,0,0|1,0,1]=4 1139 B12R1.1005 [2H]C1=NC(C(=O)O)=CC([2H])=C1[2H] Q60703 [0,2,0,0,0,0|2,0,0]=4 1140 B12R1.17 CCCC(=O)C1=CC=CC(Cl)=C1 P39716 [0,2,0,0,0,0|2,0,0]=4 1141 B12R1.17 CCOC(=O)C1=CC(O)=CN=C1 O31662 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.17 CCOC(=O)C1=NC(C)=CC=C1 Q69244 [0,2,0,0,0,0|2,0,0]=4 1143 B12R1.17 COCC(=O)C1=CC=CC(Cl)=C1 P39392 [0,2,0,0,0,0|1,0,0]=3 1144 B12R1.17 CONC(=O)C1=CC(Br)=CN=C1 N26980 [0,2,0,0,0,0|2,0,0]=4 1145 B12R1.17 N#CCC(=O)C1=CC=CC(F)=C1 P39701 [0,2,0,0,0,0|2,0,0]=4 1146 B12R1.17 N#CCC(=O)C1=CC=CC(I)=C1 P39391 [0,2,0,0,0,0|2,0,0]=4 1147 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O O33542 [0,2,0,0,0,0|2,0,0]=4 1148 B12R1.24 CCC(=O)C1=CC=CC(F)=C1I O32085 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.24 COC(=O)C1=C(Br)C(Cl)=NC=C1 O29131 [0,2,0,0,0,0|2,0,0]=4 1150 B12R1.24 COC(=O)C1=C(Br)C(F)=CC=C1 N25375 [0,2,0,0,0,0|1,0,0]=3 1151 B12R1.24 COC(=O)C1=C(C)C(Br)=CN=C1 N25914 [0,2,0,0,0,0|2,0,0]=4 1152 B12R1.24 COC(=O)C1=C(C)C(F)=CC=C1 N25095 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.24 COC(=O)C1=C(Cl)C(Br)=CN=C1 N26316 [0,2,0,0,0,0|2,0,0]=4 1154 B12R1.24 COC(=O)C1=C(Cl)C(F)=CC=C1 N24748 [0,2,0,0,0,0|1,0,0]=3 1155 B12R1.24 COC(=O)C1=C(F)C(Cl)=NC=C1 N24816 [0,2,0,0,0,0|2,0,0]=4 1156 B12R1.24 COC(=O)C1=C(N)C(C)=NC=C1 L21911 [0,2,0,0,0,0|2,0,0]=4 1157 B12R1.24 COC(=O)C1=CC=CC(Br)=C1Br Q66807 [0,2,0,0,0,0|1,0,0]=3 1158 B12R1.24 COC(=O)C1=CC=CC(Br)=C1C S70878 [0,2,0,0,0,0|1,0,0]=3 1159 B12R1.24 COC(=O)C1=CC=CC(Br)=C1F Q68065 [0,2,0,0,0,0|1,0,0]=3 1160 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1C Q68218 [0,2,0,0,0,0|1,0,0]=3 1161 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1O Q67801 [0,2,0,0,0,0|1,0,0]=3 1162 B12R1.24 COC(=O)C1=CC=CC(N)=C1N P42745 [0,2,0,0,0,0|1,0,0]=3 1163 B12R1.24 COC(=O)C1=CC=CN(C)C1=O L14065 [0,2,0,0,0,0|2,0,0]=4 1164 B12R1.24 COC(=O)C1=CC=NC(Cl)=C1Cl Q67802 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.24 COC(=O)C1=CC=NC(F)=C1Cl Q68535 [0,2,0,0,0,0|2,0,0]=4 1166 B12R1.24 COC(=O)C1=CN=CC(Cl)=C1Cl P43294 [0,2,0,0,0,0|2,0,0]=4 1167 B12R1.24 COC(=O)C1=NC=CC(Br)=C1C Q60125 [0,2,0,0,0,0|2,0,0]=4 1168 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=N1 Q53064 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=N1 L14943 [0,2,0,0,0,0|2,0,0]=4 1170 B12R1.354 COC(=O)C1=C(Br)C=NC(Cl)=C1 Q68002 [0,2,0,0,0,0|2,0,0]=4 1171 B12R1.354 COC(=O)C1=C(C)N=CC(Cl)=C1 O32525 [0,2,0,0,0,0|2,0,0]=4 1172 B12R1.354 COC(=O)C1=C(F)C=NC(N)=C1 Q54918 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=N1 L22304 [0,2,0,0,0,0|2,0,0]=4 1174 B12R1.354 COC(=O)C1=C(O)C=NC(Br)=C1 Q62293 [0,2,0,0,0,0|2,0,0]=4 1175 B12R1.354 COC(=O)C1=CC(Br)=CC=C1Cl P39362 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.354 COC(=O)C1=CC(Br)=CC=C1F Q67664 [0,2,0,0,0,0|1,0,0]=3 1177 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Br Q67506 [0,2,0,0,0,0|2,0,0]=4 1178 B12R1.354 COC(=O)C1=CC(Br)=CN=C1F N24317 [0,2,0,0,0,0|2,0,0]=4 1179 B12R1.354 COC(=O)C1=CC(Br)=CNC1=O G-6765 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.354 COC(=O)C1=CC(Br)=NC=C1Br N25929 [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.354 COC(=O)C1=CC(Br)=NC=C1F O30526 [0,2,0,0,0,0|2,0,0]=4 1182 B12R1.354 COC(=O)C1=CC(Br)=NC=C1N G-5063 [0,2,0,0,0,0|2,0,0]=4 1183 B12R1.354 COC(=O)C1=CC(C)=CC=C1Cl N24140 [0,2,0,0,0,0|1,0,0]=3 1184 B12R1.354 COC(=O)C1=CC(C)=CN=C1F N26166 [0,2,0,0,0,0|2,0,0]=4 1185 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1I N24306 [0,2,0,0,0,0|1,0,0]=3 1186 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1Br N25893 [0,2,0,0,0,0|2,0,0]=4 1187 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1F N24942 [0,2,0,0,0,0|2,0,0]=4 1188 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Cl N25259 [0,2,0,0,0,0|2,0,0]=4 1189 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1F N25133 [0,2,0,0,0,0|2,0,0]=4 1190 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1N O30171 [0,2,0,0,0,0|2,0,0]=4 1191 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O Q62292 [0,2,0,0,0,0|2,0,0]=4 1192 B12R1.354 COC(=O)C1=CC(F)=CC=C1Cl Q68234 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.354 COC(=O)C1=CC(F)=CN=C1Br O30079 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.354 COC(=O)C1=CC(F)=CN=C1C Q62262 [0,2,0,0,0,0|2,0,0]=4 1195 B12R1.354 COC(=O)C1=CC(F)=CN=C1Cl I-9441 [0,2,0,0,0,0|2,0,0]=4 1196 B12R1.354 COC(=O)C1=CC(F)=CN=C1N Q53686 [0,2,0,0,0,0|2,0,0]=4 1197 B12R1.354 COC(=O)C1=CC(F)=NC=C1Br N27079 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.354 COC(=O)C1=CC(I)=CC=C1Br Q68603 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.354 COC(=O)C1=CC(I)=CC=C1F Q68001 [0,2,0,0,0,0|1,0,0]=3 1200 B12R1.354 COC(=O)C1=CC(O)=CN=C1Cl L18307 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.354 COC(=O)C1=NC(Br)=CC=C1Br P51148 [0,2,0,0,0,0|2,0,0]=4 1202 B12R1.354 COC(=O)C1=NC(Br)=CC=C1F O30961 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.354 COC(=O)C1=NC(Br)=CC=C1N O34325 [0,2,0,0,0,0|2,0,0]=4 1204 B12R1.354 COC(=O)C1=NC(C)=CC=C1F P43479 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C O30400 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1N O34343 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br O34454 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.354 COC(=O)C1=NC(N)=CC=C1F Q63907 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.358 CC1=CC(Br)=CC(C(=O)CBr)=C1 P43315 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.358 COC(=O)C1=CC(Br)=CC(Cl)=C1 N24775 [0,2,0,0,0,0|1,0,0]=3 1211 B12R1.358 COC(=O)C1=CC(Br)=NC(Br)=C1 I-9048 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.358 COC(=O)C1=CC(C)=NC(C)=C1 O29903 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 G-6953 [0,2,0,0,0,0|2,0,0]=4 1214 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=C1 Q66687 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.358 COC(=O)C1=CC(F)=CC(Br)=C1 Q67933 [0,2,0,0,0,0|1,0,0]=3 1216 B12R1.358 COC(=O)C1=CC(F)=CC(C)=C1 N25251 [0,2,0,0,0,0|1,0,0]=3 1217 B12R1.358 COC(=O)C1=CC(F)=CC(Cl)=C1 Q67899 [0,2,0,0,0,0|1,0,0]=3 1218 B12R1.358 COC(=O)C1=CC(I)=CC(Br)=C1 O34084 [0,2,0,0,0,0|1,0,0]=3 1219 B12R1.358 COC(=O)C1=CC(O)=CC(Br)=C1 N24570 [0,2,0,0,0,0|0,0,0]=2 1220 B12R1.358 COC(=O)C1=CC(O)=NC(C)=C1 S70881 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.358 COC(=O)C1=NC(Cl)=CC(Cl)=C1 O30743 [0,2,0,0,0,0|2,0,0]=4 1222 B12R1.358 COC(=O)C1=NC(Cl)=CC(N)=C1 O33590 [0,2,0,0,0,0|2,0,0]=4 1223 B12R1.358 COC(=O)C1=NC(N)=CC(Br)=C1 M15629 [0,2,0,0,0,0|2,0,0]=4 1224 B12R1.358 COC(=O)C1=NC(N)=CC(F)=C1 Q63906 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.358 NCC(=O)C1=CC(F)=CC(F)=C1 P42401 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.435 C#CC1=CC(C(=O)OC)=CC=C1 O27992 [0,2,0,0,0,0|1,0,0]=3 1227 B12R1.435 C#CC1=CC=CC(C(=O)OC)=N1 Q65951 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.435 CCC1=CC(C(=O)OC)=CC=C1 O29108 [0,2,0,0,0,0|1,0,0]=3 1229 B12R1.435 CNC(=O)C1=CC=CC(CN)=C1 O28727 [0,2,0,0,0,0|2,0,0]=4 1230 B12R1.435 COC(=O)C1=CC(C#N)=CN=C1 O30362 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.435 COC(=O)C1=CC(C=O)=NC=C1 Q62391 [0,2,0,0,0,0|1,0,1]=4 1232 B12R1.435 COC(=O)C1=CC(CBr)=CN=C1 O29810 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.435 COC(=O)C1=CC(CN)=CN=C1 Q62201 [0,2,0,0,0,0|2,0,0]=4 1234 B12R1.435 COC(=O)C1=CC(CN)=NC=C1 Q52672 [0,2,0,0,0,0|2,0,0]=4 1235 B12R1.435 COC(=O)C1=CC(OC)=CN=C1 N24812 [0,2,0,0,0,0|1,0,0]=3 1236 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 Q67738 [0,2,0,0,0,0|1,0,0]=3 1237 B12R1.435 COC(=O)C1=CC=NC(CN)=C1 Q58189 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.435 COC(=O)C1=CN=CC(C=O)=C1 L18320 [0,2,0,0,0,0|1,0,1]=4 1239 B12R1.435 COC(=O)C1=NC(C=O)=CC=C1 O30506 [0,2,0,0,0,0|1,0,1]=4 1240 B12R1.435 COC(=O)C1=NC(OC)=CC=C1 Q67562 [0,2,0,0,0,0|1,0,0]=3 1241 B12R1.435 COC(=O)C1=NC=CC(C#N)=C1 O30017 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.435 COC(=O)C1=NC=CC(C=O)=C1 Q62439 [0,2,0,0,0,0|1,0,1]=4 1243 B12R1.435 COC(=O)C1=NC=CC(CCl)=C1 L14626 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.435 COC(=O)C1=NC=CC(CN)=C1 Q62200 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.435 COC(=O)C1=NC=CC(CO)=C1 Q62324 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.435 COC1=CC(C(=O)CBr)=NC=C1 O29941 [0,2,0,0,0,0|2,0,0]=4 1247 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 P39449 [0,2,0,0,0,0|1,0,0]=3 1248 B12R1.435 COC1=CC(C(N)CO)=CC=C1 P38813 [0,2,0,0,0,0|1,0,1]=4 1249 B12R1.435 COC1=CC(C(O)CN)=CC=C1 P39138 [0,2,0,0,0,0|1,0,1]=4 1250 B12R1.435 COC1=CC([C@@H](N)CO)=CC=C1 P36199 [0,2,0,0,0,0|1,0,1]=4 1251 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 P42270 [0,2,0,0,0,0|1,0,1]=4 1252 B12R1.435 COC1=CC=CC(C(=O)CCl)=N1 O31071 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.435 COC1=CC=CC(C(=O)NN)=N1 O30144 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.435 COC1=CC=CC(\C(N)=N\O)=N1 Q69431 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.11 CC1=CC(B(O)O)=CC(CO)=C1 N24887 [0,2,0,0,0,0|1,0,1]=4 1256 B12R1.11 CC1=CC(C(=O)O)=CC(C=O)=C1 N26053 [0,2,0,0,0,0|0,0,1]=3 1257 B12R1.11 CCC1=NC(C)=CC(C(=O)O)=C1 Q60516 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.11 COC1=CC(Br)=CC(B(O)O)=C1 Q66791 [0,2,0,0,0,0|1,0,1]=4 1259 B12R1.11 COC1=CC(Br)=CC(C(=O)O)=C1 Q67560 [0,2,0,0,0,0|0,0,0]=2 1260 B12R1.11 COC1=CC(C(=O)O)=CC(C)=C1 O32298 [0,2,0,0,0,0|0,0,0]=2 1261 B12R1.11 COC1=CC(C)=CC(B(O)O)=C1 N25354 [0,2,0,0,0,0|1,0,1]=4 1262 B12R1.11 COC1=CC(Cl)=CC(B(O)O)=C1 Q66426 [0,2,0,0,0,0|1,0,1]=4 1263 B12R1.11 COC1=CC(Cl)=CC(C(=O)O)=C1 Q68383 [0,2,0,0,0,0|0,0,0]=2 1264 B12R1.11 COC1=CC(F)=CC(B(O)O)=C1 Q66322 [0,2,0,0,0,0|1,0,1]=4 1265 B12R1.11 COC1=CC(F)=CC(C(=O)O)=C1 Q67863 [0,2,0,0,0,0|0,0,0]=2 1266 B12R1.11 COC1=CC(O)=CC(B(O)O)=C1 Q68488 [0,2,0,0,0,0|1,0,1]=4 1267 B12R1.11 CSC1=CC(Br)=CC(C(=O)O)=C1 N27198 [0,2,0,0,0,0|0,1,0]=3 1268 B12R1.11 CSC1=CC(Cl)=CC(C(=O)O)=C1 N27199 [0,2,0,0,0,0|0,1,0]=3 1269 B12R1.11 CSC1=CC(F)=CC(C(=O)O)=C1 N25480 [0,2,0,0,0,0|0,1,0]=3 1270 B12R1.11 O=CC1=CC(Br)=CC(C(=O)O)=C1 N24988 [0,2,0,0,0,0|0,0,1]=3 1271 B12R1.11 OCC1=CC(B(O)O)=CC(Cl)=C1 Q68309 [0,2,0,0,0,0|1,0,1]=4 1272 B12R1.11 OCC1=CC(F)=CC(B(O)O)=C1 N25254 [0,2,0,0,0,0|1,0,1]=4 1273 B12R1.511 CC1=C(Br)C=C(F)C=C1C(=O)O Q68690 [0,2,0,0,0,0|1,0,0]=3 1274 B12R1.511 CC1=C(Cl)C(C(=O)O)=CC(F)=C1 Q68226 [0,2,0,0,0,0|1,0,0]=3 1275 B12R1.511 CC1=C(Cl)C=C(Cl)C=C1C(=O)O Q68588 [0,2,0,0,0,0|1,0,0]=3 1276 B12R1.511 CC1=C(F)C(C(=O)O)=CC(Br)=C1 Q68605 [0,2,0,0,0,0|1,0,0]=3 1277 B12R1.511 CC1=C(N)C(C(=O)O)=CC(Br)=C1 O34492 [0,2,0,0,0,0|1,0,0]=3 1278 B12R1.511 CC1=C(N)C=C(Br)C=C1C(=O)O Q69347 [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.511 CC1=C(O)C=C(Br)C=C1C(=O)O Q69329 [0,2,0,0,0,0|0,0,0]=2 1280 B12R1.511 CC1=CC(Br)=C(F)C(C(=O)O)=C1 Q68653 [0,2,0,0,0,0|1,0,0]=3 1281 B12R1.511 CC1=CC(Br)=C(N)C(C(=O)O)=C1 Q69370 [0,2,0,0,0,0|1,0,0]=3 1282 B12R1.511 CC1=CC(C)=C(Cl)C(C(=O)O)=C1 N26159 [0,2,0,0,0,0|1,0,0]=3 1283 B12R1.511 CC1=CC(F)=C(Cl)C(C(=O)O)=C1 Q68575 [0,2,0,0,0,0|1,0,0]=3 1284 B12R1.511 CC1=CN(C)C(=O)C(C(=O)O)=C1 Q60897 [0,2,0,0,0,0|2,0,0]=4 1285 B12R1.511 CC1=NC(O)=C(O)C(C(=O)O)=N1 M15746 [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.511 CN1C=C(Br)C=C(C(=O)O)C1=O C-3342 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.511 NC1=C(C(=O)O)C=C(Cl)N=C1Cl H-8674 [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.511 NC1=C(Cl)C(C(=O)O)=CC(Cl)=C1 P51310 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.511 NC1=C(F)C=C(Br)C=C1C(=O)O Q53436 [0,2,0,0,0,0|1,0,0]=3 1290 B12R1.511 NC1=CC(Cl)=NC(C(=O)O)=C1Cl Q52688 [0,2,0,0,0,0|2,0,0]=4 1291 B12R1.511 NC1=CC(N)=C(O)C(C(=O)O)=C1 P50999 [0,2,0,0,0,0|1,0,0]=3 1292 B12R1.511 O=C(O)C1=C(Cl)C(F)=CC(F)=C1 N25281 [0,2,0,0,0,0|1,0,0]=3 1293 B12R1.511 O=C(O)C1=C(F)C(Br)=CC(Cl)=C1 N25425 [0,2,0,0,0,0|1,0,0]=3 1294 B12R1.511 O=C(O)C1=C(F)C(Cl)=CC(Br)=C1 N25579 [0,2,0,0,0,0|1,0,0]=3 1295 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1Cl O29145 [0,2,0,0,0,0|1,0,0]=3 1296 B12R1.511 O=C(O)C1=CC(Cl)=CC(Cl)=C1F N25059 [0,2,0,0,0,0|1,0,0]=3 1297 B12R1.511 O=C(O)C1=CC(Cl)=CC(F)=C1Cl O29232 [0,2,0,0,0,0|1,0,0]=3 1298 B12R1.511 O=C(O)C1=CC(F)=CC(Cl)=C1O Q68427 [0,2,0,0,0,0|1,0,0]=3 1299 B12R1.87 CCN1C(=O)C=CC=C1C(=O)O Q60844 [0,2,0,0,0,0|1,0,1]=4 1300 B12R1.87 COC1=C(B(O)O)C=CC=C1O N26457 [0,2,0,0,0,0|1,0,1]=4 1301 B12R1.87 COC1=C(C(=O)O)C=CC=C1F N24156 [0,2,0,0,0,0|1,0,0]=3 1302 B12R1.87 COC1=C(C(=O)O)C=CC=C1O N25189 [0,2,0,0,0,0|0,0,0]=2 1303 B12R1.87 COC1=C(C(=O)O)C=CN=C1O Q60674 [0,2,0,0,0,0|1,0,0]=3 1304 B12R1.87 COC1=C(C(=O)O)N=CC=C1Cl Q53039 [0,2,0,0,0,0|2,0,0]=4 1305 B12R1.87 CSC1=C(Br)C=CC=C1C(=O)O N27043 [0,2,0,0,0,0|1,0,0]=3 1306 B12R1.87 CSC1=C(F)C=CC=C1C(=O)O Q68635 [0,2,0,0,0,0|1,0,0]=3 1307 B12R1.87 O=CC1=C(Cl)N=CC=C1C(=O)O Q60209 [0,2,0,0,0,0|2,0,0]=4 1308 B12R1.440 CC1=C(B(O)O)C=CC=C1CO N26718 [0,2,0,0,0,0|1,0,1]=4 1309 B12R1.440 CC1=C(C(=O)O)C=CC=C1C=O N26189 [0,2,0,0,0,0|0,0,1]=3 1310 B12R1.440 COC1=C(C)C(C(=O)O)=CC=N1 Q60750 [0,2,0,0,0,0|1,0,0]=3 1311 B12R1.440 COC1=C(Cl)C(C(=O)O)=CC=C1 Q66689 [0,2,0,0,0,0|0,0,0]=2 1312 B12R1.440 COC1=C(Cl)C(C(=O)O)=NC=C1 Q60578 [0,2,0,0,0,0|1,0,0]=3 1313 B12R1.440 COC1=C(F)C(C(=O)O)=CC=C1 Q67065 [0,2,0,0,0,0|0,0,0]=2 1314 B12R1.440 COC1=C(N)C(C(=O)O)=CC=C1 G-7024 [0,2,0,0,0,0|0,0,0]=2 1315 B12R1.440 COC1=C(O)C(C(C)=O)=CC=C1 G-7111 [0,2,0,0,0,0|1,0,0]=3 1316 B12R1.440 COC1=CC=CC(B(O)O)=C1C N25878 [0,2,0,0,0,0|1,0,1]=4 1317 B12R1.440 COC1=CC=CC(B(O)O)=C1Cl N25352 [0,2,0,0,0,0|1,0,1]=4 1318 B12R1.440 COC1=CC=CC([N+](=O)[O-])=C1N P51314 [0,2,0,0,0,0|1,0,1]=4 1319 B12R1.440 COC1=CC=NC(C(=O)O)=C1C Q60517 [0,2,0,0,0,0|1,0,0]=3 1320 B12R1.440 COC1=CC=NC(C(=O)O)=C1O Q60603 [0,2,0,0,0,0|1,0,0]=3 1321 B12R1.440 COC1=CN=CC(C(=O)O)=C1C N26253 [0,2,0,0,0,0|1,0,0]=3 1322 B12R1.440 COC1=NC=CC(C(=O)O)=C1Cl N26058 [0,2,0,0,0,0|1,0,0]=3 1323 B12R1.440 COC1=NC=CC(C(=O)O)=C1N Q69141 [0,2,0,0,0,0|1,0,0]=3 1324 B12R1.440 CSC1=CC=CC(C(=O)O)=C1F N25002 [0,2,0,0,0,0|0,1,0]=3 1325 B12R1.440 CSC1=CN=CC(C(=O)O)=C1C Q68479 [0,2,0,0,0,0|1,1,0]=4 1326 B12R1.440 NC1=C([N+](=O)[O-])C=CC=C1CO P41390 [0,2,0,0,0,0|1,0,1]=4 1327 B12R1.440 O=C(O)C1=C(Cl)C(CBr)=CC=C1 F-4193 [0,2,0,0,0,0|1,0,0]=3 1328 B12R1.440 O=CC1=C(Br)C(C(=O)O)=CC=C1 P43469 [0,2,0,0,0,0|0,0,1]=3 1329 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1F N26299 [0,2,0,0,0,0|0,0,1]=3 1330 B12R1.440 OCC1=CC=CC(B(O)O)=C1F N24796 [0,2,0,0,0,0|1,0,1]=4 1331 B12R1.894 CC1=C(Br)C(C(=O)O)=C(Cl)C=C1 Q68747 [0,2,0,0,0,0|1,0,0]=3 1332 B12R1.894 CC1=C(C(=O)O)C(F)=CC=C1F N26422 [0,2,0,0,0,0|1,0,0]=3 1333 B12R1.894 CC1=C(Cl)C(C(=O)O)=C(Cl)C=C1 N24735 [0,2,0,0,0,0|1,0,0]=3 1334 B12R1.894 CC1=CC=C(Br)C(C(=O)O)=C1Cl N26860 [0,2,0,0,0,0|1,0,0]=3 1335 B12R1.894 CC1=CC=C(Br)C(C(=O)O)=C1F N24113 [0,2,0,0,0,0|1,0,0]=3 1336 B12R1.894 CC1=CC=C(F)C(C(=O)O)=C1Br N24296 [0,2,0,0,0,0|1,0,0]=3 1337 B12R1.894 CN1C=CC(F)=C(C(=O)O)C1=O Q54505 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.894 NC(=O)C1=C(F)C=CC(Br)=C1F O29002 [0,2,0,0,0,0|2,0,0]=4 1339 B12R1.894 NC1=C(F)C=CC(Br)=C1C(=O)O O32536 [0,2,0,0,0,0|1,0,0]=3 1340 B12R1.894 O=C(Cl)C1=C(F)C=CC(Br)=C1F Q68454 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.894 O=C(O)C1=C(Br)C(Cl)=CC=C1F N27767 [0,2,0,0,0,0|1,0,0]=3 1342 B12R1.894 O=C(O)C1=C(Br)C=CC(O)=C1F Q68685 [0,2,0,0,0,0|0,0,0]=2 1343 B12R1.894 O=C(O)C1=C(Cl)C(Br)=CC=C1Cl C-3736 [0,2,0,0,0,0|1,0,0]=3 1344 B12R1.894 O=C(O)C1=C(Cl)C(Cl)=CC=C1Br N25638 [0,2,0,0,0,0|1,0,0]=3 1345 B12R1.894 O=C(O)C1=C(Cl)C=CC(Cl)=C1F Q66909 [0,2,0,0,0,0|1,0,0]=3 1346 B12R1.894 O=C(O)C1=C(Cl)C=CC(F)=C1F Q68199 [0,2,0,0,0,0|1,0,0]=3 1347 B12R1.894 O=C(O)C1=C(Cl)C=CC(O)=C1F Q66904 [0,2,0,0,0,0|0,0,0]=2 1348 B12R1.894 O=C(O)C1=C(F)C(Br)=CC=C1Br N24795 [0,2,0,0,0,0|1,0,0]=3 1349 B12R1.894 O=C(O)C1=C(F)C(Br)=CC=C1Cl N24251 [0,2,0,0,0,0|1,0,0]=3 1350 B12R1.894 O=C(O)C1=C(F)C(Cl)=CC=C1Br N25600 [0,2,0,0,0,0|1,0,0]=3 1351 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1Br N24292 [0,2,0,0,0,0|1,0,0]=3 1352 B12R1.894 O=C(O)C1=C(F)C(F)=CC=C1O N25746 [0,2,0,0,0,0|1,0,0]=3 1353 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1Br N26917 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.894 O=C(O)C1=C(F)C(I)=CC=C1Cl N27354 [0,2,0,0,0,0|1,0,0]=3 1355 B12R1.894 O=C(O)C1=C(F)C=CC(Br)=C1Cl Q66899 [0,2,0,0,0,0|1,0,0]=3 1356 B12R1.894 O=C(O)C1=C(F)C=CC(Br)=C1F Q67754 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.894 O=C(O)C1=C(F)C=CC(F)=C1Br Q67252 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.894 O=C(O)C1=C(F)C=CC(I)=C1F Q68235 [0,2,0,0,0,0|1,0,0]=3 1359 B12R1.894 O=C(O)C1=C(O)C(F)=CC=C1F N24483 [0,2,0,0,0,0|1,0,0]=3 1360 B12R1.894 O=C(O)C1=C(O)C=CC(Cl)=C1Cl Q68676 [0,2,0,0,0,0|1,0,0]=3 1361 B12R1.894 OB(O)C1=C(Br)C(O)=CC=C1F N25079 [0,2,0,0,0,0|1,0,1]=4 1362 B12R1.894 OB(O)C1=C(F)C(O)=CC=C1Br N24575 [0,2,0,0,0,0|1,0,1]=4 1363 B12R1.894 OB(O)C1=C(F)C(O)=CC=C1Cl N24712 [0,2,0,0,0,0|1,0,1]=4 1364 B12R1.894 OB(O)C1=C(F)C(O)=CC=C1F N24523 [0,2,0,0,0,0|1,0,1]=4 1365 B12R1.894 OB(O)C1=C(F)C=CC(O)=C1Cl Q66853 [0,2,0,0,0,0|1,0,1]=4 1366 B12R1.46 COC1=C(C(=O)O)C=C(C)C=N1 Q60538 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.46 COC1=CC=C(O)C=C1B(O)O N25586 [0,2,0,0,0,0|1,0,1]=4 1368 B12R1.46 COC1=CC=C(O)C=C1C(=O)O N26109 [0,2,0,0,0,0|0,0,0]=2 1369 B12R1.46 COC1=NC=C(Br)C=C1C(=O)O C-3522 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.46 CSC1=CC=C(Cl)C=C1C(=O)O N26910 [0,2,0,0,0,0|1,0,0]=3 1371 B12R1.46 CSC1=CC=C(F)C=C1C(=O)O N24824 [0,2,0,0,0,0|1,0,0]=3 1372 B12R1.46 CSC1=NC=C(C)C=C1C(=O)O N26685 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.46 N#CC1=CC=C(Br)C=C1C(=O)O N24710 [0,2,0,0,0,0|1,0,0]=3 1374 B12R1.46 N#CC1=NC=C(Br)C=C1C(=O)O O29775 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.453 CC1=C(C(=O)O)C=C(C#N)C=N1 Q60659 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.453 CC1=CC=C(C=O)C=C1C(=O)O N24954 [0,2,0,0,0,0|0,0,1]=3 1377 B12R1.453 CC1=CC=C(CO)C=C1B(O)O N26454 [0,2,0,0,0,0|1,0,1]=4 1378 B12R1.453 CCC1=CC(C(=O)O)=C(C)N=C1 Q60747 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.453 CCC1=CC=C(Br)C(C(=O)O)=C1 O32076 [0,2,0,0,0,0|1,0,0]=3 1380 B12R1.453 CCC1=CC=C(F)C(C(=O)O)=C1 O29092 [0,2,0,0,0,0|1,0,0]=3 1381 B12R1.453 CCC1=CC=C(I)C(C(=O)O)=C1 O29417 [0,2,0,0,0,0|1,0,0]=3 1382 B12R1.453 COC1=CC(C(=O)O)=C(Br)C=N1 Q66949 [0,2,0,0,0,0|1,0,0]=3 1383 B12R1.453 COC1=CC(C(=O)O)=C(C)N=C1 Q60882 [0,2,0,0,0,0|1,0,0]=3 1384 B12R1.453 COC1=CC(C(=O)O)=C(Cl)N=C1 G-7393 [0,2,0,0,0,0|1,0,0]=3 1385 B12R1.453 COC1=CC=C(Br)C(B(O)O)=C1 Q66803 [0,2,0,0,0,0|1,0,1]=4 1386 B12R1.453 COC1=CC=C(C)C(B(O)O)=C1 N25200 [0,2,0,0,0,0|1,0,1]=4 1387 B12R1.453 COC1=CC=C(C)C(C(=O)O)=C1 Q66691 [0,2,0,0,0,0|0,0,0]=2 1388 B12R1.453 COC1=CC=C(Cl)C(B(O)O)=C1 Q66427 [0,2,0,0,0,0|1,0,1]=4 1389 B12R1.453 COC1=CC=C(Cl)C(C(=O)O)=C1 Q66692 [0,2,0,0,0,0|0,0,0]=2 1390 B12R1.453 COC1=CC=C(F)C(C(=O)O)=C1 Q67721 [0,2,0,0,0,0|0,0,0]=2 1391 B12R1.453 COC1=CC=C(F)C(C(C)=O)=C1 Q69718 [0,2,0,0,0,0|1,0,0]=3 1392 B12R1.453 COC1=CC=C(O)C(B(O)O)=C1 Q67261 [0,2,0,0,0,0|1,0,1]=4 1393 B12R1.453 COC1=CN=C(F)C(C(=O)O)=C1 N26085 [0,2,0,0,0,0|1,0,0]=3 1394 B12R1.453 COC1=CN=C(O)C(C(C)=O)=C1 Q62403 [0,2,0,0,0,0|2,0,0]=4 1395 B12R1.453 COC1=NC=C(Cl)C(C(=O)O)=C1 Q67209 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.453 COC1=NC=C(N)C(C(=O)O)=C1 O33527 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.453 CSC1=CC=C(F)C(C(=O)O)=C1 N25477 [0,2,0,0,0,0|0,1,0]=3 1398 B12R1.453 NCC1=CC=C(Cl)C(C(=O)O)=C1 P35249 [0,2,0,0,0,0|1,0,0]=3 1399 B12R1.453 O=C(O)C1=CC(CO)=CC=C1Br P42410 [0,2,0,0,0,0|0,0,0]=2 1400 B12R1.453 O=C(O)C1=NC(CO)=NC=C1Br Q52066 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.453 O=CC1=CC(C(=O)O)=C(F)C=C1 N24848 [0,2,0,0,0,0|0,0,1]=3 1402 B12R1.453 O=CC1=CC=C(Br)C(C(=O)O)=C1 P43470 [0,2,0,0,0,0|0,0,1]=3 1403 B12R1.453 O=CC1=CC=C(Cl)C(C(=O)O)=C1 Q68578 [0,2,0,0,0,0|0,0,1]=3 1404 B12R1.258 CC(C)C1=CC(C(=O)O)=CN=C1 Q60756 [0,2,0,0,0,0|2,0,0]=4 1405 B12R1.258 CC(C)C1=NC(C(=O)O)=CC=C1 C-3365 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.258 CC(C)C1=NC=CC(C(=O)O)=C1 Q60619 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.258 CN(C)C1=CC=CC(C(=O)O)=N1 P38912 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.258 CN(C)C1=CN=CC(C(=O)O)=C1 Q60525 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.258 NC(=O)C1=CC(C(=O)O)=CC=C1 P38037 [0,2,0,0,0,0|0,0,1]=3 1410 B12R1.258 NC(=O)C1=CN=CC(C(=O)O)=C1 Q58200 [0,2,0,0,0,0|1,0,1]=4 1411 B12R1.258 NC(=O)C1=NC=CC(B(O)O)=C1 Q53683 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.258 O=C(O)C1=CC(B(O)O)=CN=C1 N25232 [0,2,0,0,0,0|1,0,0]=3 1413 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=N1 L14048 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.258 O=C(O)C1=CC([N+](=O)[O-])=CC=N1 Q65364 [0,2,0,0,0,0|1,0,1]=4 1415 B12R1.258 O=C(O)C1=CC([N+](=O)[O-])=NC=C1 O30689 [0,2,0,0,0,0|1,0,1]=4 1416 B12R1.258 O=C(O)C1=CC=CC(C(F)F)=N1 Q60706 [0,2,0,0,0,0|2,0,0]=4 1417 B12R1.258 O=C(O)C1=CC=NC(C(F)F)=C1 O32415 [0,2,0,0,0,0|2,0,0]=4 1418 B12R1.258 O=C(O)C1=CN=CC(C(F)F)=C1 Q60593 [0,2,0,0,0,0|2,0,0]=4 1419 B12R1.258 O=C(O)C1=CN=CC([N+](=O)[O-])=C1 P43338 [0,2,0,0,0,0|1,0,1]=4 1420 B12R1.279 CCOC1=CC(C(=O)O)=NC=C1 Q60806 [0,2,0,0,0,0|1,0,0]=3 1421 B12R1.279 CCOC1=CN=CC(C(=O)O)=C1 N26062 [0,2,0,0,0,0|1,0,0]=3 1422 B12R1.279 CCOC1=NC=CC(C(=O)O)=C1 Q67292 [0,2,0,0,0,0|1,0,0]=3 1423 B12R1.279 CCOC1=NC=CC(C(=O)O)=N1 Q60851 [0,2,0,0,0,0|2,0,0]=4 1424 B12R1.279 CCOC1=NC=NC(C(=O)O)=C1 Q60847 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.279 CNCC1=CC(C(N)=O)=CC=C1 P34823 [0,2,0,0,0,0|2,0,0]=4 1426 B12R1.279 COCC1=CC(B(O)O)=CC=C1 Q66515 [0,2,0,0,0,0|1,0,1]=4 1427 B12R1.279 COCC1=CC(C(=O)O)=CC=C1 P38831 [0,2,0,0,0,0|0,0,0]=2 1428 B12R1.279 N#CCC1=NC(C(=O)O)=CC=C1 Q60781 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.279 N#CCC1=NC=CC(C(=O)O)=C1 Q60776 [0,2,0,0,0,0|2,0,0]=4 1430 B12R1.279 NCCC1=CC(C(=O)O)=CC=C1 P36745 [0,2,0,0,0,0|1,0,0]=3 1431 B12R1.279 O=C(O)C1=CC=CC(CCO)=C1 O31031 [0,2,0,0,0,0|0,0,0]=2 1432 B12R1.279 O=C(O)C1=NC=CC(CCO)=C1 Q60880 [0,2,0,0,0,0|1,0,0]=3 1433 B12R1.279 O=[N+]([O-])C1=CC(CCO)=CC=C1 O28059 [0,2,0,0,0,0|1,0,1]=4 1434 B12R1.279 O\N=C\C1=CC(B(O)O)=CC=C1 Q66983 [0,2,0,0,0,0|1,0,1]=4 1435 B10R1.23 NC(C(=O)O)C1=CC=CO1 P40590 [0,0,1,1,0,0|1,0,1]=4 1436 B10R1.66 O=C(O)\C=C\C1=CC=CO1 P45498 [0,0,1,1,0,0|0,0,0]=2 1437 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 M15511 [0,0,0,1,0,1|2,0,0]=4 1438 B12R2.202 CC1=NC2=C(O)C=CC=C2S1 O29691 [0,0,0,1,0,1|2,0,0]=4 1439 B12R2.202 NC1=CC=CC2=C1CC(=O)N2 O30052 [0,0,0,1,0,1|2,0,0]=4 1440 B12R2.202 NC1=NC2=C(O)C=CC=C2S1 Q55820 [0,0,0,1,0,1|2,0,0]=4 1441 B12R2.202 NC1=NC2=CC=CC(O)=C2S1 L13188 [0,0,0,1,0,1|1,1,0]=4 1442 B12R2.202 O=C1CC2=C(C1)C(Br)=CC=C2 G-5797 [0,0,0,1,0,1|2,0,0]=4 1443 B12R2.202 O=C1CC2=C(C=CC=C2Br)N1 S86334 [0,0,0,1,0,1|2,0,0]=4 1444 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 M15095 [0,0,0,1,0,1|2,0,0]=4 1445 B12R2.202 O=C1CC2=C(C=CC=C2O)N1 M15233 [0,0,0,1,0,1|1,0,0]=3 1446 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 O32907 [0,0,0,1,0,1|2,0,0]=4 1447 B12R2.202 OC1=C2SC(Cl)=NC2=CC=C1 L13815 [0,0,0,1,0,1|1,1,0]=4 1448 B12R2.606 CC1=NC2=CC(Br)=CC=C2O1 A-856 [0,0,0,1,0,1|2,0,0]=4 1449 B12R2.606 CC1=NC2=CC(N)=CC=C2O1 O31906 [0,0,0,1,0,1|2,0,0]=4 1450 B12R2.606 CC1=NC2=CC(O)=CC=C2O1 P51391 [0,0,0,1,0,1|1,0,0]=3 1451 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 P44528 [0,0,0,1,0,1|2,0,0]=4 1452 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 C-2304 [0,0,0,1,0,1|2,0,0]=4 1453 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 O30897 [0,0,0,1,0,1|2,0,0]=4 1454 B12R2.606 NC1=CC=C2OC(=O)NC2=C1 P41149 [0,0,0,1,0,1|1,0,0]=3 1455 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 L14009 [0,0,0,1,0,1|2,0,0]=4 1456 B12R2.606 NC1=NC2=CC(O)=CC=C2S1 L14162 [0,0,0,1,0,1|1,1,0]=4 1457 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 G-5187 [0,0,0,1,0,1|2,0,0]=4 1458 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 O30335 [0,0,0,1,0,1|1,0,0]=3 1459 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 C-3428 [0,0,0,1,0,1|2,0,0]=4 1460 B12R2.606 O=C1CC2=CC(Br)=CC=C2O1 H-8082 [0,0,0,1,0,1|1,0,0]=3 1461 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 E-3094 [0,0,0,1,0,1|2,0,0]=4 1462 B12R2.606 O=C1CC2=CC(O)=CN=C2N1 L14537 [0,0,0,1,0,1|2,0,0]=4 1463 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 A-639 [0,0,0,1,0,1|2,0,0]=4 1464 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 O30873 [0,0,0,1,0,1|2,0,0]=4 1465 B12R2.606 O=C1NC2=CC=C(O)C=C2N1 P38343 [0,0,0,1,0,1|1,0,0]=3 1466 B12R2.606 OC1=CC=C2N=C(Br)SC2=C1 O30115 [0,0,0,1,0,1|2,0,0]=4 1467 B12R2.606 OC1=CC=C2N=C(Cl)SC2=C1 P44634 [0,0,0,1,0,1|2,0,0]=4 1468 B12R2.132 CC1=CC2=C(C=C1)ON=C2Cl L19234 [0,1,0,1,0,0|2,0,0]=4 1469 B12R2.132 CC1=NNC2=C1C=C(O)C=C2 Q55686 [0,1,0,1,0,0|2,0,0]=4 1470 B12R2.132 ClC1=NOC2=CC=C(Br)C=C21 10619 [0,1,0,1,0,0|2,0,0]=4 1471 B12R2.132 NC1=CC2=C(C=C1)CNC2=O G-6420 [0,1,0,1,0,0|2,0,0]=4 1472 B12R2.132 NC1=CC2=C(C=C1)COC2=O P37328 [0,1,0,1,0,0|1,0,0]=3 1473 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 A-507 [0,1,0,1,0,0|2,0,0]=4 1474 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 I-9219 [0,1,0,1,0,0|2,0,0]=4 1475 B12R2.132 O=C1CCC2=C1C=C(I)C=C2 P41205 [0,1,0,1,0,0|2,0,0]=4 1476 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 A-509 [0,1,0,1,0,0|2,0,0]=4 1477 B12R2.132 O=C1COC2=CC=C(Br)C=C12 B-1771 [0,1,0,1,0,0|1,0,0]=3 1478 B12R2.132 O=C1COC2=CC=C(Cl)C=C12 B-1796 [0,1,0,1,0,0|1,0,0]=3 1479 B12R2.132 O=C1COC2=CC=C(F)C=C12 B-1139 [0,1,0,1,0,0|1,0,0]=3 1480 B12R2.132 O=C1NCC2=C1C=C(Br)C=C2 A-637 [0,1,0,1,0,0|2,0,0]=4 1481 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 O33569 [0,1,0,1,0,0|2,0,0]=4 1482 B12R2.132 O=C1NOC2=CC=C(Br)C=C12 M15623 [0,1,0,1,0,0|1,0,0]=3 1483 B12R2.132 O=C1OCC2=CC=C(I)C=C12 L18429 [0,1,0,1,0,0|1,0,0]=3 1484 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 L13741 [0,1,0,1,0,0|2,0,0]=4 1485 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 E-3117 [0,1,0,1,0,0|2,0,0]=4 1486 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 C-2426 [0,1,0,1,0,0|2,0,0]=4 1487 B12R2.196 O=C1CCC2=C1C=CC=C2F P36547 [0,1,0,1,0,0|2,0,0]=4 1488 B12R2.196 O=C1COC2=C(Br)C=CC=C12 L22354 [0,1,0,1,0,0|1,0,0]=3 1489 B12R2.196 O=C1COC2=C1C=CC=C2F S72794 [0,1,0,1,0,0|1,0,0]=3 1490 B12R2.196 O=C1CSC2=C(F)C=CC=C12 L19573 [0,1,0,1,0,0|1,1,0]=4 1491 B12R2.196 O=C1NCC2=C1C=CC=C2Br A-616 [0,1,0,1,0,0|2,0,0]=4 1492 B12R2.196 O=C1NCC2=C1C=CC=C2O A-651 [0,1,0,1,0,0|1,0,0]=3 1493 B12R2.196 O=C1OCC2=C1C=CC=C2Br P42977 [0,1,0,1,0,0|1,0,0]=3 1494 B12R2.196 OC1=NNC2=C1C=CC=C2F M15118 [0,1,0,1,0,0|2,0,0]=4 1495 B8R1.1 CC1=CC(C=O)=CS1 L14285 [1,0,0,0,1,0|2,0,0]=4 1496 B8R1.1 CC1=CSC(C=O)=C1 Q67410 [1,0,0,0,1,0|2,0,0]=4 1497 B8R1.1 O=CC1=CC(Cl)=CS1 O30331 [1,0,0,0,1,0|2,0,0]=4 1498 B8R1.1 O=CC1=CC(I)=CN1 O30775 [1,0,0,0,1,0|2,0,0]=4 1499 B8R1.1 O=CC1=CC=C(Cl)S1 G-5619 [1,0,0,0,1,0|2,0,0]=4 1500 B8R1.1 O=CC1=CSC(Br)=C1 L22211 [1,0,0,0,1,0|2,0,0]=4 1501 B8R1.1 O=CC1=CSC(Cl)=C1 G-5623 [1,0,0,0,1,0|2,0,0]=4 1502 B8R1.11 CC1=C(C=O)C=CS1 O30366 [1,0,0,0,1,0|2,0,0]=4 1503 B8R1.11 CC1=CSC=C1C=O L14435 [1,0,0,0,1,0|2,0,0]=4 1504 B8R1.11 O=CC1=C(Br)C=CS1 Q66577 [1,0,0,0,1,0|2,0,0]=4 1505 B8R1.11 O=CC1=CSC=C1Br Q67166 [1,0,0,0,1,0|2,0,0]=4 1506 B8R1.7 NC(=O)C1=CC=CN1 P38018 [1,0,0,0,1,0|2,0,0]=4 1507 B8R1.7 O=C(O)C1=CC=NS1 P51141 [1,0,0,0,1,0|2,0,0]=4 1508 B8R1.7 O=C(O)C1=CNN=C1 G-5584 [1,0,0,0,1,0|2,0,0]=4 1509 B8R1.7 O=C(O)C1=COC=N1 I-9284 [1,0,0,0,1,0|2,0,0]=4 1510 B8R1.7 O=C(O)C1=CSN=C1 L22423 [1,0,0,0,1,0|2,0,0]=4 1511 B8R1.7 O=C(O)C1=NC=CO1 F-4564 [1,0,0,0,1,0|2,0,0]=4 1512 B8R1.7 O=C(O)C1=NNC=C1 I-9172 [1,0,0,0,1,0|2,0,0]=4 1513 B8R1.7 O=C(O)C1=NSC=C1 O30998 [1,0,0,0,1,0|2,0,0]=4 1514 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [1,0,0,0,0,1|2,0,0]=4 1515 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [1,0,0,0,0,1|2,0,0]=4 1516 B10R1.18 O=C(O)CC1=CN=CN=C1 O33591 [1,0,0,0,0,1|2,0,0]=4 1517 B10R1.18 O=C(O)CC1=CN=NC=C1 G-5165 [1,0,0,0,0,1|2,0,0]=4 1518 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [1,0,0,0,0,1|2,0,0]=4 1519 B12R1.226 CC(=O)NCC1=CC=CC(Br)=C1 P38728 [0,0,0,0,0,2|2,0,0]=4 1520 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 P38460 [0,0,0,0,0,2|1,0,0]=3 1521 B12R1.226 CC1=CC(CCC(=O)O)=CC=N1 Q60479 [0,0,0,0,0,2|2,0,0]=4 1522 B12R1.226 CC1=CC(CCC(=O)O)=CN=C1 Q60486 [0,0,0,0,0,2|2,0,0]=4 1523 B12R1.226 CC1=CC(CCC(=O)O)=NC=C1 Q60480 [0,0,0,0,0,2|2,0,0]=4 1524 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 P40758 [0,0,0,0,0,2|1,0,0]=3 1525 B12R1.226 CC1=NC(CCC(=O)O)=CC=C1 Q60488 [0,0,0,0,0,2|2,0,0]=4 1526 B12R1.226 CC1=NC(\C=C\C(=O)O)=CC=C1 Q60610 [0,0,0,0,0,2|2,0,0]=4 1527 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 P37053 [0,0,0,0,0,2|2,0,0]=4 1528 B12R1.226 NC1=NC=CC(CCC(=O)O)=C1 O29533 [0,0,0,0,0,2|2,0,0]=4 1529 B12R1.226 O=C(O)CCC1=CC(F)=CN=C1 Q60660 [0,0,0,0,0,2|2,0,0]=4 1530 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 P38005 [0,0,0,0,0,2|1,0,0]=3 1531 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 P36632 [0,0,0,0,0,2|1,0,0]=3 1532 B12R1.226 O=C(O)CCC1=NC=CC(F)=C1 Q60481 [0,0,0,0,0,2|2,0,0]=4 1533 B12R1.226 O=C(O)CNC1=CC=CC(Br)=C1 P38138 [0,0,0,0,0,2|1,0,0]=3 1534 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 O28084 [0,0,0,0,0,2|1,0,0]=3 1535 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 P38226 [0,0,0,0,0,2|1,0,0]=3 1536 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 P50423 [0,0,0,0,0,2|1,0,0]=3