0 B7R1.2 BrC1=CC(Br)=CS1 AC130134 [0,0,0,0,0,0|4,0,0]=4 1 B7R1.2 BrC1=CC=C(Br)O1 AC060039 [0,0,0,0,0,0|3,1,0]=4 2 B7R1.2 BrC1=CC=C(Br)S1 AC130347 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.2 BrC1=CN=C(Br)S1 AC160437 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.2 BrC1=NC(Br)=CS1 AC160436 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.2 BrC1=NC(Br)=NN1 AC512088 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.2 C1=C(Br)SC(=N1)Br LN00007308 [0,0,0,0,0,0|2,0,0]=2 7 B7R1.2 C1=C(Cl)N=C(Br)S1 LN02041931 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.2 CC1=CC(=CS1)Br LN00009283 [0,0,0,0,0,0|3,0,0]=3 9 B7R1.2 CC1=CC(=NN1)Br LN00003238 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.2 CC1=CC(Br)=CS1 AC181846 [0,0,0,0,0,0|3,0,0]=3 11 B7R1.2 CC1=CC(Br)=NO1 AC512084 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.2 CC1=CC(N)=NN1 AC180618 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.2 CC1=CN=C(C)N1 LN00227182 [0,0,0,0,0,0|1,0,0]=1 14 B7R1.2 CC1=CN=C(C)S1 AC180738 [0,0,0,0,0,0|0,0,0]=0 15 B7R1.2 CC1=CN=C(Cl)S1 AC050511 [0,0,0,0,0,0|1,0,0]=1 16 B7R1.2 CC1=CNC(Br)=N1 AC512184 [0,0,0,0,0,0|2,0,1]=3 17 B7R1.2 CC1=CSC(Br)=N1 AC182309 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.2 CC1=CSC(N)=N1 AC511057 [0,0,0,0,0,0|3,0,0]=3 19 B7R1.2 CC1=NC(I)=CN1 AC050638 [0,0,0,0,0,0|2,0,1]=3 20 B7R1.2 CC1=NN=C(C1)O LN00175250 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.2 CC1=NOC(N)=C1 AC020889 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.2 CC1=NSC(N)=C1 AC021204 [0,0,0,0,0,0|3,0,0]=3 23 B7R1.2 CN1C=C(Br)C=N1 AC181436 [0,0,0,0,0,0|3,0,0]=3 24 B7R1.2 CN1C=C(Br)N=N1 AC511208 [0,0,0,0,0,0|4,0,0]=4 25 B7R1.2 CN1C=C(Cl)C=N1 AC182254 [0,0,0,0,0,0|3,0,0]=3 26 B7R1.2 CN1C=C(I)C=N1 AC190232 [0,0,0,0,0,0|3,0,0]=3 27 B7R1.2 CN1C=C(N)C=N1 AC182141 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.2 CN1C=CC(Br)=N1 AC040176 [0,0,0,0,0,0|4,0,0]=4 29 B7R1.2 CN1C=CC(C)=N1 AC180405 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.2 CN1C=CC(Cl)=N1 AC040111 [0,0,0,0,0,0|4,0,0]=4 31 B7R1.2 CN1C=CC(I)=N1 AC040177 [0,0,0,0,0,0|4,0,0]=4 32 B7R1.2 CN1C=CC(N)=N1 AC021051 [0,0,0,0,0,0|4,0,0]=4 33 B7R1.2 CN1C=CC(O)=N1 AC511151 [0,0,0,0,0,0|4,0,0]=4 34 B7R1.2 CN1C=NC(Br)=C1 AC190153 [0,0,0,0,0,0|3,0,0]=3 35 B7R1.2 CN1C=NC(Br)=N1 AC511737 [0,0,0,0,0,0|3,0,0]=3 36 B7R1.2 CN1C=NC(I)=C1 AC190084 [0,0,0,0,0,0|3,0,0]=3 37 B7R1.2 CN1N=CC(N)=N1 AC190148 [0,0,0,0,0,0|3,0,0]=3 38 B7R1.2 ClC1=NC(Cl)=NS1 AC030159 [0,0,0,0,0,0|4,0,0]=4 39 B7R1.2 NC1=CC(Br)=NN1 AC020090 [0,0,0,0,0,0|4,0,0]=4 40 B7R1.2 NC1=CSC(Br)=N1 AC051131 [0,0,0,0,0,0|4,0,0]=4 41 B7R1.2 NC1=NC(Br)=CS1 AC511046 [0,0,0,0,0,0|4,0,0]=4 42 B7R1.2 NC1=NC=C(Br)S1 AC130290 [0,0,0,0,0,0|2,0,0]=2 43 B7R1.2 NC1=NC=C(Br)S1 AC130291 [0,0,0,0,0,0|2,0,0]=2 44 B7R1.2 NC1=NN=C(Br)S1 AC510742 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.2 O=C1NC(=O)C=C1 AC500013 [0,0,0,0,0,0|4,0,0]=4 46 B6R1.2 BrC1=CN=CS1 AC130295 [1,0,0,0,0,0|1,0,0]=2 47 B6R1.2 BrC1=CNC=N1 AC180482 [1,0,0,0,0,0|2,0,1]=4 48 B6R1.2 BrC1=CNN=C1 AC500255 [1,0,0,0,0,0|3,0,0]=4 49 B6R1.2 BrC1=COC=C1 AC130126 [1,0,0,0,0,0|3,0,0]=4 50 B6R1.2 BrC1=CSC=C1 AC510982 [1,0,0,0,0,0|3,0,0]=4 51 B6R1.2 BrC1=CSC=N1 AC130293 [1,0,0,0,0,0|3,0,0]=4 52 B6R1.2 BrC1=NC=CN1 AC500229 [1,0,0,0,0,0|2,0,0]=3 53 B6R1.2 BrC1=NC=CS1 AC130296 [1,0,0,0,0,0|1,0,0]=2 54 B6R1.2 BrC1=NNC=C1 AC181278 [1,0,0,0,0,0|3,0,0]=4 55 B6R1.2 BrC1=NNC=N1 AC511086 [1,0,0,0,0,0|3,0,0]=4 56 B6R1.2 C1=C(Br)NN=C1 LN00003049 [1,0,0,0,0,0|3,0,0]=4 57 B6R1.2 C1=C(C=NN1)I LN00008748 [1,0,0,0,0,0|3,0,0]=4 58 B6R1.2 C1=CNC(=N)N1 LN00226716 [1,0,0,0,0,0|2,0,1]=4 59 B6R1.2 C1=CON=C1Br LN00190967 [1,0,0,0,0,0|3,0,0]=4 60 B6R1.2 C1=CSC(=N1)Br LN00004618 [1,0,0,0,0,0|1,0,0]=2 61 B6R1.2 C1=CSC=C1I LN00177299 [1,0,0,0,0,0|3,0,0]=4 62 B6R1.2 C1=NC(=N)SN1 LN00130816 [1,0,0,0,0,0|2,0,0]=3 63 B6R1.2 C1=NNN=C1Br LN00003191 [1,0,0,0,0,0|3,0,0]=4 64 B6R1.2 C1=NSC(=N1)Br LN00175159 [1,0,0,0,0,0|2,0,0]=3 65 B6R1.2 C1=NSC=C1Br LN00183425 [1,0,0,0,0,0|3,0,0]=4 66 B6R1.2 CC1=CCCC1 AC220188 [1,0,0,0,0,0|2,0,1]=4 67 B6R1.2 CC1=CN=CN1 AC190147 [1,0,0,0,0,0|1,0,0]=2 68 B6R1.2 CC1=CN=CS1 AC510736 [1,0,0,0,0,0|0,0,0]=1 69 B6R1.2 CC1=CNN=C1 AC130170 [1,0,0,0,0,0|2,0,0]=3 70 B6R1.2 CC1=CNN=C1 HY-B0876 [1,0,0,0,0,0|2,0,0]=3 71 B6R1.2 CC1=CSC=N1 AC130333 [1,0,0,0,0,0|2,0,0]=3 72 B6R1.2 CC1=NC=CS1 AC180527 [1,0,0,0,0,0|0,0,0]=1 73 B6R1.2 CC1=NNC=C1 AC130325 [1,0,0,0,0,0|2,0,0]=3 74 B6R1.2 CC1=NNC=N1 AC021370 [1,0,0,0,0,0|2,0,0]=3 75 B6R1.2 CN1C=CC=C1 AC130318 [1,0,0,0,0,0|3,0,0]=4 76 B6R1.2 CN1C=CN=C1 AC130869 [1,0,0,0,0,0|2,0,0]=3 77 B6R1.2 CN1C=CN=N1 LN00159495 [1,0,0,0,0,0|3,0,0]=4 78 B6R1.2 CN1C=NC=N1 AC130334 [1,0,0,0,0,0|2,0,0]=3 79 B6R1.2 CN1C=NC=N1 LN00004617 [1,0,0,0,0,0|2,0,0]=3 80 B6R1.2 ClC1=CNN=C1 AC180803 [1,0,0,0,0,0|3,0,0]=4 81 B6R1.2 ClC1=NC=CS1 AC180884 [1,0,0,0,0,0|1,0,0]=2 82 B6R1.2 ClC1=NC=NS1 AC512114 [1,0,0,0,0,0|2,0,0]=3 83 B6R1.2 IC1=CC=CS1 AC510730 [1,0,0,0,0,0|2,0,0]=3 84 B6R1.2 IC1=CN=CN1 AC181272 [1,0,0,0,0,0|2,0,0]=3 85 B6R1.2 IC1=NNC=C1 AC040037 [1,0,0,0,0,0|3,0,0]=4 86 B6R1.2 NC1=CNN=C1 AC511640 [1,0,0,0,0,0|3,0,0]=4 87 B6R1.2 NC1=CSC=C1 AC010284 [1,0,0,0,0,0|3,0,0]=4 88 B6R1.2 NC1=NC=CN1 AC180296 [1,0,0,0,0,0|2,0,0]=3 89 B6R1.2 NC1=NC=CO1 AC182080 [1,0,0,0,0,0|1,1,0]=3 90 B6R1.2 NC1=NC=CS1 HY-12396 [1,0,0,0,0,0|1,0,0]=2 91 B6R1.2 NC1=NC=NS1 AC182784 [1,0,0,0,0,0|2,0,0]=3 92 B6R1.2 NC1=NN=CS1 AC512158 [1,0,0,0,0,0|2,0,0]=3 93 B6R1.2 NC1=NNC=C1 AC130171 [1,0,0,0,0,0|3,0,0]=4 94 B6R1.2 O=C1CC=NN1 AC250038 [1,0,0,0,0,0|3,0,0]=4 95 B6R1.2 O=C1NC=CN1 AC180428 [1,0,0,0,0,0|2,0,1]=4 96 B6R1.2 OC1=CC=NN1 AC200038 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.1 BrC1=NC=C(S1)C=O AC510784 [0,1,0,0,0,0|1,0,1]=3 98 B8R1.1 C(C1=NC(=CS1)Br)N LN02041216 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.1 C1=C(C=O)SC(=C1)Br LN00009990 [0,1,0,0,0,0|2,0,1]=4 100 B8R1.1 CC1=CC(=NN1)C#N AC511986 [0,1,0,0,0,0|2,0,1]=4 101 B8R1.1 CC1=CC=C(S1)C=O AC511283 [0,1,0,0,0,0|1,0,1]=3 102 B8R1.1 CC1=CN=C(CO)S1 AC512131 [0,1,0,0,0,0|0,0,0]=1 103 B8R1.1 CC1=CN=C(S1)C=O AC182206 [0,1,0,0,0,0|0,0,1]=2 104 B8R1.1 CC1=CSC(=N1)C=O LN00003611 [0,1,0,0,0,0|2,0,1]=4 105 B8R1.1 CC1=NC(=CO1)C=O LN00169165 [0,1,0,0,0,0|2,0,1]=4 106 B8R1.1 CC1=NC(C=O)=CS1 AC181975 [0,1,0,0,0,0|2,0,1]=4 107 B8R1.1 CC1=NN=C(CCl)S1 AC021632 [0,1,0,0,0,0|1,0,0]=2 108 B8R1.1 CC1=NOC(CN)=C1 AC320008 [0,1,0,0,0,0|2,0,0]=3 109 B8R1.1 CC1=NOC(CN)=N1 AC200026 [0,1,0,0,0,0|2,0,0]=3 110 B8R1.1 CCC1=NOC(=C1)N LN00337016 [0,1,0,0,0,0|3,0,0]=4 111 B8R1.1 CCN1C=C(Br)C=N1 AC182237 [0,1,0,0,0,0|3,0,0]=4 112 B8R1.1 CN1C=C(C=N1)C#N AC512161 [0,1,0,0,0,0|2,0,1]=4 113 B8R1.1 CN1C=C(C=O)C=N1 AC511623 [0,1,0,0,0,0|2,0,1]=4 114 B8R1.1 COC1=CC(N)=NO1 AC182433 [0,1,0,0,0,0|3,0,0]=4 115 B8R1.1 COC1=NC(Br)=CS1 AC160355 [0,1,0,0,0,0|3,0,0]=4 116 B8R1.1 COC1=NC=C(Br)S1 AC160442 [0,1,0,0,0,0|1,0,0]=2 117 B8R1.1 CSC1=NC(=CS1)Br LN00169678 [0,1,0,0,0,0|3,0,0]=4 118 B8R1.1 ClC1=CC=C(S1)C=O AC180483 [0,1,0,0,0,0|2,0,1]=4 119 B8R1.1 ClC1=NC=C(S1)C=O AC100127 [0,1,0,0,0,0|1,0,1]=3 120 B8R1.1 ClCC1=CN=C(Cl)S1 AC181168 [0,1,0,0,0,0|1,0,0]=2 121 B8R1.1 ClCC1=NNC(=O)N1 AC360025 [0,1,0,0,0,0|3,0,0]=4 122 B8R1.1 NCC1=CC=C(Br)S1 AC070057 [0,1,0,0,0,0|2,0,0]=3 123 B8R1.1 NCC1=NC(Br)=CS1 AC010235 [0,1,0,0,0,0|3,0,0]=4 124 B8R1.1 NCC1=NC(Br)=CS1 AC050165 [0,1,0,0,0,0|3,0,0]=4 125 B8R1.1 OCC1=CC=C(F)S1 AC050155 [0,1,0,0,0,0|2,0,0]=3 126 B8R1.1 OCC1=NC(Br)=CS1 AC050164 [0,1,0,0,0,0|3,0,0]=4 127 B8R1.18 BrC1=NC(Br)=C(Br)N1 AC180087 [0,1,0,0,0,0|3,0,0]=4 128 B8R1.18 CC1=C(Br)N=C(N)S1 AC050997 [0,1,0,0,0,0|1,0,0]=2 129 B8R1.18 CC1=C(Br)NC(Br)=N1 AC181433 [0,1,0,0,0,0|2,0,1]=4 130 B8R1.18 CC1=C(Br)SC(Br)=C1 AC130248 [0,1,0,0,0,0|3,0,0]=4 131 B8R1.18 CC1=C(C)N=C(N)S1 AC180280 [0,1,0,0,0,0|1,0,0]=2 132 B8R1.18 CC1=C(C)N=C(N)S1 AC360032 [0,1,0,0,0,0|1,0,0]=2 133 B8R1.18 CC1=C(Cl)SC(Cl)=C1 AC130300 [0,1,0,0,0,0|3,0,0]=4 134 B8R1.18 CN1C=C(Br)N=C1Br AC010422 [0,1,0,0,0,0|3,0,0]=4 135 B8R1.18 CN1C=C(N)C(Cl)=N1 AC020192 [0,1,0,0,0,0|3,0,0]=4 136 B8R1.18 CN1CC(=O)N=C1N HY-B0504 [0,1,0,0,0,0|3,0,0]=4 137 B8R1.18 CN1N=C(Br)C=C1C AC511912 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.18 IC1=NC(I)=C(I)N1 AC200116 [0,1,0,0,0,0|3,0,0]=4 139 B8R1.50 CC1=C(C)C(N)=NO1 AC181619 [0,1,0,0,0,0|3,0,0]=4 140 B8R1.50 CC1=NNC(C)=C1Br AC511668 [0,1,0,0,0,0|2,0,0]=3 141 B8R1.50 CC1=NNC(C)=C1I AC180426 [0,1,0,0,0,0|2,0,0]=3 142 B8R1.50 CC1=NOC(=C1Br)C LN00183856 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.50 CC1=NOC(N)=C1Br AC051039 [0,1,0,0,0,0|3,0,0]=4 144 B8R1.50 CC1=NOC(N)=C1Cl AC020803 [0,1,0,0,0,0|3,0,0]=4 145 B8R1.50 CN1C=NC(Br)=C1Br AC010423 [0,1,0,0,0,0|3,0,0]=4 146 B8R1.3 BrC1=CN=C(Br)C=C1 AC180142 [0,0,0,0,0,1|3,0,0]=4 147 B8R1.3 BrC1=CN=C(Br)C=N1 AC182208 [0,0,0,0,0,1|3,0,0]=4 148 B8R1.3 BrC1=CN=C(Br)N=C1 AC182256 [0,0,0,0,0,1|3,0,0]=4 149 B8R1.3 BrC1=CN=C(I)C=C1 AC181090 [0,0,0,0,0,1|3,0,0]=4 150 B8R1.3 BrC1=CN=C(I)N=C1 AC181212 [0,0,0,0,0,1|3,0,0]=4 151 B8R1.3 BrC1=CNC(=O)N=C1 AC180917 [0,0,0,0,0,1|3,0,0]=4 152 B8R1.3 BrC1=NC=C(I)C=C1 AC181587 [0,0,0,0,0,1|3,0,0]=4 153 B8R1.3 C1=C(Br)N=CC(=N1)Br LN00010056 [0,0,0,0,0,1|3,0,0]=4 154 B8R1.3 C1=C(C=NC(=N1)F)Br LN00137103 [0,0,0,0,0,1|3,0,0]=4 155 B8R1.3 C1=CC(=NC=C1F)Br LN00009037 [0,0,0,0,0,1|3,0,0]=4 156 B8R1.3 C1=CC(=NC=C1I)O LN00124595 [0,0,0,0,0,1|3,0,0]=4 157 B8R1.3 C1=CC(=NC=C1N)Cl LN00008750 [0,0,0,0,0,1|3,0,0]=4 158 B8R1.3 C1=CC(=NC=C1N)F LN00120919 [0,0,0,0,0,1|3,0,0]=4 159 B8R1.3 C1=CC(=NC=C1N)O LN00008570 [0,0,0,0,0,1|3,0,0]=4 160 B8R1.3 C1=CC(=NC=C1O)Br LN00007949 [0,0,0,0,0,1|3,0,0]=4 161 B8R1.3 CC1=CC=C(Cl)N=N1 AC160040 [0,0,0,0,0,1|3,0,0]=4 162 B8R1.3 CC1=CC=C(I)C=C1 AC510888 [0,0,0,0,0,1|3,0,0]=4 163 B8R1.3 CC1=CC=C(O)C=C1 HY-B0969 [0,0,0,0,0,1|3,0,0]=4 164 B8R1.3 CC1=CC=C(O)C=N1 AC511040 [0,0,0,0,0,1|2,0,0]=3 165 B8R1.3 CC1=CN=C(Br)C=C1 AC500069 [0,0,0,0,0,1|2,0,0]=3 166 B8R1.3 CC1=CN=C(Br)N=C1 AC511900 [0,0,0,0,0,1|2,0,0]=3 167 B8R1.3 CC1=CN=C(Cl)C=C1 AC511572 [0,0,0,0,0,1|2,0,0]=3 168 B8R1.3 CC1=CN=C(Cl)C=N1 AC510859 [0,0,0,0,0,1|2,0,0]=3 169 B8R1.3 CC1=CN=C(Cl)N=C1 AC182402 [0,0,0,0,0,1|2,0,0]=3 170 B8R1.3 CC1=CN=C(F)C=C1 AC510699 [0,0,0,0,0,1|2,0,0]=3 171 B8R1.3 CC1=CN=C(N)C=C1 AC180158 [0,0,0,0,0,1|2,0,0]=3 172 B8R1.3 CC1=CN=C(N)C=N1 AC182280 [0,0,0,0,0,1|2,0,0]=3 173 B8R1.3 CC1=CNC(=O)C=C1 LN00005245 [0,0,0,0,0,1|2,0,1]=4 174 B8R1.3 CC1=NC=C(Br)C=N1 AC511167 [0,0,0,0,0,1|2,0,0]=3 175 B8R1.3 CC1=NC=C(C=C1)Br LN00129792 [0,0,0,0,0,1|2,0,0]=3 176 B8R1.3 CC1=NC=C(Cl)C=N1 AC040054 [0,0,0,0,0,1|2,0,0]=3 177 B8R1.3 CC1=NC=C(O)C=N1 AC511982 [0,0,0,0,0,1|2,0,0]=3 178 B8R1.3 CC1=NN=C(N)C=C1 AC181256 [0,0,0,0,0,1|3,0,0]=4 179 B8R1.3 CC1=NNC(=O)C=C1 AC180424 [0,0,0,0,0,1|3,0,0]=4 180 B8R1.3 ClC1=CN=C(Br)C=C1 AC180923 [0,0,0,0,0,1|3,0,0]=4 181 B8R1.3 ClC1=CN=C(Br)C=N1 AC511896 [0,0,0,0,0,1|3,0,0]=4 182 B8R1.3 ClC1=CN=C(Cl)N=C1 AC020197 [0,0,0,0,0,1|3,0,0]=4 183 B8R1.3 ClC1=CN=C(I)N=C1 AC182215 [0,0,0,0,0,1|3,0,0]=4 184 B8R1.3 ClC1=NC=C(Br)C=C1 AC181223 [0,0,0,0,0,1|3,0,0]=4 185 B8R1.3 ClC1=NC=C(Br)C=N1 AC181040 [0,0,0,0,0,1|3,0,0]=4 186 B8R1.3 ClC1=NC=C(I)C=C1 AC181366 [0,0,0,0,0,1|3,0,0]=4 187 B8R1.3 ClC1=NC=C(I)C=N1 AC220159 [0,0,0,0,0,1|3,0,0]=4 188 B8R1.3 FC1=CC=C(F)N=C1 AC181803 [0,0,0,0,0,1|3,0,0]=4 189 B8R1.3 FC1=CN=C(Br)C=C1 AC510763 [0,0,0,0,0,1|3,0,0]=4 190 B8R1.3 FC1=CN=C(Br)N=C1 AC020971 [0,0,0,0,0,1|3,0,0]=4 191 B8R1.3 FC1=CN=C(Cl)C=C1 AC510723 [0,0,0,0,0,1|3,0,0]=4 192 B8R1.3 FC1=CN=C(Cl)N=C1 AC181698 [0,0,0,0,0,1|3,0,0]=4 193 B8R1.3 FC1=NC=C(Br)C=C1 AC181369 [0,0,0,0,0,1|3,0,0]=4 194 B8R1.3 FC1=NC=C(I)C=C1 AC500230 [0,0,0,0,0,1|3,0,0]=4 195 B8R1.3 NC1=CC=C(Br)N=C1 AC511492 [0,0,0,0,0,1|3,0,0]=4 196 B8R1.3 NC1=CC=C(Cl)N=C1 AC510819 [0,0,0,0,0,1|3,0,0]=4 197 B8R1.3 NC1=CC=C(F)N=C1 AC181270 [0,0,0,0,0,1|3,0,0]=4 198 B8R1.3 NC1=NC=C(Br)C=C1 AC180157 [0,0,0,0,0,1|3,0,0]=4 199 B8R1.3 NC1=NC=C(Br)C=N1 AC180276 [0,0,0,0,0,1|3,0,0]=4 200 B8R1.3 NC1=NC=C(Cl)C=C1 AC500167 [0,0,0,0,0,1|3,0,0]=4 201 B8R1.3 NC1=NC=C(Cl)C=N1 AC510830 [0,0,0,0,0,1|3,0,0]=4 202 B8R1.3 NC1=NC=C(I)C=C1 AC511594 [0,0,0,0,0,1|3,0,0]=4 203 B8R1.3 NC1=NC=C(I)N=C1 AC182518 [0,0,0,0,0,1|3,0,0]=4 204 B8R1.3 OC1=CC=C(Br)N=C1 AC181802 [0,0,0,0,0,1|3,0,0]=4 205 B8R1.3 OC1=CC=C(Cl)N=C1 AC130205 [0,0,0,0,0,1|3,0,0]=4 206 B8R1.3 OC1=CN=C(Br)C=N1 AC181950 [0,0,0,0,0,1|3,0,0]=4 207 B8R1.3 OC1=CN=C(Cl)N=C1 AC500090 [0,0,0,0,0,1|3,0,0]=4 208 B8R1.3 OC1=NC=C(Br)C=C1 AC180928 [0,0,0,0,0,1|3,0,0]=4 209 B8R1.4 BrC1=CC(Br)=NC=C1 AC181322 [0,0,0,0,0,1|3,0,0]=4 210 B8R1.4 BrC1=CN=CC(Br)=N1 AC182478 [0,0,0,0,0,1|3,0,0]=4 211 B8R1.4 C1=C(C=NC=C1N)F LN00009794 [0,0,0,0,0,1|3,0,0]=4 212 B8R1.4 C1=CN=C(C=C1Br)Cl LN00007826 [0,0,0,0,0,1|3,0,0]=4 213 B8R1.4 C1=CN=C(C=C1Cl)Br LN00170028 [0,0,0,0,0,1|3,0,0]=4 214 B8R1.4 CC1=CC(=CN=C1)Br LN00008870 [0,0,0,0,0,1|2,0,0]=3 215 B8R1.4 CC1=CC(=O)NC=N1 AC170050 [0,0,0,0,0,1|2,0,0]=3 216 B8R1.4 CC1=CC(=O)NN=C1 AC050579 [0,0,0,0,0,1|2,0,0]=3 217 B8R1.4 CC1=CC(Br)=NC=C1 AC510792 [0,0,0,0,0,1|2,0,0]=3 218 B8R1.4 CC1=CC(C)=NC=N1 AC180136 [0,0,0,0,0,1|1,0,0]=2 219 B8R1.4 CC1=CC(F)=NC=C1 AC511705 [0,0,0,0,0,1|2,0,0]=3 220 B8R1.4 CC1=CC(N)=NC=C1 AC190055 [0,0,0,0,0,1|2,0,0]=3 221 B8R1.4 CC1=CC=CC(F)=N1 AC511694 [0,0,0,0,0,1|3,0,0]=4 222 B8R1.4 CC1=CC=CC(N)=N1 AC500239 [0,0,0,0,0,1|3,0,0]=4 223 B8R1.4 CC1=CC=NC(Cl)=N1 AC180532 [0,0,0,0,0,1|2,0,0]=3 224 B8R1.4 CC1=CN=CC(Br)=C1 AC181288 [0,0,0,0,0,1|2,0,0]=3 225 B8R1.4 CC1=CN=CC(Br)=N1 AC511942 [0,0,0,0,0,1|2,0,0]=3 226 B8R1.4 CC1=CN=CC(Cl)=N1 AC030143 [0,0,0,0,0,1|2,0,0]=3 227 B8R1.4 CC1=CN=CC(N)=C1 AC181783 [0,0,0,0,0,1|2,0,0]=3 228 B8R1.4 CC1=CN=CC(N)=N1 AC511922 [0,0,0,0,0,1|2,0,0]=3 229 B8R1.4 CC1=CN=CC(O)=N1 AC182347 [0,0,0,0,0,1|2,0,0]=3 230 B8R1.4 CC1=NC(Br)=CC=C1 AC180435 [0,0,0,0,0,1|3,0,0]=4 231 B8R1.4 CC1=NC(Cl)=CC=C1 AC180145 [0,0,0,0,0,1|3,0,0]=4 232 B8R1.4 CC1=NC=CC(Br)=C1 AC500262 [0,0,0,0,0,1|2,0,0]=3 233 B8R1.4 CC1=NC=CC(Cl)=C1 AC500323 [0,0,0,0,0,1|2,0,0]=3 234 B8R1.4 CC1=NC=CC(F)=C1 AC511870 [0,0,0,0,0,1|2,0,0]=3 235 B8R1.4 CC1=NC=CC(N)=C1 AC180846 [0,0,0,0,0,1|2,0,0]=3 236 B8R1.4 CC1=NC=NC(Cl)=C1 AC181467 [0,0,0,0,0,1|2,0,0]=3 237 B8R1.4 CC1=NC=NC(N)=C1 AC180849 [0,0,0,0,0,1|2,0,0]=3 238 B8R1.4 ClC1=CC(=O)N=CN1 AC180918 [0,0,0,0,0,1|3,0,0]=4 239 B8R1.4 ClC1=CC(=O)NN=C1 AC182692 [0,0,0,0,0,1|3,0,0]=4 240 B8R1.4 ClC1=CC(Cl)=NC=C1 AC130945 [0,0,0,0,0,1|3,0,0]=4 241 B8R1.4 ClC1=CC(Cl)=NC=N1 AC500182 [0,0,0,0,0,1|3,0,0]=4 242 B8R1.4 ClC1=CC(Cl)=NN=C1 AC182577 [0,0,0,0,0,1|3,0,0]=4 243 B8R1.4 ClC1=CC=NC(Br)=C1 AC181743 [0,0,0,0,0,1|3,0,0]=4 244 B8R1.4 ClC1=CN=CC(Br)=C1 AC181808 [0,0,0,0,0,1|3,0,0]=4 245 B8R1.4 ClC1=NC(Cl)=NC=C1 AC021699 [0,0,0,0,0,1|3,0,0]=4 246 B8R1.4 ClC1=NC=CC(Br)=C1 AC181742 [0,0,0,0,0,1|3,0,0]=4 247 B8R1.4 ClC1=NC=CC(Br)=N1 AC050694 [0,0,0,0,0,1|3,0,0]=4 248 B8R1.4 ClC1=NC=CC(I)=C1 AC181346 [0,0,0,0,0,1|3,0,0]=4 249 B8R1.4 ClC1=NC=CC(I)=N1 AC051162 [0,0,0,0,0,1|3,0,0]=4 250 B8R1.4 FC1=CC(Br)=NC=C1 AC182403 [0,0,0,0,0,1|3,0,0]=4 251 B8R1.4 FC1=CC(F)=CN=C1 AC130331 [0,0,0,0,0,1|3,0,0]=4 252 B8R1.4 FC1=CC(F)=NC=C1 AC511673 [0,0,0,0,0,1|3,0,0]=4 253 B8R1.4 FC1=CC=NC(Cl)=C1 AC511674 [0,0,0,0,0,1|3,0,0]=4 254 B8R1.4 FC1=CN=CC(Br)=C1 AC130339 [0,0,0,0,0,1|3,0,0]=4 255 B8R1.4 FC1=NC=CC(Br)=C1 AC181781 [0,0,0,0,0,1|3,0,0]=4 256 B8R1.4 FC1=NC=CC(I)=C1 AC511608 [0,0,0,0,0,1|3,0,0]=4 257 B8R1.4 IC1=CC(=O)NN=C1 AC512086 [0,0,0,0,0,1|3,0,0]=4 258 B8R1.4 IC1=CN=CC(I)=N1 AC182421 [0,0,0,0,0,1|3,0,0]=4 259 B8R1.4 NC1=CC(=O)N=CN1 AC180501 [0,0,0,0,0,1|3,0,0]=4 260 B8R1.4 NC1=CC(Br)=CC=N1 AC181286 [0,0,0,0,0,1|3,0,0]=4 261 B8R1.4 NC1=CC(Br)=CN=C1 AC181279 [0,0,0,0,0,1|3,0,0]=4 262 B8R1.4 NC1=CC(Br)=NC=C1 AC500084 [0,0,0,0,0,1|3,0,0]=4 263 B8R1.4 NC1=CC(Cl)=CN=C1 AC181695 [0,0,0,0,0,1|3,0,0]=4 264 B8R1.4 NC1=CC(Cl)=NC=C1 AC130302 [0,0,0,0,0,1|3,0,0]=4 265 B8R1.4 NC1=CC(Cl)=NN=C1 AC512083 [0,0,0,0,0,1|3,0,0]=4 266 B8R1.4 NC1=CC(F)=NC=C1 AC510679 [0,0,0,0,0,1|3,0,0]=4 267 B8R1.4 NC1=CC(N)=CN=C1 AC511967 [0,0,0,0,0,1|3,0,0]=4 268 B8R1.4 NC1=CC(N)=NC=C1 AC511205 [0,0,0,0,0,1|3,0,0]=4 269 B8R1.4 NC1=CC(O)=CN=C1 AC182434 [0,0,0,0,0,1|3,0,0]=4 270 B8R1.4 NC1=CN=CC(Cl)=N1 AC180534 [0,0,0,0,0,1|3,0,0]=4 271 B8R1.4 NC1=NC(Br)=CN=C1 AC511206 [0,0,0,0,0,1|3,0,0]=4 272 B8R1.4 NC1=NC(Cl)=NC=C1 AC190260 [0,0,0,0,0,1|3,0,0]=4 273 B8R1.4 NC1=NC(N)=NC=C1 AC511891 [0,0,0,0,0,1|3,0,0]=4 274 B8R1.4 NC1=NC=CC(Cl)=C1 AC500248 [0,0,0,0,0,1|3,0,0]=4 275 B8R1.4 NC1=NC=CC(Cl)=N1 AC180410 [0,0,0,0,0,1|3,0,0]=4 276 B8R1.4 NC1=NC=CC(F)=C1 AC511214 [0,0,0,0,0,1|3,0,0]=4 277 B8R1.4 NC1=NC=CC(O)=C1 AC181799 [0,0,0,0,0,1|3,0,0]=4 278 B8R1.4 NC1=NC=NC(Br)=C1 AC180919 [0,0,0,0,0,1|3,0,0]=4 279 B8R1.4 NC1=NC=NC(Cl)=C1 AC170083 [0,0,0,0,0,1|3,0,0]=4 280 B8R1.4 OC1=CC(O)=CN=C1 AC181325 [0,0,0,0,0,1|3,0,0]=4 281 B8R1.4 OC1=CC=NC(Cl)=C1 AC130253 [0,0,0,0,0,1|3,0,0]=4 282 B8R1.4 OC1=CN=CC(Br)=C1 AC510948 [0,0,0,0,0,1|3,0,0]=4 283 B8R1.4 OC1=CN=CC(F)=C1 AC181586 [0,0,0,0,0,1|3,0,0]=4 284 B8R1.4 OC1=NC(Cl)=CN=C1 AC180873 [0,0,0,0,0,1|3,0,0]=4 285 B5R0.1 CCOC(C)=N AC510695 [1,0,1,0,0,0|0,1,1]=4 286 B5R1.1 N1C=CC=N1 AC130500 [2,0,0,0,0,0|2,0,0]=4 287 B5R1.1 N1C=CN=C1 HY-D0837 [2,0,0,0,0,0|1,0,0]=3 288 B5R1.1 N1C=CN=N1 AC180307 [2,0,0,0,0,0|2,0,0]=4 289 B5R1.1 N1C=NC=N1 AC130258 [2,0,0,0,0,0|2,0,0]=4 290 B5R1.1 S1C=CC=N1 AC050496 [2,0,0,0,0,0|2,0,0]=4 291 B5R1.1 S1C=CN=C1 AC130315 [2,0,0,0,0,0|0,0,0]=2 292 B7R1.1 BrCC1=CC=NO1 AC050627 [1,1,0,0,0,0|2,0,0]=4 293 B7R1.1 C#CC1=CC=CS1 LN00184075 [1,1,0,0,0,0|1,0,1]=4 294 B7R1.1 C(C1=NC=NN1)O LN02218391 [1,1,0,0,0,0|2,0,0]=4 295 B7R1.1 C1=CC=C([CH-]1)CO LN02135120 [1,1,0,0,0,0|2,0,0]=4 296 B7R1.1 C1=CON=C1CN LN00111972 [1,1,0,0,0,0|2,0,0]=4 297 B7R1.1 C=CC1=NC=CN1 AC280004 [1,1,0,0,0,0|1,0,1]=4 298 B7R1.1 CCN1C=NC=N1 LN00184923 [1,1,0,0,0,0|2,0,0]=4 299 B7R1.1 CNC1=NC=CO1 LN00002575 [1,1,0,0,0,0|0,1,0]=3 300 B7R1.1 CNC1=NOC=C1 LN00001263 [1,1,0,0,0,0|2,0,0]=4 301 B7R1.1 CNC1=NOC=C1 LN00002470 [1,1,0,0,0,0|2,0,0]=4 302 B7R1.1 COC1=CC=CS1 AC130135 [1,1,0,0,0,0|1,0,0]=3 303 B7R1.1 COC1=CSC=C1 AC511563 [1,1,0,0,0,0|2,0,0]=4 304 B7R1.1 CSC1=CNN=C1 LN01331335 [1,1,0,0,0,0|2,0,0]=4 305 B7R1.1 ClCC1=NC=CO1 AC050434 [1,1,0,0,0,0|0,1,0]=3 306 B7R1.1 N#CC1=CC=CS1 AC511049 [1,1,0,0,0,0|1,0,1]=4 307 B7R1.1 N#CC1=NC=CS1 AC182437 [1,1,0,0,0,0|0,0,1]=3 308 B7R1.1 NCC1=CC=CN1 AC182788 [1,1,0,0,0,0|1,0,1]=4 309 B7R1.1 NCC1=CC=CS1 AC510712 [1,1,0,0,0,0|1,0,0]=3 310 B7R1.1 NCC1=CNN=C1 AC050524 [1,1,0,0,0,0|2,0,0]=4 311 B7R1.1 NCC1=CSC=C1 AC181241 [1,1,0,0,0,0|2,0,0]=4 312 B7R1.1 O=CC1=CC=CS1 AC511013 [1,1,0,0,0,0|1,0,1]=4 313 B7R1.1 O=CC1=CN=CO1 AC051098 [1,1,0,0,0,0|0,1,1]=4 314 B7R1.1 O=CC1=CN=CS1 AC181432 [1,1,0,0,0,0|0,0,1]=3 315 B7R1.1 O=CC1=NC=CS1 AC180755 [1,1,0,0,0,0|0,0,1]=3 316 B7R1.1 OCC1=CC=NO1 AC050733 [1,1,0,0,0,0|2,0,0]=4 317 B7R1.1 OCC1=CN=CN1 AC500303 [1,1,0,0,0,0|1,0,0]=3 318 B7R1.1 OCC1=CN=CO1 AC182363 [1,1,0,0,0,0|0,1,0]=3 319 B7R1.1 OCC1=CNN=C1 AC511994 [1,1,0,0,0,0|2,0,0]=4 320 B7R1.1 OCC1=COC=C1 AC510770 [1,1,0,0,0,0|2,0,0]=4 321 B7R1.1 OCC1=CON=C1 AC051093 [1,1,0,0,0,0|2,0,0]=4 322 B7R1.1 OCC1=CSC=C1 AC180309 [1,1,0,0,0,0|2,0,0]=4 323 B7R1.1 OCC1=CSC=N1 AC190085 [1,1,0,0,0,0|2,0,0]=4 324 B7R1.1 OCC1=NOC=C1 AC190021 [1,1,0,0,0,0|2,0,0]=4 325 B7R1.4 CC1=C(Br)C=NN1 AC190316 [1,1,0,0,0,0|2,0,0]=4 326 B7R1.4 CC1=C(Br)SC=C1 AC180547 [1,1,0,0,0,0|2,0,0]=4 327 B7R1.4 CC1=C(C)N=CN1 AC190128 [1,1,0,0,0,0|1,0,0]=3 328 B7R1.4 CC1=CC=NN1C LN00158842 [1,1,0,0,0,0|2,0,0]=4 329 B7R1.4 CN1C=CN=C1Br AC181434 [1,1,0,0,0,0|2,0,0]=4 330 B7R1.4 CN1C=CN=C1I AC190098 [1,1,0,0,0,0|2,0,0]=4 331 B7R1.4 CN1C=CN=C1S HY-B0208 [1,1,0,0,0,0|2,0,0]=4 332 B7R1.4 CN1C=NC=C1Br AC130292 [1,1,0,0,0,0|2,0,0]=4 333 B7R1.4 CN1C=NC=C1I LN00004363 [1,1,0,0,0,0|2,0,0]=4 334 B7R1.4 CN1N=CC=C1Br AC511309 [1,1,0,0,0,0|2,0,0]=4 335 B7R1.4 CN1N=CC=C1C AC181287 [1,1,0,0,0,0|2,0,0]=4 336 B7R1.4 CN1N=CC=C1I AC190152 [1,1,0,0,0,0|2,0,0]=4 337 B7R1.4 CN1N=CC=C1N AC180602 [1,1,0,0,0,0|2,0,0]=4 338 B7R1.4 CN1N=CN=C1Br AC130297 [1,1,0,0,0,0|2,0,0]=4 339 B7R1.4 IC1=C(I)N=CN1 AC181149 [1,1,0,0,0,0|2,0,0]=4 340 B9R1.1 CC1=CC=C(C=O)C=N1 AC100063 [0,1,0,0,0,1|1,0,1]=4 341 B9R1.1 CC1=CC=C(C=O)N=C1 AC511100 [0,1,0,0,0,1|1,0,1]=4 342 B9R1.1 CC1=CC=C(CO)C=N1 AC100103 [0,1,0,0,0,1|1,0,0]=3 343 B9R1.1 CC1=CN=C(C=C1)C#N AC181932 [0,1,0,0,0,1|1,0,1]=4 344 B9R1.1 CC1=NC=C(C=O)C=N1 AC190110 [0,1,0,0,0,1|1,0,1]=4 345 B9R1.1 CC1=NC=C(CBr)C=C1 AC190124 [0,1,0,0,0,1|1,0,0]=3 346 B9R1.1 CC1=NC=C(CO)C=N1 AC512082 [0,1,0,0,0,1|1,0,0]=3 347 B9R1.1 COC1=CC=C(Br)C=N1 AC130157 [0,1,0,0,0,1|2,0,0]=4 348 B9R1.1 COC1=CC=C(I)C=N1 AC070095 [0,1,0,0,0,1|2,0,0]=4 349 B9R1.1 COC1=CC=C(N)N=C1 AC182126 [0,1,0,0,0,1|2,0,0]=4 350 B9R1.1 COC1=CN=C(Cl)C=C1 AC511217 [0,1,0,0,0,1|2,0,0]=4 351 B9R1.1 COC1=CN=C(Cl)N=C1 AC182336 [0,1,0,0,0,1|2,0,0]=4 352 B9R1.1 COC1=CN=C(N)C=N1 AC512160 [0,1,0,0,0,1|2,0,0]=4 353 B9R1.1 COC1=CN=C(N)N=C1 AC050315 [0,1,0,0,0,1|2,0,0]=4 354 B9R1.1 COC1=NC=C(Br)C=C1 AC130150 [0,1,0,0,0,1|2,0,0]=4 355 B9R1.1 COC1=NC=C(Br)C=N1 AC181878 [0,1,0,0,0,1|2,0,0]=4 356 B9R1.1 COC1=NC=C(C)C=C1 AC182341 [0,1,0,0,0,1|1,0,0]=3 357 B9R1.1 COC1=NC=C(Cl)C=C1 AC070111 [0,1,0,0,0,1|2,0,0]=4 358 B9R1.1 COC1=NC=C(N)C=C1 AC180146 [0,1,0,0,0,1|2,0,0]=4 359 B9R1.1 COC1=NC=C(N)C=N1 AC182229 [0,1,0,0,0,1|2,0,0]=4 360 B9R1.1 COC1=NC=C(O)C=C1 AC511210 [0,1,0,0,0,1|2,0,0]=4 361 B9R1.1 COC1=NC=C(O)C=N1 AC040104 [0,1,0,0,0,1|2,0,0]=4 362 B9R1.1 CSC1=CN=C(N)C=C1 AC100050 [0,1,0,0,0,1|2,0,0]=4 363 B9R1.1 CSC1=NC=C(Br)C=N1 AC511500 [0,1,0,0,0,1|2,0,0]=4 364 B9R1.1 CSC1=NC=C(C=N1)O LN00335641 [0,1,0,0,0,1|2,0,0]=4 365 B9R1.1 CSC1=NC=C(O)C=N1 AC180908 [0,1,0,0,0,1|2,0,0]=4 366 B9R1.1 NCC1=CN=C(Cl)C=C1 AC511011 [0,1,0,0,0,1|2,0,0]=4 367 B9R1.1 NCC1=NC=C(Br)C=C1 AC181948 [0,1,0,0,0,1|2,0,0]=4 368 B9R1.1 OCC1=CC=C(Cl)N=C1 AC181178 [0,1,0,0,0,1|2,0,0]=4 369 B9R1.1 OCC1=NC=C(Br)C=C1 AC181754 [0,1,0,0,0,1|2,0,0]=4 370 B9R1.1 OCC1=NC=C(Cl)N=C1 AC182624 [0,1,0,0,0,1|2,0,0]=4 371 B9R1.1 OCC1=NC=C(O)C=C1 AC512020 [0,1,0,0,0,1|2,0,0]=4 372 B9R1.69 CC1=CC(=C(Cl)N=C1)Cl LN00156920 [0,1,0,0,0,1|2,0,0]=4 373 B9R1.69 CC1=CC(=C(F)N=C1)Br LN00131249 [0,1,0,0,0,1|2,0,0]=4 374 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 AC181319 [0,1,0,0,0,1|2,0,0]=4 375 B9R1.69 CC1=CC(Br)=CN=C1C AC050490 [0,1,0,0,0,1|2,0,0]=4 376 B9R1.69 CC1=CC=C(Br)C(C)=N1 AC180956 [0,1,0,0,0,1|2,0,0]=4 377 B9R1.69 CC1=CC=C(Br)C(N)=N1 AC070129 [0,1,0,0,0,1|2,0,0]=4 378 B9R1.69 CC1=CN=C(Br)C(Br)=C1 AC020702 [0,1,0,0,0,1|2,0,0]=4 379 B9R1.69 CC1=CN=C(Br)C(F)=C1 AC511670 [0,1,0,0,0,1|2,0,0]=4 380 B9R1.69 CC1=CN=C(Br)C(N)=C1 AC182267 [0,1,0,0,0,1|2,0,0]=4 381 B9R1.69 CC1=CN=C(C)C(Cl)=N1 AC190247 [0,1,0,0,0,1|1,0,0]=3 382 B9R1.69 CC1=CN=C(Cl)C(C)=N1 AC180716 [0,1,0,0,0,1|2,0,0]=4 383 B9R1.69 CC1=CN=C(Cl)C(F)=C1 AC181991 [0,1,0,0,0,1|2,0,0]=4 384 B9R1.69 CC1=CN=C(Cl)C(N)=C1 AC181669 [0,1,0,0,0,1|2,0,0]=4 385 B9R1.69 CC1=CN=C(Cl)C=C1Cl AC511738 [0,1,0,0,0,1|2,0,0]=4 386 B9R1.69 CC1=CN=C(Cl)N=C1Cl AC180359 [0,1,0,0,0,1|2,0,0]=4 387 B9R1.69 CC1=CN=C(Cl)N=C1N AC181498 [0,1,0,0,0,1|2,0,0]=4 388 B9R1.69 CC1=CN=C(F)C(Br)=C1 AC181595 [0,1,0,0,0,1|2,0,0]=4 389 B9R1.69 CC1=CN=C(F)C=C1I AC510660 [0,1,0,0,0,1|2,0,0]=4 390 B9R1.69 CC1=CN=C(N)C(Br)=C1 AC020831 [0,1,0,0,0,1|2,0,0]=4 391 B9R1.69 CC1=NC(C)=C(N)C=C1 AC181294 [0,1,0,0,0,1|2,0,0]=4 392 B9R1.69 CC1=NC=C(Br)C(Cl)=N1 AC511275 [0,1,0,0,0,1|2,0,0]=4 393 B9R1.69 CC1=NC=C(Br)C=C1N AC182370 [0,1,0,0,0,1|2,0,0]=4 394 B9R1.69 CC1=NC=C(Cl)C(Cl)=N1 AC050977 [0,1,0,0,0,1|2,0,0]=4 395 B9R1.69 CC1=NC=C(Cl)C(O)=N1 AC051115 [0,1,0,0,0,1|2,0,0]=4 396 B9R1.69 CC1=NC=C(Cl)C=C1N AC020435 [0,1,0,0,0,1|2,0,0]=4 397 B9R1.69 CC1=NC=C(F)C(Cl)=N1 AC190145 [0,1,0,0,0,1|2,0,0]=4 398 B9R1.69 CC1=NC=C(N)C=C1Br AC182204 [0,1,0,0,0,1|2,0,0]=4 399 B9R1.2 C1=C(C=C(Cl)N=C1)CO LN00005270 [0,1,0,0,0,1|2,0,0]=4 400 B9R1.2 C1=CN=C(C=C1Br)CN LN00173736 [0,1,0,0,0,1|2,0,0]=4 401 B9R1.2 CC1=CC(=NC=C1)C#N AC511539 [0,1,0,0,0,1|1,0,1]=4 402 B9R1.2 CC1=CC(C=O)=NC=C1 AC510820 [0,1,0,0,0,1|1,0,1]=4 403 B9R1.2 CC1=CC(CN)=CC=C1 AC500121 [0,1,0,0,0,1|2,0,0]=4 404 B9R1.2 CC1=CC=CC(=N1)OC LN00002432 [0,1,0,0,0,1|2,0,0]=4 405 B9R1.2 CC1=CC=CC(CN)=N1 AC190009 [0,1,0,0,0,1|2,0,0]=4 406 B9R1.2 CC1=NC(=CC=C1)CO LN00224223 [0,1,0,0,0,1|2,0,0]=4 407 B9R1.2 CC1=NC(=NC=C1)C#N AC182722 [0,1,0,0,0,1|1,0,1]=4 408 B9R1.2 CC1=NC=CC(C=O)=C1 AC181964 [0,1,0,0,0,1|1,0,1]=4 409 B9R1.2 CCC1=CC(N)=NC=C1 AC310156 [0,1,0,0,0,1|2,0,0]=4 410 B9R1.2 CCC1=NC=CC(=C1)Br LN02122573 [0,1,0,0,0,1|2,0,0]=4 411 B9R1.2 CCC1=NC=NC(Cl)=C1 AC511297 [0,1,0,0,0,1|2,0,0]=4 412 B9R1.2 CNC1=CC(Cl)=NC=N1 AC190073 [0,1,0,0,0,1|2,0,0]=4 413 B9R1.2 COC1=CC(Br)=CN=C1 AC510801 [0,1,0,0,0,1|2,0,0]=4 414 B9R1.2 COC1=CC(Br)=NC=C1 AC181956 [0,1,0,0,0,1|2,0,0]=4 415 B9R1.2 COC1=CC(C)=NC=C1 AC511978 [0,1,0,0,0,1|1,0,0]=3 416 B9R1.2 COC1=CC(N)=NC=C1 AC182137 [0,1,0,0,0,1|2,0,0]=4 417 B9R1.2 COC1=CC=CC(C)=N1 AC181782 [0,1,0,0,0,1|2,0,0]=4 418 B9R1.2 COC1=CC=NC(Cl)=C1 AC130676 [0,1,0,0,0,1|2,0,0]=4 419 B9R1.2 COC1=CN=CC(N)=C1 AC182431 [0,1,0,0,0,1|2,0,0]=4 420 B9R1.2 COC1=NC(Cl)=NC=C1 AC180869 [0,1,0,0,0,1|2,0,0]=4 421 B9R1.2 COC1=NC(N)=NC=C1 AC512040 [0,1,0,0,0,1|2,0,0]=4 422 B9R1.2 COC1=NC=CC(Br)=C1 AC182264 [0,1,0,0,0,1|2,0,0]=4 423 B9R1.2 COC1=NC=CC(Cl)=C1 AC512031 [0,1,0,0,0,1|2,0,0]=4 424 B9R1.2 COC1=NC=CC(N)=C1 AC182029 [0,1,0,0,0,1|2,0,0]=4 425 B9R1.2 COC1=NC=NC(Cl)=C1 AC181930 [0,1,0,0,0,1|2,0,0]=4 426 B9R1.2 CSC1=NC=CC(=O)N1 AC181143 [0,1,0,0,0,1|2,0,0]=4 427 B9R1.2 CSC1=NC=CC(Br)=N1 AC182505 [0,1,0,0,0,1|2,0,0]=4 428 B9R1.2 CSC1=NC=CC(Cl)=N1 AC511714 [0,1,0,0,0,1|2,0,0]=4 429 B9R1.2 ClCC1=CC(Cl)=NC=C1 AC182544 [0,1,0,0,0,1|2,0,0]=4 430 B9R1.2 NC1=NC=CC(CO)=C1 AC181723 [0,1,0,0,0,1|2,0,0]=4 431 B9R1.2 OCC1=CC(Br)=CN=C1 AC500329 [0,1,0,0,0,1|2,0,0]=4 432 B9R1.2 OCC1=CC(Br)=NC=C1 AC070124 [0,1,0,0,0,1|2,0,0]=4 433 B9R1.2 OCC1=CC(Cl)=NC=C1 AC182075 [0,1,0,0,0,1|2,0,0]=4 434 B9R1.2 OCC1=NC=CC(Cl)=C1 AC182138 [0,1,0,0,0,1|2,0,0]=4 435 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 AC181784 [0,1,0,0,0,1|2,0,0]=4 436 B9R1.3 CC1=C(Br)C(F)=NC=C1 AC182268 [0,1,0,0,0,1|2,0,0]=4 437 B9R1.3 CC1=C(F)C(Cl)=NC=C1 AC200022 [0,1,0,0,0,1|2,0,0]=4 438 B9R1.3 CC1=C(N)C(Br)=NC=C1 AC070130 [0,1,0,0,0,1|2,0,0]=4 439 B9R1.3 CC1=CC=CC(C)=C1Br AC510845 [0,1,0,0,0,1|2,0,0]=4 440 B9R1.3 CC1=CC=CC(C)=C1I AC100018 [0,1,0,0,0,1|2,0,0]=4 441 B9R1.3 CC1=CNC=C(C)C1=N LN00169107 [0,1,0,0,0,1|1,0,1]=4 442 B9R1.3 CC1=NC=CC(Br)=C1C AC512076 [0,1,0,0,0,1|2,0,0]=4 443 B9R1.3 CC1=NC=CC(N)=C1C AC180390 [0,1,0,0,0,1|2,0,0]=4 444 B9R1.3 CC1=NC=NC(Cl)=C1Br AC180926 [0,1,0,0,0,1|2,0,0]=4 445 B9R1.3 CC1=NC=NC(Cl)=C1Cl AC511303 [0,1,0,0,0,1|2,0,0]=4 446 B9R1.3 CC1=NC=NC(O)=C1Br AC181280 [0,1,0,0,0,1|2,0,0]=4 447 B9R1.34 CC1=CC(Br)=CC(C)=N1 AC511718 [0,1,0,0,0,1|2,0,0]=4 448 B9R1.34 CC1=CC(Br)=NC(Br)=C1 AC310110 [0,1,0,0,0,1|2,0,0]=4 449 B9R1.34 CC1=CC(Br)=NC(C)=C1 AC180648 [0,1,0,0,0,1|1,0,0]=3 450 B9R1.34 CC1=CC(Br)=NC(Cl)=C1 AC512138 [0,1,0,0,0,1|2,0,0]=4 451 B9R1.34 CC1=CC(C)=NC(C)=C1 AC500170 [0,1,0,0,0,1|1,0,0]=3 452 B9R1.34 CC1=CC(C)=NC(N)=N1 AC180132 [0,1,0,0,0,1|1,0,0]=3 453 B9R1.34 CC1=CC(Cl)=CC(C)=N1 AC181289 [0,1,0,0,0,1|2,0,0]=4 454 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 AC182319 [0,1,0,0,0,1|2,0,0]=4 455 B9R1.34 CC1=CC(Cl)=NC(C)=C1 AC182266 [0,1,0,0,0,1|1,0,0]=3 456 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 AC182418 [0,1,0,0,0,1|2,0,0]=4 457 B9R1.34 CC1=CC(Cl)=NC(N)=N1 AC180131 [0,1,0,0,0,1|2,0,0]=4 458 B9R1.34 CC1=CC(N)=CC(C)=C1 AC130026 [0,1,0,0,0,1|2,0,0]=4 459 B9R1.34 CC1=CC(N)=CC(C)=N1 AC130149 [0,1,0,0,0,1|2,0,0]=4 460 B9R1.34 CC1=CC(N)=NC(C)=C1 AC130158 [0,1,0,0,0,1|1,0,0]=3 461 B9R1.34 CC1=CC(O)=CC(O)=N1 AC181327 [0,1,0,0,0,1|2,0,0]=4 462 B9R1.34 CC1=NC(C)=NC(Cl)=C1 AC180943 [0,1,0,0,0,1|1,0,0]=3 463 B9R1.34 CC1=NC(Cl)=CC(Cl)=N1 AC180672 [0,1,0,0,0,1|2,0,0]=4 464 B9R1.34 CC1=NC(Cl)=NC(Cl)=C1 AC180128 [0,1,0,0,0,1|2,0,0]=4 465 B9R1.7 CC1=NNC(CC#N)=N1 AC020862 [0,2,0,0,0,0|2,0,0]=4 466 B9R1.7 NC1=NC=C(SC#N)S1 AC200129 [0,2,0,0,0,0|1,0,1]=4 467 B9R1.21 OCC1=CC=C(CO)O1 AC511338 [0,2,0,0,0,0|1,1,0]=4 468 B9R1.22 CC1=CC(C)=C(N1)C=O AC511604 [0,2,0,0,0,0|1,0,1]=4 469 B9R1.22 CC1=NC(C)=C(N1)C=O AC020332 [0,2,0,0,0,0|1,0,1]=4 470 B9R1.22 CN1C=C(C)C(CO)=N1 AC051154 [0,2,0,0,0,0|2,0,0]=4 471 B9R1.22 NC1=NC(C#N)=C(Br)S1 AC060022 [0,2,0,0,0,0|2,0,0]=4 472 B9R1.23 CC1=C(C)N=C(S1)C=O AC190136 [0,2,0,0,0,0|0,0,1]=3 473 B9R1.35 CC(=O)C1=CC=C(C)S1 AC180308 [0,2,0,0,0,0|1,0,0]=3 474 B9R1.35 CC(C)C1=NN=C(Br)S1 AC050210 [0,2,0,0,0,0|2,0,0]=4 475 B9R1.35 CC(N)C1=CN(C)N=C1 AC200018 [0,2,0,0,0,0|2,0,0]=4 476 B9R1.35 CC(N)C1=NN=C(C)N1 AC030033 [0,2,0,0,0,0|2,0,0]=4 477 B9R1.35 CC1=CC=C(S1)B(O)O AC130313 [0,2,0,0,0,0|2,0,0]=4 478 B9R1.35 CC1=CC=C(S1)C(O)=O AC511071 [0,2,0,0,0,0|1,0,1]=4 479 B9R1.35 CC1=NC=C(C(=O)O)O1 LN00214770 [0,2,0,0,0,0|0,1,1]=4 480 B9R1.35 CC1=NC=C(S1)C(O)=O AC181314 [0,2,0,0,0,0|0,0,1]=3 481 B9R1.35 CC1=NN=C(C(=O)O)S1 LN01372544 [0,2,0,0,0,0|1,0,1]=4 482 B9R1.35 CN1C=C(C=N1)C(C)=O AC511894 [0,2,0,0,0,0|2,0,0]=4 483 B9R1.35 NC1=NC=C(S1)C(O)=O AC181939 [0,2,0,0,0,0|1,0,1]=4 484 B9R1.35 OC(=O)C1=CN=C(Br)S1 AC511727 [0,2,0,0,0,0|1,0,1]=4 485 B9R1.35 [O-][N+](=O)C1=CN=C(Br)S1 AC180096 [0,2,0,0,0,0|2,0,0]=4 486 B9R1.37 CN1N=C(C)C(Br)=C1C AC180518 [0,2,0,0,0,0|2,0,0]=4 487 B9R1.27 CC1=C(C=O)C(C)=NO1 AC181481 [0,2,0,0,0,0|2,0,0]=4 488 B9R1.27 CN1N=CC(C)=C1CO AC051166 [0,2,0,0,0,0|2,0,0]=4 489 B7R1.3 CC1=CC=NC=N1 AC021043 [0,0,1,1,0,0|2,0,0]=4