0 B7R1.4 BrC1=C(I)SC=C1 AK-81714 [0,0,0,0,0,0|4,0,0]=4 1 B7R1.4 BrC1=CC=N[N]1C AK-34841 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.4 BrC1=CSC=C1I AK-82208 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.4 C1=C(Br)C(=CS1)Br AK-46302 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.4 C1=C(N)[N](C)N=C1 AK-23556 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.4 C1=CC(=C(S1)Br)C AK-46588 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.4 C1=CSC(=C1Br)Br AK-25755 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.4 C1=N[NH]C(=C1Br)N AK-23671 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.4 CC1=C(Br)C=NO1 AK112982 [0,0,0,0,0,0|3,0,0]=3 9 B7R1.4 CC1=C(Br)NC=N1 AK-92496 [0,0,0,0,0,0|4,0,0]=4 10 B7R1.4 CC1=C(Br)NN=N1 AK109316 [0,0,0,0,0,0|4,0,0]=4 11 B7R1.4 CC1=C(Br)SC=N1 AK-40873 [0,0,0,0,0,0|4,0,0]=4 12 B7R1.4 CC1=C(C)N=CN1 AK157739 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.4 CC1=C(C)N=CS1 AK-46395 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.4 CC1=C(I)NC=N1 AK128524 [0,0,0,0,0,0|4,0,0]=4 15 B7R1.4 CC1=CC=NN1C AK-36127 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.4 CC1=CNN=C1C AK111434 [0,0,0,0,0,0|2,0,0]=2 17 B7R1.4 CC1=CNN=C1C AK117330 [0,0,0,0,0,0|2,0,0]=2 18 B7R1.4 CC1=CSC=C1Br AK-34597 [0,0,0,0,0,0|1,0,0]=1 19 B7R1.4 CC1=CSC=C1C AK-45919 [0,0,0,0,0,0|0,0,0]=0 20 B7R1.4 CC1=NNC=C1Br AK-24746 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.4 CC1=NNC=C1I AK-73045 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.4 CC1CSCC1=O AK104742 [0,0,0,0,0,0|1,0,3]=4 23 B7R1.4 CN1C(I)=CN=C1 AK-36203 [0,0,0,0,0,0|3,0,0]=3 24 B7R1.4 CN1C=CN=C1C AK-60401 [0,0,0,0,0,0|3,0,0]=3 25 B7R1.4 CN1C=CN=C1Cl AK-79282 [0,0,0,0,0,0|4,0,0]=4 26 B7R1.4 CN1C=CN=C1I AK-34893 [0,0,0,0,0,0|4,0,0]=4 27 B7R1.4 CN1C=NC=C1Br AK-32615 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.4 ClC1=C(Br)C=CS1 AK-25922 [0,0,0,0,0,0|4,0,0]=4 29 B7R1.4 ClC1=C(Br)SC=C1 AK-93781 [0,0,0,0,0,0|4,0,0]=4 30 B7R1.4 IC1=CC=N[N]1C AK-34754 [0,0,0,0,0,0|4,0,0]=4 31 B7R1.4 NC1=CN=CN1C AK128338 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.4 NC1=CNN=C1Br AK145116 [0,0,0,0,0,0|4,0,0]=4 33 B7R1.4 NC1=CNN=C1Cl AK120335 [0,0,0,0,0,0|4,0,0]=4 34 B7R1.4 NC1=CNN=C1Cl AK144425 [0,0,0,0,0,0|4,0,0]=4 35 B7R1.4 NC1=NC=CN1C AK-36047 [0,0,0,0,0,0|4,0,0]=4 36 B7R1.4 NC1=NC=CN1C AK125047 [0,0,0,0,0,0|4,0,0]=4 37 B7R1.4 O=C1C(O)=CCC1 AK-43709 [0,0,0,0,0,0|3,0,1]=4 38 B7R1.4 O=C1N(C)NC=C1 AK113037 [0,0,0,0,0,0|4,0,0]=4 39 B7R1.4 O=C1N(C)SC=C1 AK682465 [0,0,0,0,0,0|4,0,0]=4 40 B7R1.4 O=C1NC=CN1C AK317267 [0,0,0,0,0,0|4,0,0]=4 41 B7R1.4 OC1=CC=N[N]1C AK-39760 [0,0,0,0,0,0|4,0,0]=4 42 B6R1.2 BrC1=CSN=C1 AK-29054 [1,0,0,0,0,0|2,0,0]=3 43 B6R1.2 BrC1=NOC=C1 AK-32851 [1,0,0,0,0,0|2,1,0]=4 44 B6R1.2 BrC1=N[NH]C=C1 AK-23694 [1,0,0,0,0,0|3,0,0]=4 45 B6R1.2 C1=C(Br)SC=N1 AK-22153 [1,0,0,0,0,0|3,0,0]=4 46 B6R1.2 C1=C(Cl)[NH]C=N1 AK-39375 [1,0,0,0,0,0|3,0,0]=4 47 B6R1.2 C1=C(N=CS1)C AK-27071 [1,0,0,0,0,0|1,0,0]=2 48 B6R1.2 C1=C([NH]C=N1)Br AK-29028 [1,0,0,0,0,0|3,0,0]=4 49 B6R1.2 C1=C([NH]N=C1)C AK-47298 [1,0,0,0,0,0|2,0,0]=3 50 B6R1.2 C1=CSC(=N1)C AK-25844 [1,0,0,0,0,0|3,0,0]=4 51 B6R1.2 C1=CSC=C1I AK-73044 [1,0,0,0,0,0|1,0,0]=2 52 B6R1.2 C1=NC(=CS1)Br AK-23755 [1,0,0,0,0,0|2,0,0]=3 53 B6R1.2 C1=NC=C(I)[NH]1 AH-10005 [1,0,0,0,0,0|3,0,0]=4 54 B6R1.2 C1=N[NH]C(=C1)N AK-23634 [1,0,0,0,0,0|3,0,0]=4 55 B6R1.2 C1=N[NH]C=C1Br AK-23744 [1,0,0,0,0,0|3,0,0]=4 56 B6R1.2 C1=N[NH]C=C1C AK-46480 [1,0,0,0,0,0|2,0,0]=3 57 B6R1.2 C1=N[NH]C=C1Cl AK-28843 [1,0,0,0,0,0|3,0,0]=4 58 B6R1.2 C1=N[NH]C=C1I AK-39171 [1,0,0,0,0,0|3,0,0]=4 59 B6R1.2 C1=N[NH]C=C1N AK-23740 [1,0,0,0,0,0|3,0,0]=4 60 B6R1.2 C1=N[N](C=N1)C AK-51663 [1,0,0,0,0,0|3,0,0]=4 61 B6R1.2 CC1=CN=CS1 AK-40769 [1,0,0,0,0,0|2,0,0]=3 62 B6R1.2 CC1=CNC=C1 AK-59534 [1,0,0,0,0,0|1,0,0]=2 63 B6R1.2 CC1=CNN=N1 AK-38543 [1,0,0,0,0,0|3,0,0]=4 64 B6R1.2 CC1=NC=CN1 AK-76902 [1,0,0,0,0,0|3,0,0]=4 65 B6R1.2 CC1=NN=CO1 AK-50870 [1,0,0,0,0,0|3,0,0]=4 66 B6R1.2 CC1=NNC=N1 AK-46139 [1,0,0,0,0,0|3,0,0]=4 67 B6R1.2 CC1=NON=C1 AK-49621 [1,0,0,0,0,0|2,1,0]=4 68 B6R1.2 CN1C=CN=N1 AK-60587 [1,0,0,0,0,0|3,0,0]=4 69 B6R1.2 CN1C=NN=C1 AK321144 [1,0,0,0,0,0|3,0,0]=4 70 B6R1.2 ClC1=CC=NN1 AK132931 [1,0,0,0,0,0|3,0,0]=4 71 B6R1.2 ClC1=CSC=N1 AK-23769 [1,0,0,0,0,0|2,0,0]=3 72 B6R1.2 ClC1=NNC=C1 AK-64806 [1,0,0,0,0,0|3,0,0]=4 73 B6R1.2 IC1=CC=CS1 AK-77599 [1,0,0,0,0,0|3,0,0]=4 74 B6R1.2 IC1=CON=C1 AK-24636 [1,0,0,0,0,0|2,1,0]=4 75 B6R1.2 IC1=NNC=C1 AK-31094 [1,0,0,0,0,0|3,0,0]=4 76 B6R1.2 N1=CC=C([NH]1)N AK-36860 [1,0,0,0,0,0|3,0,0]=4 77 B6R1.2 NC1=CC=NO1 AK-46390 [1,0,0,0,0,0|3,0,0]=4 78 B6R1.2 NC1=CN=CN1 AK110462 [1,0,0,0,0,0|3,0,0]=4 79 B6R1.2 NC1=CNN=C1 AK-24373 [1,0,0,0,0,0|3,0,0]=4 80 B6R1.2 NC1=CON=C1 AK-24626 [1,0,0,0,0,0|2,1,0]=4 81 B6R1.2 NC1=CON=C1 AK-24638 [1,0,0,0,0,0|2,1,0]=4 82 B6R1.2 NC1=CSC=N1 AK142332 [1,0,0,0,0,0|2,0,0]=3 83 B6R1.2 NC1=NOC=C1 AK-25502 [1,0,0,0,0,0|2,1,0]=4 84 B6R1.2 NN1C=CC=C1 AK-88561 [1,0,0,0,0,0|3,0,0]=4 85 B6R1.2 NN1C=CN=C1 AK187814 [1,0,0,0,0,0|3,0,0]=4 86 B6R1.2 O=C1NNC=C1 AK-58738 [1,0,0,0,0,0|3,0,0]=4 87 B6R1.2 O=C1NSC=C1 AK101140 [1,0,0,0,0,0|2,0,0]=3 88 B6R1.2 O=C1OCC=C1 AK163254 [1,0,0,0,0,0|3,0,0]=4 89 B6R1.2 OC1=NNC=C1 AK-96005 [1,0,0,0,0,0|3,0,0]=4 90 B6R1.2 S1C(=CN=C1)N AK-28900 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.11 BrC1=CSC=C1C=O AK-33868 [0,1,0,0,0,0|1,0,1]=3 92 B8R1.11 CC1=NSC=C1C#N AK-82179 [0,1,0,0,0,0|1,0,1]=3 93 B8R1.11 CC1=N[NH]C=C1C=O AK-27719 [0,1,0,0,0,0|2,0,1]=4 94 B8R1.11 CCC1=CNNC1=N AK-23672 [0,1,0,0,0,0|3,0,0]=4 95 B8R1.11 CN1C=CN=C1CCl AK-45446 [0,1,0,0,0,0|3,0,0]=4 96 B8R1.11 CN1C=CN=C1CN AK-38431 [0,1,0,0,0,0|3,0,0]=4 97 B8R1.11 CSC1=C(C)OC=C1 AK307519 [0,1,0,0,0,0|2,0,0]=3 98 B8R1.11 CSC1=NC=CN1C AK175602 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.11 ClC1=C(CBr)C=CS1 AK113906 [0,1,0,0,0,0|3,0,0]=4 100 B8R1.11 N#CC1=CNN=C1C AK-76070 [0,1,0,0,0,0|2,0,1]=4 101 B8R1.11 NC1=NNC=C1CC AK-75653 [0,1,0,0,0,0|3,0,0]=4 102 B8R1.11 NCC1=CC=CN1C AK-44946 [0,1,0,0,0,0|2,0,0]=3 103 B8R1.11 NCC1=CC=NN1C AK-76608 [0,1,0,0,0,0|3,0,0]=4 104 B8R1.11 OCC1=C(Br)C=CS1 AK327707 [0,1,0,0,0,0|3,0,0]=4 105 B8R1.11 OCC1=C(C)N=CN1 AK-34958 [0,1,0,0,0,0|3,0,0]=4 106 B8R1.11 OCC1=CC=NN1C AK-65816 [0,1,0,0,0,0|3,0,0]=4 107 B8R1.11 OCC1=NC=CN1C AK-23555 [0,1,0,0,0,0|3,0,0]=4 108 B8R1.11 OCC1=NN=CN1C AK-32421 [0,1,0,0,0,0|3,0,0]=4 109 B8R1.18 BrC1=NC(=C(S1)C)C AK-40981 [0,1,0,0,0,0|3,0,0]=4 110 B8R1.18 CC1=C(C)N=C(N)S1 AK-34230 [0,1,0,0,0,0|3,0,0]=4 111 B8R1.18 CC1=C(Cl)SC(Cl)=C1 AK-63384 [0,1,0,0,0,0|3,0,0]=4 112 B8R1.18 CC1=C(OC(O1)=O)C AK-49114 [0,1,0,0,0,0|3,0,0]=4 113 B8R1.18 CC1=CC(Br)=NN1C AK142229 [0,1,0,0,0,0|3,0,0]=4 114 B8R1.18 CC1=CC(C)=NN1C AK-32793 [0,1,0,0,0,0|3,0,0]=4 115 B8R1.18 CC1=NC(C)=C(C)S1 AK-58544 [0,1,0,0,0,0|3,0,0]=4 116 B8R1.18 CC1=NN(C)C=C1I AK501768 [0,1,0,0,0,0|3,0,0]=4 117 B8R1.18 NC1=CN(C)N=C1C AK117155 [0,1,0,0,0,0|3,0,0]=4 118 B8R1.18 NC1=NC(C)=C(C)S1 AK-93474 [0,1,0,0,0,0|3,0,0]=4 119 B8R1.18 NC1=NN(C)C(C)=C1 AK-81604 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.50 CC1=C(Br)C(C)=NO1 AK-40049 [0,1,0,0,0,0|2,1,0]=4 121 B8R1.50 CC1=C(Br)N(C)C=N1 AK155413 [0,1,0,0,0,0|3,0,0]=4 122 B8R1.50 CC1=C(C)C(N)=NN1 AK-36836 [0,1,0,0,0,0|2,0,0]=3 123 B8R1.50 CC1=C(I)C(I)=NN1 AK165918 [0,1,0,0,0,0|3,0,0]=4 124 B8R1.50 CC1=C(ON=C1N)C AK-27780 [0,1,0,0,0,0|2,0,0]=3 125 B8R1.50 CC1=NC=C(Br)N1C AK-39971 [0,1,0,0,0,0|3,0,0]=4 126 B8R1.50 CC1=NOC(=C1I)C AK-32755 [0,1,0,0,0,0|2,1,0]=4 127 B8R1.50 CC1=N[NH]C(=C1I)C AK-34009 [0,1,0,0,0,0|3,0,0]=4 128 B8R1.50 CC=1CCC(C1O)=O AK103328 [0,1,0,0,0,0|2,0,1]=4 129 B8R1.50 CN1C(=O)CSC1=O AK-63992 [0,1,0,0,0,0|2,0,1]=4 130 B8R1.50 CN1N=CC(N)=C1C AK105113 [0,1,0,0,0,0|3,0,0]=4 131 B8R1.50 NC1=C(C)N(C)N=C1 AK-78097 [0,1,0,0,0,0|3,0,0]=4 132 B8R1.50 NC1=C(C)ON=C1C AK114014 [0,1,0,0,0,0|2,1,0]=4 133 B8R1.50 S=C1NN=C(C)N1C AK-34970 [0,1,0,0,0,0|3,0,0]=4 134 B8R1.4 BrC1=CC(Br)=CC=C1 AK-88659 [0,0,0,0,0,1|3,0,0]=4 135 B8R1.4 BrC1=CC=CC(N)=N1 AK-25560 [0,0,0,0,0,1|3,0,0]=4 136 B8R1.4 BrC1=CN=CC(Br)=C1 AK-22107 [0,0,0,0,0,1|3,0,0]=4 137 B8R1.4 BrC1=CN=CC(Br)=N1 AK-23575 [0,0,0,0,0,1|3,0,0]=4 138 B8R1.4 BrC1=NC(=NC=C1)C AK-31569 [0,0,0,0,0,1|3,0,0]=4 139 B8R1.4 BrC1=NC(I)=CC=C1 AK-49587 [0,0,0,0,0,1|3,0,0]=4 140 B8R1.4 BrC1=NC=CC(=N1)C AK-25002 [0,0,0,0,0,1|3,0,0]=4 141 B8R1.4 C1=C(Br)C=CN=C1C AK-23747 [0,0,0,0,0,1|3,0,0]=4 142 B8R1.4 C1=C(C)C=CN=C1Cl AK-25858 [0,0,0,0,0,1|3,0,0]=4 143 B8R1.4 C1=C(C)N=CN=C1C AK-33461 [0,0,0,0,0,1|3,0,0]=4 144 B8R1.4 C1=C(C=C(C=N1)Cl)Br AK-26301 [0,0,0,0,0,1|3,0,0]=4 145 B8R1.4 C1=C(C=CC=C1Br)I AK-48371 [0,0,0,0,0,1|3,0,0]=4 146 B8R1.4 C1=C(C=CN=C1Br)C AK-26025 [0,0,0,0,0,1|3,0,0]=4 147 B8R1.4 C1=C(C=CN=C1C)Cl AK-25859 [0,0,0,0,0,1|3,0,0]=4 148 B8R1.4 C1=C(C=NC=C1Cl)O AK-27757 [0,0,0,0,0,1|3,0,0]=4 149 B8R1.4 C1=C(C=NC=C1O)Br AK-22149 [0,0,0,0,0,1|3,0,0]=4 150 B8R1.4 C1=C(C=NC=C1O)C AK-25962 [0,0,0,0,0,1|2,0,0]=3 151 B8R1.4 C1=C(F)C=NC=C1Br AK-23525 [0,0,0,0,0,1|3,0,0]=4 152 B8R1.4 C1=C(N=C(C=C1)Br)C AK-26079 [0,0,0,0,0,1|2,0,0]=3 153 B8R1.4 C1=C(N=C(C=C1)Br)Cl AK-35415 [0,0,0,0,0,1|3,0,0]=4 154 B8R1.4 C1=C(N=C(C=C1)Cl)N AK-27165 [0,0,0,0,0,1|3,0,0]=4 155 B8R1.4 C1=C(N=C(C=N1)Cl)N AK-25785 [0,0,0,0,0,1|3,0,0]=4 156 B8R1.4 C1=C(N=C(N=C1)C)Cl AK-21837 [0,0,0,0,0,1|3,0,0]=4 157 B8R1.4 C1=CC=C(F)N=C1Br AK-25117 [0,0,0,0,0,1|3,0,0]=4 158 B8R1.4 C1=CC=C(I)N=C1I AK-39176 [0,0,0,0,0,1|3,0,0]=4 159 B8R1.4 C1=CC=C(N=C1C)Cl AK-32452 [0,0,0,0,0,1|2,0,0]=3 160 B8R1.4 C1=CC=C(N=C1C)F AK-25943 [0,0,0,0,0,1|2,0,0]=3 161 B8R1.4 C1=CC=C(N=C1N)N AK-33251 [0,0,0,0,0,1|3,0,0]=4 162 B8R1.4 CC1=CC(C=CN1)=O AK-25534 [0,0,0,0,0,1|3,0,0]=4 163 B8R1.4 CC1=CC(F)=NC=C1 AK-26002 [0,0,0,0,0,1|3,0,0]=4 164 B8R1.4 CC1=CC(I)=CC=C1 AK161788 [0,0,0,0,0,1|2,0,0]=3 165 B8R1.4 CC1=CC(NN=C1)=O AK-39857 [0,0,0,0,0,1|3,0,0]=4 166 B8R1.4 CC1=CC=CC(I)=N1 AK-35898 [0,0,0,0,0,1|2,0,0]=3 167 B8R1.4 CC1=CC=CC(N)=N1 AK-28918 [0,0,0,0,0,1|2,0,0]=3 168 B8R1.4 CC1=CN=CC(=N1)N AK-26646 [0,0,0,0,0,1|2,0,0]=3 169 B8R1.4 CC1=CN=CC(Br)=N1 AK-28293 [0,0,0,0,0,1|2,0,0]=3 170 B8R1.4 CC1=CN=CC(C)=N1 AK-73109 [0,0,0,0,0,1|1,0,0]=2 171 B8R1.4 CC1=CN=CC(Cl)=C1 AK-25547 [0,0,0,0,0,1|2,0,0]=3 172 B8R1.4 CC1=CN=CC(Cl)=N1 AK-28258 [0,0,0,0,0,1|2,0,0]=3 173 B8R1.4 CC1=CN=CC(F)=C1 AK-25942 [0,0,0,0,0,1|2,0,0]=3 174 B8R1.4 CC1=NC(C)=NC=C1 AK128381 [0,0,0,0,0,1|2,0,0]=3 175 B8R1.4 CC1=NC(Cl)=NC=C1 AK-25001 [0,0,0,0,0,1|3,0,0]=4 176 B8R1.4 CC1=NC(I)=NC=C1 AK-31571 [0,0,0,0,0,1|3,0,0]=4 177 B8R1.4 CC1=NC(O)=NC=C1 AK-24705 [0,0,0,0,0,1|3,0,0]=4 178 B8R1.4 CC1=NC=CC(I)=C1 AK-29006 [0,0,0,0,0,1|3,0,0]=4 179 B8R1.4 ClC1=CC(I)=CN=C1 AK-44424 [0,0,0,0,0,1|3,0,0]=4 180 B8R1.4 ClC1=CC=CC(Br)=C1 AK-77010 [0,0,0,0,0,1|3,0,0]=4 181 B8R1.4 ClC1=CN=CC(=N1)O AK-30468 [0,0,0,0,0,1|3,0,0]=4 182 B8R1.4 ClC1=CN=CC(Cl)=N1 AK-26010 [0,0,0,0,0,1|3,0,0]=4 183 B8R1.4 ClC1=NC(=CC=C1)F AK-32282 [0,0,0,0,0,1|3,0,0]=4 184 B8R1.4 ClC1=NC(I)=CC=C1 AK-45679 [0,0,0,0,0,1|3,0,0]=4 185 B8R1.4 FC1=CC(=CN=C1)O AK-23521 [0,0,0,0,0,1|3,0,0]=4 186 B8R1.4 FC1=CC(I)=CN=C1 AK-50098 [0,0,0,0,0,1|3,0,0]=4 187 B8R1.4 FC1=CC=CC(Br)=C1 AK-88414 [0,0,0,0,0,1|3,0,0]=4 188 B8R1.4 FC1=CC=CC(N)=N1 AK-28849 [0,0,0,0,0,1|3,0,0]=4 189 B8R1.4 IC1=CC(Cl)=CC=C1 AK-48399 [0,0,0,0,0,1|3,0,0]=4 190 B8R1.4 IC1=CC(I)=CC=C1 AK-76947 [0,0,0,0,0,1|3,0,0]=4 191 B8R1.4 IC1=CN=CC(Br)=C1 AK-23687 [0,0,0,0,0,1|3,0,0]=4 192 B8R1.4 IC1=NC(=CN=C1)I AK-23578 [0,0,0,0,0,1|3,0,0]=4 193 B8R1.4 NC1=CC(=CN=C1)Cl AK-23676 [0,0,0,0,0,1|3,0,0]=4 194 B8R1.4 NC1=CC(=CN=C1)F AK-25590 [0,0,0,0,0,1|3,0,0]=4 195 B8R1.4 NC1=CC(=CN=C1)O AK-23677 [0,0,0,0,0,1|3,0,0]=4 196 B8R1.4 NC1=CC(=CN=C1)O AK-27981 [0,0,0,0,0,1|3,0,0]=4 197 B8R1.4 NC1=CC(=NC=C1)C AK-28926 [0,0,0,0,0,1|3,0,0]=4 198 B8R1.4 NC1=CC(Br)=CN=C1 AK-31985 [0,0,0,0,0,1|3,0,0]=4 199 B8R1.4 NC1=CC(N)=CN=C1 AK-81907 [0,0,0,0,0,1|3,0,0]=4 200 B8R1.4 NC1=CC=CC(I)=C1 AK-95998 [0,0,0,0,0,1|3,0,0]=4 201 B8R1.4 NC1=NC(=CN=C1)Br AK-26617 [0,0,0,0,0,1|3,0,0]=4 202 B8R1.4 NC1=NC(C)=NC=C1 AK-30457 [0,0,0,0,0,1|3,0,0]=4 203 B8R1.4 NC1=NC(I)=CC=C1 AK-44440 [0,0,0,0,0,1|3,0,0]=4 204 B8R1.4 NC1=NC(N)=CN=C1 AK-64864 [0,0,0,0,0,1|3,0,0]=4 205 B8R1.4 O=C1C=CC=C(C)N1 AK-29158 [0,0,0,0,0,1|2,0,0]=3 206 B8R1.4 O=C1C=CC=C(Cl)N1 AK-27743 [0,0,0,0,0,1|3,0,0]=4 207 B8R1.4 O=C1NC(=CC=C1)N AK-28666 [0,0,0,0,0,1|3,0,0]=4 208 B8R1.4 O=C1NC(C)=NC=C1 AK-46845 [0,0,0,0,0,1|3,0,0]=4 209 B8R1.4 OC1=CC=CC(Br)=N1 AK-34491 [0,0,0,0,0,1|3,0,0]=4 210 B8R1.4 OC1=CC=CC(I)=C1 AK-88502 [0,0,0,0,0,1|3,0,0]=4 211 B8R1.4 OC1=CN=CC(O)=C1 AK-45937 [0,0,0,0,0,1|3,0,0]=4 212 B8R1.4 OC1=NC(=NC=C1)C AK-21836 [0,0,0,0,0,1|3,0,0]=4 213 B8R1.4 OC1=NC(C)=CN=C1 AK-26663 [0,0,0,0,0,1|2,0,0]=3 214 B8R1.4 OC1=NC(Cl)=CC=C1 AK104457 [0,0,0,0,0,1|3,0,0]=4 215 B8R1.4 OC1=NC(F)=CC=C1 AK-29320 [0,0,0,0,0,1|3,0,0]=4 216 B8R1.4 OC1=NC=CC(C)=C1 AK-33151 [0,0,0,0,0,1|3,0,0]=4 217 B8R1.4 S=C1N=C(C)C=CN1 AK-45762 [0,0,0,0,0,1|3,0,0]=4 218 B8R1.5 BrC1=C(Br)C=NC=C1 AK-41345 [0,0,0,0,0,1|3,0,0]=4 219 B8R1.5 BrC1=C(C=CN=C1)F AK-32932 [0,0,0,0,0,1|3,0,0]=4 220 B8R1.5 BrC1=C(C=CN=C1)O AK-18201 [0,0,0,0,0,1|3,0,0]=4 221 B8R1.5 BrC1=C(C=NC=C1)F AK-51330 [0,0,0,0,0,1|3,0,0]=4 222 B8R1.5 BrC1=C(C=NC=C1)O AK-23750 [0,0,0,0,0,1|3,0,0]=4 223 B8R1.5 BrC1=C(I)C=NC=C1 AK-26413 [0,0,0,0,0,1|3,0,0]=4 224 B8R1.5 BrC1=CC=CN=C1C AK-25896 [0,0,0,0,0,1|2,0,0]=3 225 B8R1.5 BrC1=CC=CN=C1N AK-25389 [0,0,0,0,0,1|3,0,0]=4 226 B8R1.5 BrC1=CN=CN=C1C AK-24717 [0,0,0,0,0,1|2,0,0]=3 227 B8R1.5 BrC1=NC=CC=C1Cl AK-26478 [0,0,0,0,0,1|3,0,0]=4 228 B8R1.5 C1=C(Br)C(=CC=N1)N AK-25388 [0,0,0,0,0,1|3,0,0]=4 229 B8R1.5 C1=C(C(=CN=C1)Br)Cl AK-25860 [0,0,0,0,0,1|3,0,0]=4 230 B8R1.5 C1=C(C(=NC=C1)Br)O AK-30294 [0,0,0,0,0,1|3,0,0]=4 231 B8R1.5 C1=C(C(=NC=C1)Cl)Cl AK-39485 [0,0,0,0,0,1|3,0,0]=4 232 B8R1.5 C1=C(C(=NC=C1)Cl)O AK-30100 [0,0,0,0,0,1|3,0,0]=4 233 B8R1.5 C1=C(C(=NC=C1)F)C AK-34277 [0,0,0,0,0,1|2,0,0]=3 234 B8R1.5 C1=CC=CC(=C1Cl)Br AK-47441 [0,0,0,0,0,1|3,0,0]=4 235 B8R1.5 C1=CC=CC(=C1N)I AK-46500 [0,0,0,0,0,1|3,0,0]=4 236 B8R1.5 C1=CC=C[N+](=C1Cl)C AK-44806 [0,0,0,0,0,1|3,0,0]=4 237 B8R1.5 C1=CC=NC(=C1Br)Br AK-32432 [0,0,0,0,0,1|3,0,0]=4 238 B8R1.5 C1=CC=NC(=C1Br)Cl AK-27263 [0,0,0,0,0,1|3,0,0]=4 239 B8R1.5 C1=CC=NC(=C1C)Cl AK-25527 [0,0,0,0,0,1|2,0,0]=3 240 B8R1.5 C1=CC=NC(=C1I)Cl AK-26334 [0,0,0,0,0,1|3,0,0]=4 241 B8R1.5 C1=CC=NC(=C1O)I AK-25929 [0,0,0,0,0,1|3,0,0]=4 242 B8R1.5 C1=CC=NC(=C1O)N AK-32377 [0,0,0,0,0,1|3,0,0]=4 243 B8R1.5 C1=CN=C(C(=C1)Cl)F AK-33350 [0,0,0,0,0,1|3,0,0]=4 244 B8R1.5 C1=CN=C(C(=C1)I)N AK-39162 [0,0,0,0,0,1|3,0,0]=4 245 B8R1.5 C1=CN=C(C(=N1)C)Cl AK-28587 [0,0,0,0,0,1|3,0,0]=4 246 B8R1.5 C1=CN=CC(=C1C)Br AK-25806 [0,0,0,0,0,1|2,0,0]=3 247 B8R1.5 C1=CN=CC(=C1C)N AK-27057 [0,0,0,0,0,1|2,0,0]=3 248 B8R1.5 C1=CN=CC(=C1N)I AK-25071 [0,0,0,0,0,1|3,0,0]=4 249 B8R1.5 C1=NC(=C(C=N1)N)C AK-28385 [0,0,0,0,0,1|2,0,0]=3 250 B8R1.5 C1=NC=CC(=C1N)I AK-28715 [0,0,0,0,0,1|3,0,0]=4 251 B8R1.5 CC1=C(Br)C=CN=C1 AK-50602 [0,0,0,0,0,1|2,0,0]=3 252 B8R1.5 CC1=C(Br)N=CC=N1 AK-31997 [0,0,0,0,0,1|3,0,0]=4 253 B8R1.5 CC1=C(Cl)C=CN=C1 AK-25556 [0,0,0,0,0,1|2,0,0]=3 254 B8R1.5 CC1=C(Cl)N=NC=C1 AK-36098 [0,0,0,0,0,1|3,0,0]=4 255 B8R1.5 CC1=C(F)C=CN=C1 AK-87891 [0,0,0,0,0,1|2,0,0]=3 256 B8R1.5 CC1=C(F)C=CN=C1 AK132194 [0,0,0,0,0,1|2,0,0]=3 257 B8R1.5 CC1=C(F)C=NC=C1 AK-28364 [0,0,0,0,0,1|2,0,0]=3 258 B8R1.5 CC1=C(I)C=NC=N1 AK-30883 [0,0,0,0,0,1|2,0,0]=3 259 B8R1.5 CC1=C(O)C=NC=C1 AK-29776 [0,0,0,0,0,1|2,0,0]=3 260 B8R1.5 CC1=CC=CC=C1I AK-77011 [0,0,0,0,0,1|2,0,0]=3 261 B8R1.5 CC1=CC=CN=C1Br AK-23603 [0,0,0,0,0,1|2,0,0]=3 262 B8R1.5 CC1=CC=CN=C1O AK-75629 [0,0,0,0,0,1|2,0,0]=3 263 B8R1.5 CC1=CC=CNC1=O AK-32442 [0,0,0,0,0,1|2,0,0]=3 264 B8R1.5 CC1=CC=NNC1=O AK-28464 [0,0,0,0,0,1|3,0,0]=4 265 B8R1.5 CC1=CN=CN=C1O AK-27176 [0,0,0,0,0,1|2,0,0]=3 266 B8R1.5 CC1=NC=CC=C1F AK-33505 [0,0,0,0,0,1|2,0,0]=3 267 B8R1.5 CN1C=CC=CC1=O AK-48448 [0,0,0,0,0,1|3,0,0]=4 268 B8R1.5 ClC1=C(Br)C=NC=C1 AK115133 [0,0,0,0,0,1|3,0,0]=4 269 B8R1.5 ClC1=C(C=CN=C1)Cl AK-27763 [0,0,0,0,0,1|3,0,0]=4 270 B8R1.5 ClC1=C(C=CN=C1)I AK-44916 [0,0,0,0,0,1|3,0,0]=4 271 B8R1.5 ClC1=C(C=CN=C1)O AK-23518 [0,0,0,0,0,1|3,0,0]=4 272 B8R1.5 ClC1=C(C=NC=C1)O AK-25094 [0,0,0,0,0,1|3,0,0]=4 273 B8R1.5 ClC1=C(Cl)C=NN=C1 AK129544 [0,0,0,0,0,1|3,0,0]=4 274 B8R1.5 ClC1=C(I)C=CC=C1 AK-77000 [0,0,0,0,0,1|3,0,0]=4 275 B8R1.5 ClC1=C(N)C=CN=C1 AK-28558 [0,0,0,0,0,1|3,0,0]=4 276 B8R1.5 ClC1=C(N)C=NC=C1 AK-27797 [0,0,0,0,0,1|3,0,0]=4 277 B8R1.5 ClC1=CC=CN=C1I AK-36351 [0,0,0,0,0,1|3,0,0]=4 278 B8R1.5 ClC1=CN=CC=C1Br AK-44084 [0,0,0,0,0,1|3,0,0]=4 279 B8R1.5 ClC1=CN=CN=C1O AK-28090 [0,0,0,0,0,1|3,0,0]=4 280 B8R1.5 ClC1=NC=CC=C1N AK-30071 [0,0,0,0,0,1|3,0,0]=4 281 B8R1.5 ClC1=NC=NC=C1Br AK-47095 [0,0,0,0,0,1|3,0,0]=4 282 B8R1.5 ClC1=NC=NC=C1C AK-25152 [0,0,0,0,0,1|2,0,0]=3 283 B8R1.5 ClC1=NC=NC=C1Cl AK-26228 [0,0,0,0,0,1|3,0,0]=4 284 B8R1.5 ClC1=NC=NC=C1I AK-24022 [0,0,0,0,0,1|3,0,0]=4 285 B8R1.5 FC1=C(Cl)C=CN=C1 AK-87634 [0,0,0,0,0,1|3,0,0]=4 286 B8R1.5 FC1=CC=CC=C1Br AK-88413 [0,0,0,0,0,1|3,0,0]=4 287 B8R1.5 FC1=CC=CN=C1O AK-28818 [0,0,0,0,0,1|3,0,0]=4 288 B8R1.5 FC1=CN=CN=C1Cl AK-68823 [0,0,0,0,0,1|3,0,0]=4 289 B8R1.5 FC1=NC=CC=C1Br AK-25851 [0,0,0,0,0,1|3,0,0]=4 290 B8R1.5 FC1=NC=CC=C1O AK-24443 [0,0,0,0,0,1|3,0,0]=4 291 B8R1.5 IC1=C(Br)C=NC=C1 AK-50221 [0,0,0,0,0,1|3,0,0]=4 292 B8R1.5 IC1=C(C=NC=C1)O AK-23780 [0,0,0,0,0,1|3,0,0]=4 293 B8R1.5 IC1=C(Cl)C=CN=C1 AK-30171 [0,0,0,0,0,1|3,0,0]=4 294 B8R1.5 IC1=C(F)C=NC=C1 AK-29008 [0,0,0,0,0,1|3,0,0]=4 295 B8R1.5 IC1=CC=CC=C1Br AK-48364 [0,0,0,0,0,1|3,0,0]=4 296 B8R1.5 IC1=CC=CC=C1I AK-88372 [0,0,0,0,0,1|3,0,0]=4 297 B8R1.5 IC1=CC=CN=C1Br AK-61736 [0,0,0,0,0,1|3,0,0]=4 298 B8R1.5 IC1=CC=CN=C1F AK-23632 [0,0,0,0,0,1|3,0,0]=4 299 B8R1.5 IC1=CN=CN=C1O AK-28049 [0,0,0,0,0,1|3,0,0]=4 300 B8R1.5 IC1=NC=CC=C1F AK140084 [0,0,0,0,0,1|3,0,0]=4 301 B8R1.5 NC1=C(Br)C=NN=C1 AK123411 [0,0,0,0,0,1|3,0,0]=4 302 B8R1.5 NC1=C(C)C=NC=C1 AK-25562 [0,0,0,0,0,1|2,0,0]=3 303 B8R1.5 NC1=C(C=CN=C1)Br AK-25647 [0,0,0,0,0,1|3,0,0]=4 304 B8R1.5 NC1=C(C=NC=C1)F AK-25616 [0,0,0,0,0,1|3,0,0]=4 305 B8R1.5 NC1=C(C=NC=C1)O AK-23732 [0,0,0,0,0,1|3,0,0]=4 306 B8R1.5 NC1=C(Cl)C=NN=C1 AK-72824 [0,0,0,0,0,1|3,0,0]=4 307 B8R1.5 NC1=C(N)C=NN=C1 AK113553 [0,0,0,0,0,1|3,0,0]=4 308 B8R1.5 NC1=CC=CN=C1Br AK-25918 [0,0,0,0,0,1|3,0,0]=4 309 B8R1.5 NC1=CC=CN=C1C AK-28661 [0,0,0,0,0,1|2,0,0]=3 310 B8R1.5 NC1=CC=CN=C1F AK-28850 [0,0,0,0,0,1|3,0,0]=4 311 B8R1.5 NC1=CC=CN=C1I AK-25585 [0,0,0,0,0,1|3,0,0]=4 312 B8R1.5 NC1=CN=CN=C1Br AK-24576 [0,0,0,0,0,1|3,0,0]=4 313 B8R1.5 NC1=CN=CN=C1Cl AK-30459 [0,0,0,0,0,1|3,0,0]=4 314 B8R1.5 NC1=CN=CN=C1I AK-39594 [0,0,0,0,0,1|3,0,0]=4 315 B8R1.5 NC1=NC=CC=C1Cl AK-23510 [0,0,0,0,0,1|3,0,0]=4 316 B8R1.5 NC1=NC=CC=C1F AK-23511 [0,0,0,0,0,1|3,0,0]=4 317 B8R1.5 NC1=NC=CN=C1C AK-23583 [0,0,0,0,0,1|3,0,0]=4 318 B8R1.5 NC1=NC=NC=C1Br AK-23957 [0,0,0,0,0,1|3,0,0]=4 319 B8R1.5 NC1=NC=NC=C1C AK-27177 [0,0,0,0,0,1|2,0,0]=3 320 B8R1.5 NC1=NC=NC=C1Cl AK-24639 [0,0,0,0,0,1|3,0,0]=4 321 B8R1.5 NC1=NC=NC=C1F AK-31818 [0,0,0,0,0,1|3,0,0]=4 322 B8R1.5 NC1=NC=NC=C1I AK-24640 [0,0,0,0,0,1|3,0,0]=4 323 B8R1.5 O=C1C(Br)=CC=CN1 AK-28771 [0,0,0,0,0,1|3,0,0]=4 324 B8R1.5 O=C1C(C)=NC=CN1 AK-24748 [0,0,0,0,0,1|3,0,0]=4 325 B8R1.5 O=C1C(N)=CC=CN1 AK-88485 [0,0,0,0,0,1|3,0,0]=4 326 B8R1.5 O=C1C(O)=CC=CO1 AK-77266 [0,0,0,0,0,1|3,0,0]=4 327 B8R1.5 O=C1C(O)=COC=C1 AK109540 [0,0,0,0,0,1|2,1,0]=4 328 B8R1.5 O=C1N=CNC=C1O AK-28836 [0,0,0,0,0,1|3,0,0]=4 329 B8R1.5 O=C1NC=NC=C1Br AK-24126 [0,0,0,0,0,1|3,0,0]=4 330 B8R1.5 O=C1NC=NC=C1Br AK-31143 [0,0,0,0,0,1|3,0,0]=4 331 B8R1.5 O=C1NC=NC=C1F AK-23833 [0,0,0,0,0,1|3,0,0]=4 332 B8R1.5 O=C1NC=NC=C1O AK-76929 [0,0,0,0,0,1|3,0,0]=4 333 B8R1.5 O=C1NC=NC=C1O AK155886 [0,0,0,0,0,1|3,0,0]=4 334 B8R1.5 OC1=C(F)C=NC=C1 AK-23520 [0,0,0,0,0,1|3,0,0]=4 335 B8R1.5 OC1=C(I)C=NC=C1 AK-89378 [0,0,0,0,0,1|3,0,0]=4 336 B8R1.5 OC1=C(O)C=CN=C1 AK-45917 [0,0,0,0,0,1|3,0,0]=4 337 B8R1.5 OC1=C(O)N=CC=C1 AK-46383 [0,0,0,0,0,1|3,0,0]=4 338 B8R1.5 OC1=CC=CN=C1C AK-29777 [0,0,0,0,0,1|2,0,0]=3 339 B8R1.5 OC1=NC=CC=C1Cl AK-27733 [0,0,0,0,0,1|3,0,0]=4 340 B8R1.5 S=C1C(N)=CC=CN1 AK-79026 [0,0,0,0,0,1|3,0,0]=4 341 B5R0.3 C=CC(NC)=O AK115593 [1,0,1,0,0,0|2,0,0]=4 342 B5R1.1 N1C=CN=C1 AK-68419 [2,0,0,0,0,0|2,0,0]=4 343 B5R1.1 N1N=CC=C1 AK-80047 [2,0,0,0,0,0|2,0,0]=4 344 B7R0.4 C\C=C\C=C\C([O-])=O AK-47286 [0,1,1,0,0,0|2,0,0]=4 345 B7R1.1 BrCC1=CSC=N1 AK158849 [1,1,0,0,0,0|1,0,0]=3 346 B7R1.1 C1=C(C#N)C=CS1 AK-50641 [1,1,0,0,0,0|0,0,1]=3 347 B7R1.1 C1=C(N=CS1)C=O AK-23930 [1,1,0,0,0,0|1,0,1]=4 348 B7R1.1 C1=C(SC=N1)CO AK-23792 [1,1,0,0,0,0|2,0,0]=4 349 B7R1.1 C1=NC(=CS1)C#N AK-24730 [1,1,0,0,0,0|1,0,1]=4 350 B7R1.1 C1=NC(=CS1)CO AK-23714 [1,1,0,0,0,0|1,0,0]=3 351 B7R1.1 C1=N[NH]C=C1CO AK-29936 [1,1,0,0,0,0|2,0,0]=4 352 B7R1.1 CCC1=CC=CS1 AK-76635 [1,1,0,0,0,0|2,0,0]=4 353 B7R1.1 CCN1C=CN=C1 AK-47598 [1,1,0,0,0,0|2,0,0]=4 354 B7R1.1 COC1=CC=CS1 AK-60885 [1,1,0,0,0,0|2,0,0]=4 355 B7R1.1 COC1=CNN=C1 AK200730 [1,1,0,0,0,0|2,0,0]=4 356 B7R1.1 COC1=CSC=C1 AK-60944 [1,1,0,0,0,0|0,0,0]=2 357 B7R1.1 ClCC1=CN=CO1 AK143331 [1,1,0,0,0,0|2,0,0]=4 358 B7R1.1 ClCC1=CN=CS1 AK-94779 [1,1,0,0,0,0|2,0,0]=4 359 B7R1.1 N#CC1=CNC=C1 AK-46080 [1,1,0,0,0,0|1,0,1]=4 360 B7R1.1 N#CC1=CSN=C1 AK163753 [1,1,0,0,0,0|1,0,1]=4 361 B7R1.1 NCC1=CC=CN1 AK-39872 [1,1,0,0,0,0|2,0,0]=4 362 B7R1.1 NCC1=CC=CS1 AK-46394 [1,1,0,0,0,0|2,0,0]=4 363 B7R1.1 NCC1=CN=CO1 AK-25086 [1,1,0,0,0,0|2,0,0]=4 364 B7R1.1 NCC1=CN=CS1 AK-24530 [1,1,0,0,0,0|2,0,0]=4 365 B7R1.1 NCC1=CNC=C1 AK-67638 [1,1,0,0,0,0|1,0,0]=3 366 B7R1.1 NCC1=CNC=N1 AK-33143 [1,1,0,0,0,0|2,0,0]=4 367 B7R1.1 NCC1=CSC=C1 AK-28306 [1,1,0,0,0,0|0,0,0]=2 368 B7R1.1 NCC1=CSC=C1 AK-48092 [1,1,0,0,0,0|0,0,0]=2 369 B7R1.1 NCC1=NNC=C1 AK-25875 [1,1,0,0,0,0|2,0,0]=4 370 B7R1.1 O=CC1=CNC=C1 AK-36182 [1,1,0,0,0,0|1,0,1]=4 371 B7R1.1 O=CC1=CSC=C1 AK-42964 [1,1,0,0,0,0|0,0,1]=3 372 B7R1.1 OCC1=CC=CS1 AK-93468 [1,1,0,0,0,0|2,0,0]=4 373 B7R1.1 OCC1=CC=NO1 AK-68490 [1,1,0,0,0,0|2,0,0]=4 374 B7R1.1 OCC1=CN=CO1 AK-25343 [1,1,0,0,0,0|2,0,0]=4 375 B7R1.1 OCC1=COC=C1 AK-46116 [1,1,0,0,0,0|0,1,0]=3 376 B7R1.1 OCC1=CSC=C1 AK-36199 [1,1,0,0,0,0|0,0,0]=2 377 B7R1.1 OCC1=NOC=C1 AK-25087 [1,1,0,0,0,0|1,1,0]=4 378 B7R1.2 BrC1=CSC(=C1)C AK-28080 [1,1,0,0,0,0|1,0,0]=3 379 B7R1.2 BrC1=NC=C(S1)C AK-23612 [1,1,0,0,0,0|2,0,0]=4 380 B7R1.2 C1=C(C)N=C(N)S1 AK-33524 [1,1,0,0,0,0|1,0,0]=3 381 B7R1.2 C1=C(C)SC(=N1)C AK-46393 [1,1,0,0,0,0|2,0,0]=4 382 B7R1.2 C1=C(C)[NH]N=C1C AK-50030 [1,1,0,0,0,0|2,0,0]=4 383 B7R1.2 C1=C(N=C(Br)S1)Br AK-27022 [1,1,0,0,0,0|2,0,0]=4 384 B7R1.2 C1=C(N=C(C)S1)C AK-35570 [1,1,0,0,0,0|1,0,0]=3 385 B7R1.2 C1=C(SC(=C1)Br)C AK-36324 [1,1,0,0,0,0|2,0,0]=4 386 B7R1.2 C1=C(SC(=N1)N)C AK-26992 [1,1,0,0,0,0|2,0,0]=4 387 B7R1.2 C1=C([NH]C(=N1)C)C AK-36899 [1,1,0,0,0,0|2,0,0]=4 388 B7R1.2 C1=C[N](N=C1C)C AK-47383 [1,1,0,0,0,0|2,0,0]=4 389 B7R1.2 C1=N[N](C=C1C)C AK-47523 [1,1,0,0,0,0|2,0,0]=4 390 B7R1.2 CC1=CC(Br)=NN1 AK-49142 [1,1,0,0,0,0|2,0,0]=4 391 B7R1.2 CC1=CC(Br)=NO1 AK-34396 [1,1,0,0,0,0|2,0,0]=4 392 B7R1.2 CC1=CC(I)=NN1 AK100667 [1,1,0,0,0,0|2,0,0]=4 393 B7R1.2 CC1=CC(N)=NO1 AK-32792 [1,1,0,0,0,0|2,0,0]=4 394 B7R1.2 CC1=CN=C(Cl)S1 AK-34726 [1,1,0,0,0,0|2,0,0]=4 395 B7R1.2 CC1=CNC(I)=N1 AK113414 [1,1,0,0,0,0|2,0,0]=4 396 B7R1.2 CC1=CSC(Br)=N1 AK-23607 [1,1,0,0,0,0|1,0,0]=3 397 B7R1.2 CC1=NNC(Br)=C1 AK100666 [1,1,0,0,0,0|2,0,0]=4 398 B7R1.2 CC1=NNC(Cl)=C1 AK-80228 [1,1,0,0,0,0|2,0,0]=4 399 B7R1.2 CC1=NNC(N)=C1 AK111310 [1,1,0,0,0,0|2,0,0]=4 400 B7R1.2 CC1=NOC(N)=C1 AK-33327 [1,1,0,0,0,0|1,1,0]=4 401 B7R1.2 CC1=NSC(Br)=N1 AK-90235 [1,1,0,0,0,0|2,0,0]=4 402 B7R1.2 CC1=NSC(N)=N1 AK-33703 [1,1,0,0,0,0|2,0,0]=4 403 B7R1.2 CN1C=C(I)N=C1 AK-29464 [1,1,0,0,0,0|2,0,0]=4 404 B7R1.2 C[N+]1=CN(C)C=C1 AK113093 [1,1,0,0,0,0|2,0,0]=4 405 B7R1.2 ClC1=CSC(Br)=N1 AK128270 [1,1,0,0,0,0|2,0,0]=4 406 B7R1.2 ClC1=NC(=CS1)Cl AK-23570 [1,1,0,0,0,0|2,0,0]=4 407 B7R1.2 ClC1=NC(=NS1)C AK-24499 [1,1,0,0,0,0|2,0,0]=4 408 B7R1.2 NC1=CN(C)C=N1 AK-77405 [1,1,0,0,0,0|2,0,0]=4 409 B7R1.2 NC1=CSC(Br)=N1 AK-54917 [1,1,0,0,0,0|2,0,0]=4 410 B7R1.2 NC1=CSC(C)=N1 AK165023 [1,1,0,0,0,0|2,0,0]=4 411 B7R1.2 NC1=NC(=CS1)Br AK-24535 [1,1,0,0,0,0|2,0,0]=4 412 B7R1.2 NC1=NC(N)=CS1 AK-68884 [1,1,0,0,0,0|2,0,0]=4 413 B7R1.2 NC1=NNC(C)=C1 AK-29128 [1,1,0,0,0,0|2,0,0]=4 414 B7R1.2 O=C1COC(C)=C1 AK142223 [1,1,0,0,0,0|2,0,0]=4 415 B7R1.2 O=C1NNC(C)=C1 AK-25972 [1,1,0,0,0,0|2,0,0]=4 416 B7R1.2 O=C1NOC(C)=C1 AK158281 [1,1,0,0,0,0|2,0,0]=4 417 B7R1.2 O=C1OC(C)=CC1 AK601784 [1,1,0,0,0,0|2,0,0]=4 418 B7R1.2 OC1=NC(Br)=CS1 AK112691 [1,1,0,0,0,0|2,0,0]=4 419 B7R1.2 OC1=NSC(Cl)=C1 AK-80655 [1,1,0,0,0,0|2,0,0]=4 420 B9R1.2 BrC1=CC(=CN=C1)CC AK-54800 [0,1,0,0,0,1|2,0,0]=4 421 B9R1.2 BrC1=CN=CC(=C1)CO AK-29246 [0,1,0,0,0,1|2,0,0]=4 422 B9R1.2 BrCC1=CC(I)=CC=C1 AK-54649 [0,1,0,0,0,1|2,0,0]=4 423 B9R1.2 BrCC1=CC=CC(Br)=N1 AK-48524 [0,1,0,0,0,1|2,0,0]=4 424 B9R1.2 C1=C(CO)C=CC=C1N AK-50595 [0,1,0,0,0,1|2,0,0]=4 425 B9R1.2 C1=C(NN)C=CC=C1C AK-47381 [0,1,0,0,0,1|2,0,0]=4 426 B9R1.2 C1=CC(=NC(=C1)C)C#N AK-29900 [0,1,0,0,0,1|1,0,1]=4 427 B9R1.2 C1=CC=C(N=C1OC)Br AK-25939 [0,1,0,0,0,1|2,0,0]=4 428 B9R1.2 C1=CC=C(N=C1OC)C AK-44038 [0,1,0,0,0,1|1,0,0]=3 429 B9R1.2 C1=CC=C(N=C1OC)Cl AK-25492 [0,1,0,0,0,1|2,0,0]=4 430 B9R1.2 CC1=CC(=CN=C1)C=O AK-28384 [0,1,0,0,0,1|1,0,1]=4 431 B9R1.2 CC1=CC(CCl)=NC=C1 AK-74194 [0,1,0,0,0,1|2,0,0]=4 432 B9R1.2 CC1=CC(CO)=NC=C1 AK-74173 [0,1,0,0,0,1|2,0,0]=4 433 B9R1.2 CC1=CC(OC)=NC=C1 AK-39493 [0,1,0,0,0,1|2,0,0]=4 434 B9R1.2 CC1=CC=CC(CBr)=N1 AK-44889 [0,1,0,0,0,1|1,0,0]=3 435 B9R1.2 CC1=CC=CC(CCl)=N1 AK-40015 [0,1,0,0,0,1|1,0,0]=3 436 B9R1.2 CC1=CN=CC(CBr)=C1 AK-56105 [0,1,0,0,0,1|1,0,0]=3 437 B9R1.2 CC1=NC=CC(OC)=N1 AK-59113 [0,1,0,0,0,1|2,0,0]=4 438 B9R1.2 CCC1=CC=CC(Br)=C1 AK111102 [0,1,0,0,0,1|2,0,0]=4 439 B9R1.2 CCC1=CC=CC(Br)=N1 AK-65167 [0,1,0,0,0,1|2,0,0]=4 440 B9R1.2 CNC1=CC=CC(Br)=C1 AK112706 [0,1,0,0,0,1|2,0,0]=4 441 B9R1.2 CNC1=NC(Cl)=CC=C1 AK-48574 [0,1,0,0,0,1|2,0,0]=4 442 B9R1.2 COC1=CC(Br)=CC=C1 AK-76817 [0,1,0,0,0,1|2,0,0]=4 443 B9R1.2 COC1=CC(C)=NC=C1 AK-67862 [0,1,0,0,0,1|2,0,0]=4 444 B9R1.2 COC1=CC(Cl)=CC=C1 AK106212 [0,1,0,0,0,1|2,0,0]=4 445 B9R1.2 COC1=CC=CC(F)=N1 AK130132 [0,1,0,0,0,1|2,0,0]=4 446 B9R1.2 COC1=CN=CC(=C1)O AK-28499 [0,1,0,0,0,1|2,0,0]=4 447 B9R1.2 COC1=CN=CC(Br)=C1 AK-26045 [0,1,0,0,0,1|2,0,0]=4 448 B9R1.2 COC1=CN=CC(I)=N1 AK-94548 [0,1,0,0,0,1|2,0,0]=4 449 B9R1.2 CSC1=CC=CC(Br)=N1 AK159822 [0,1,0,0,0,1|2,0,0]=4 450 B9R1.2 ClC1=CC(CO)=CC=C1 AK-51231 [0,1,0,0,0,1|2,0,0]=4 451 B9R1.2 ClC1=CC=CC(=N1)CO AK-28428 [0,1,0,0,0,1|2,0,0]=4 452 B9R1.2 ClC1=CN=CC(=C1)CO AK-23534 [0,1,0,0,0,1|2,0,0]=4 453 B9R1.2 ClC1=CN=CC(=N1)NC AK-41779 [0,1,0,0,0,1|2,0,0]=4 454 B9R1.2 ClC1=NC(=CN=C1)OC AK-29172 [0,1,0,0,0,1|2,0,0]=4 455 B9R1.2 ClCC1=CC(=CN=C1)C AK-33495 [0,1,0,0,0,1|1,0,0]=3 456 B9R1.2 ClCC1=CC(I)=CC=C1 AK-94390 [0,1,0,0,0,1|2,0,0]=4 457 B9R1.2 ClCC1=CC=CC(Br)=N1 AK151971 [0,1,0,0,0,1|2,0,0]=4 458 B9R1.2 ClCC1=CN=CC(Br)=C1 AK-88388 [0,1,0,0,0,1|2,0,0]=4 459 B9R1.2 FC1=CC(CO)=CC=C1 AK-51232 [0,1,0,0,0,1|2,0,0]=4 460 B9R1.2 FC1=CC=CC(CBr)=N1 AK-77216 [0,1,0,0,0,1|2,0,0]=4 461 B9R1.2 FC1=CC=CC(CCl)=N1 AK137993 [0,1,0,0,0,1|2,0,0]=4 462 B9R1.2 N(N)C1=NC(=CC=C1)C AK-35513 [0,1,0,0,0,1|2,0,0]=4 463 B9R1.2 NC1=CC(=CN=C1)OC AK-27775 [0,1,0,0,0,1|2,0,0]=4 464 B9R1.2 NC1=CC=CC(CN)=C1 AK-76655 [0,1,0,0,0,1|2,0,0]=4 465 B9R1.2 NC1=CC=CC(CO)=N1 AK-85732 [0,1,0,0,0,1|2,0,0]=4 466 B9R1.2 NC1=CC=CC(OC)=C1 AK309398 [0,1,0,0,0,1|2,0,0]=4 467 B9R1.2 NC1=CC=CC(SC)=C1 AK162933 [0,1,0,0,0,1|2,0,0]=4 468 B9R1.2 NC1=NC(=CC=C1)OC AK-27734 [0,1,0,0,0,1|2,0,0]=4 469 B9R1.2 NC1=NC(=CN=C1)OC AK-24224 [0,1,0,0,0,1|2,0,0]=4 470 B9R1.2 NC1=NC(CC)=CC=C1 AK-28992 [0,1,0,0,0,1|2,0,0]=4 471 B9R1.2 NCC1=CC(C)=NC=C1 AK130210 [0,1,0,0,0,1|2,0,0]=4 472 B9R1.2 NCC1=CC(F)=CC=C1 AK-80195 [0,1,0,0,0,1|2,0,0]=4 473 B9R1.2 NCC1=CC=CC(Br)=C1 AK-49144 [0,1,0,0,0,1|2,0,0]=4 474 B9R1.2 NCC1=CC=CC(C)=C1 AK-98167 [0,1,0,0,0,1|1,0,0]=3 475 B9R1.2 NCC1=CC=CC(Cl)=C1 AK-89641 [0,1,0,0,0,1|2,0,0]=4 476 B9R1.2 NCC1=CC=CC(I)=C1 AK-46127 [0,1,0,0,0,1|2,0,0]=4 477 B9R1.2 NCC1=NC(Br)=CC=C1 AK-39249 [0,1,0,0,0,1|2,0,0]=4 478 B9R1.2 NCC1=NC(Br)=CC=C1 AK-79055 [0,1,0,0,0,1|2,0,0]=4 479 B9R1.2 NCC1=NC(Cl)=CC=C1 AK105012 [0,1,0,0,0,1|2,0,0]=4 480 B9R1.2 NCC1=NC(Cl)=CN=C1 AK130178 [0,1,0,0,0,1|2,0,0]=4 481 B9R1.2 NCC1=NC(F)=CC=C1 AK112462 [0,1,0,0,0,1|2,0,0]=4 482 B9R1.2 O=CC1=NC(C)=CC=C1 AK-45099 [0,1,0,0,0,1|1,0,1]=4 483 B9R1.2 OC1=CC(CBr)=CC=C1 AK-99880 [0,1,0,0,0,1|2,0,0]=4 484 B9R1.2 OCC1=CC(C)=CN=C1 AK130310 [0,1,0,0,0,1|1,0,0]=3 485 B9R1.2 OCC1=CC(C)=NC=C1 AK-32751 [0,1,0,0,0,1|2,0,0]=4 486 B9R1.2 OCC1=CC(N)=CN=C1 AK135137 [0,1,0,0,0,1|2,0,0]=4 487 B9R1.2 OCC1=CC=CC(Br)=C1 AK110441 [0,1,0,0,0,1|2,0,0]=4 488 B9R1.2 OCC1=CC=CC(Br)=N1 AK-34739 [0,1,0,0,0,1|2,0,0]=4 489 B9R1.2 OCC1=CN=CC(Br)=N1 AK-68017 [0,1,0,0,0,1|2,0,0]=4 490 B9R1.2 OCC1=NC(C)=CC=C1 AK-47726 [0,1,0,0,0,1|1,0,0]=3 491 B9R1.2 OCC1=NC(Cl)=CC=C1 AK-29179 [0,1,0,0,0,1|2,0,0]=4 492 B9R1.2 OCC1=NC(Cl)=CN=C1 AK-98157 [0,1,0,0,0,1|2,0,0]=4 493 B9R1.3 BrC1=C(N)C(=CC=C1)C AK-40941 [0,1,0,0,0,1|2,0,0]=4 494 B9R1.3 C1=C(C(=C(C=C1)Cl)N)C AK-36668 [0,1,0,0,0,1|2,0,0]=4 495 B9R1.3 C1=CC=C(C(=C1C)Br)C AK-47475 [0,1,0,0,0,1|1,0,0]=3 496 B9R1.3 C1=CC=C(C(=C1Cl)I)C AK-35390 [0,1,0,0,0,1|2,0,0]=4 497 B9R1.3 CC1=C(Br)C(C)=NC=C1 AK-29971 [0,1,0,0,0,1|2,0,0]=4 498 B9R1.3 CC1=C(Br)C(F)=CC=C1 AK-53756 [0,1,0,0,0,1|2,0,0]=4 499 B9R1.3 CC1=C(Cl)C(C)=CC=C1 AK326084 [0,1,0,0,0,1|1,0,0]=3 500 B9R1.3 CC1=C(F)C(Br)=CC=C1 AK-53771 [0,1,0,0,0,1|2,0,0]=4 501 B9R1.3 CC1=C(F)C(C)=CC=C1 AK-35178 [0,1,0,0,0,1|1,0,0]=3 502 B9R1.3 CC1=C(I)C(Br)=CC=C1 AK167253 [0,1,0,0,0,1|2,0,0]=4 503 B9R1.3 CC1=C(I)C(F)=CC=C1 AK-36688 [0,1,0,0,0,1|2,0,0]=4 504 B9R1.3 CC1=CC=CC(Cl)=C1Br AK-76810 [0,1,0,0,0,1|2,0,0]=4 505 B9R1.3 CC1=CC=CC(I)=C1Cl AK-79122 [0,1,0,0,0,1|2,0,0]=4 506 B9R1.3 CC1=CN=CC(Br)=C1C AK-48087 [0,1,0,0,0,1|2,0,0]=4 507 B9R1.3 ClC1=C(C(=CN=C1)C)N AK-46573 [0,1,0,0,0,1|2,0,0]=4 508 B9R1.3 FC1=C(N)C(=CC=C1)C AK-26980 [0,1,0,0,0,1|2,0,0]=4 509 B9R1.3 NC1=C(Br)C=NC=C1C AK-29636 [0,1,0,0,0,1|2,0,0]=4 510 B9R1.3 NC1=C(C)C=CC=C1C AK135982 [0,1,0,0,0,1|1,0,0]=3 511 B9R1.3 NC1=C(C)C=NC=C1C AK-35144 [0,1,0,0,0,1|1,0,0]=3 512 B9R1.3 NC1=C(N)C(C)=CN=C1 AK-33220 [0,1,0,0,0,1|2,0,0]=4 513 B9R1.3 NC1=CC=CC(=C1F)C AK-33947 [0,1,0,0,0,1|2,0,0]=4 514 B9R1.3 NC1=CC=CC(=C1O)C AK-25505 [0,1,0,0,0,1|2,0,0]=4 515 B9R1.3 NC1=CC=CC(C)=C1Br AK-65165 [0,1,0,0,0,1|2,0,0]=4 516 B9R1.3 NC1=CC=CC(C)=C1Cl AK-65171 [0,1,0,0,0,1|2,0,0]=4 517 B9R1.3 NC1=CC=CC(C)=C1N AK-61303 [0,1,0,0,0,1|2,0,0]=4 518 B9R1.3 OC1=C(C)C=CC=C1Cl AK135681 [0,1,0,0,0,1|2,0,0]=4 519 B9R1.3 OC1=CC=CC(C)=C1Br AK-86289 [0,1,0,0,0,1|2,0,0]=4 520 B9R1.3 OC1=CC=CC(C)=C1F AK-36371 [0,1,0,0,0,1|2,0,0]=4 521 B9R1.3 OC1=CC=CC(C)=C1O AK-76819 [0,1,0,0,0,1|2,0,0]=4 522 B9R1.3 [BH3-][N+]1=C(C)C=CC=C1C AK153144 [0,1,0,0,0,1|1,0,0]=3 523 B9R1.34 BrC1=CC(=CC(=C1)C)F AK-34003 [0,1,0,0,0,1|2,0,0]=4 524 B9R1.34 BrC1=CC(=CC(=C1)O)C AK-31142 [0,1,0,0,0,1|2,0,0]=4 525 B9R1.34 BrC1=NC(=CC(=C1)C)C AK-26024 [0,1,0,0,0,1|2,0,0]=4 526 B9R1.34 C1=C(N)C=C(Br)C=C1C AK-36277 [0,1,0,0,0,1|2,0,0]=4 527 B9R1.34 C1=C(N=C(C=C1C)N)C AK-35566 [0,1,0,0,0,1|2,0,0]=4 528 B9R1.34 CC1=CC(=O)C=C(O)N1 AK-29243 [0,1,0,0,0,1|2,0,0]=4 529 B9R1.34 CC1=CC(Br)=CC(Br)=C1 AK-27065 [0,1,0,0,0,1|2,0,0]=4 530 B9R1.34 CC1=CC(Br)=CC(C)=C1 AK-49911 [0,1,0,0,0,1|1,0,0]=3 531 B9R1.34 CC1=CC(Br)=CC(C)=N1 AK-35389 [0,1,0,0,0,1|1,0,0]=3 532 B9R1.34 CC1=CC(Br)=CC(N)=N1 AK-55088 [0,1,0,0,0,1|2,0,0]=4 533 B9R1.34 CC1=CC(Br)=CC(O)=N1 AK-55089 [0,1,0,0,0,1|2,0,0]=4 534 B9R1.34 CC1=CC(C=C(C)N1)=O AK-25391 [0,1,0,0,0,1|1,0,0]=3 535 B9R1.34 CC1=CC(Cl)=CC(Br)=C1 AK-54890 [0,1,0,0,0,1|2,0,0]=4 536 B9R1.34 CC1=CC(Cl)=CC(C)=N1 AK-26952 [0,1,0,0,0,1|1,0,0]=3 537 B9R1.34 CC1=CC(Cl)=CC(Cl)=C1 AK-73039 [0,1,0,0,0,1|2,0,0]=4 538 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 AK-54975 [0,1,0,0,0,1|2,0,0]=4 539 B9R1.34 CC1=CC(Cl)=CC(N)=N1 AK-29225 [0,1,0,0,0,1|2,0,0]=4 540 B9R1.34 CC1=CC(F)=CC(F)=N1 AK100315 [0,1,0,0,0,1|2,0,0]=4 541 B9R1.34 CC1=CC(I)=CC(C)=C1 AK-44907 [0,1,0,0,0,1|1,0,0]=3 542 B9R1.34 CC1=CC(N)=CC(Cl)=N1 AK-40958 [0,1,0,0,0,1|2,0,0]=4 543 B9R1.34 CC1=CC(O)=CC(Cl)=C1 AK-35739 [0,1,0,0,0,1|2,0,0]=4 544 B9R1.34 CC1=CC(O)=CC(F)=C1 AK-37425 [0,1,0,0,0,1|2,0,0]=4 545 B9R1.34 CC1=CC(O)=NC(C)=C1 AK-63436 [0,1,0,0,0,1|2,0,0]=4 546 B9R1.34 CC1=NC(C)=NC(N)=C1 AK-29268 [0,1,0,0,0,1|2,0,0]=4 547 B9R1.34 CC1=NC(C)=NC(O)=C1 AK-54988 [0,1,0,0,0,1|2,0,0]=4 548 B9R1.34 ClC1=NC(=CC(=C1)C)C AK-46768 [0,1,0,0,0,1|2,0,0]=4 549 B9R1.34 ClC1=NC(=NC(=C1)C)C AK-21842 [0,1,0,0,0,1|2,0,0]=4 550 B9R1.34 FC1=CC(=CC(=C1)N)C AK-35464 [0,1,0,0,0,1|2,0,0]=4 551 B9R1.34 NC1=CC(C)=CC(Cl)=C1 AK-39878 [0,1,0,0,0,1|2,0,0]=4 552 B9R1.34 NC1=CC(C)=NC(C)=C1 AK-34805 [0,1,0,0,0,1|1,0,0]=3 553 B9R1.34 O=C1C=C(O)C=C(C)N1 AK-77080 [0,1,0,0,0,1|2,0,0]=4 554 B9R1.34 O=C1C=C(O)C=C(C)O1 AK-44057 [0,1,0,0,0,1|2,0,0]=4 555 B9R1.34 OC1=CC(C)=CC(N)=C1 AK-36326 [0,1,0,0,0,1|2,0,0]=4 556 B9R1.34 OC1=CC(C)=CC(O)=C1 AK-40748 [0,1,0,0,0,1|2,0,0]=4 557 B9R1.34 OC1=CC(Cl)=NC(C)=C1 AK150752 [0,1,0,0,0,1|2,0,0]=4 558 B9R1.69 BrC1=C(C=C(C=C1)C)N AK-26077 [0,1,0,0,0,1|2,0,0]=4 559 B9R1.69 BrC1=CC=C(N=C1C)Cl AK-25366 [0,1,0,0,0,1|2,0,0]=4 560 B9R1.69 BrC1=CN=C(C(=C1)C)C AK-55129 [0,1,0,0,0,1|2,0,0]=4 561 B9R1.69 BrC1=NC(=C(C=C1)Br)C AK-30361 [0,1,0,0,0,1|2,0,0]=4 562 B9R1.69 BrC1=NC=C(C=C1C)F AK-37290 [0,1,0,0,0,1|2,0,0]=4 563 B9R1.69 C1=C(Br)C=CC(=C1C)N AK-26154 [0,1,0,0,0,1|2,0,0]=4 564 B9R1.69 C1=C(Br)C=NC(=C1C)Br AK-25803 [0,1,0,0,0,1|2,0,0]=4 565 B9R1.69 C1=C(C(=CC=C1Br)O)C AK-25092 [0,1,0,0,0,1|2,0,0]=4 566 B9R1.69 C1=C(C(=CC=C1C)Br)Cl AK-53768 [0,1,0,0,0,1|2,0,0]=4 567 B9R1.69 C1=C(C(=CC=C1C)C)Br AK-47276 [0,1,0,0,0,1|2,0,0]=4 568 B9R1.69 C1=C(C(=CC=C1C)Cl)Br AK-35694 [0,1,0,0,0,1|2,0,0]=4 569 B9R1.69 C1=C(C(=CC=C1C)O)Cl AK-36041 [0,1,0,0,0,1|2,0,0]=4 570 B9R1.69 C1=C(C(=CC=C1F)O)C AK-35220 [0,1,0,0,0,1|2,0,0]=4 571 B9R1.69 C1=C(C(=CC=C1I)N)C AK-33113 [0,1,0,0,0,1|2,0,0]=4 572 B9R1.69 C1=C(C(=CC=C1N)F)C AK-35218 [0,1,0,0,0,1|2,0,0]=4 573 B9R1.69 C1=C(C(=CC=C1O)F)C AK-35219 [0,1,0,0,0,1|2,0,0]=4 574 B9R1.69 C1=C(C(=CC=C1O)N)C AK-47392 [0,1,0,0,0,1|2,0,0]=4 575 B9R1.69 C1=C(C(=NC(=C1)C)I)O AK-27802 [0,1,0,0,0,1|2,0,0]=4 576 B9R1.69 C1=C(C(=NC=C1Br)Cl)C AK-29098 [0,1,0,0,0,1|2,0,0]=4 577 B9R1.69 C1=C(C(=NC=C1C)Br)Br AK-25716 [0,1,0,0,0,1|2,0,0]=4 578 B9R1.69 C1=C(C)C=CC(=C1N)Cl AK-36982 [0,1,0,0,0,1|2,0,0]=4 579 B9R1.69 C1=C(C)C=CC(=C1N)F AK-35225 [0,1,0,0,0,1|2,0,0]=4 580 B9R1.69 C1=C(O)C(=NC(=C1)C)N AK-31272 [0,1,0,0,0,1|2,0,0]=4 581 B9R1.69 C1=CC(=C(N=C1Br)C)F AK-25869 [0,1,0,0,0,1|2,0,0]=4 582 B9R1.69 C1=CC(=NC(=C1Br)Cl)C AK-33834 [0,1,0,0,0,1|2,0,0]=4 583 B9R1.69 C1=CC(=NC(=C1N)C)Cl AK-27752 [0,1,0,0,0,1|2,0,0]=4 584 B9R1.69 C1=CC(=NC(=C1N)Cl)C AK-27681 [0,1,0,0,0,1|2,0,0]=4 585 B9R1.69 CC1=C(Br)C=CC(N)=N1 AK-25963 [0,1,0,0,0,1|2,0,0]=4 586 B9R1.69 CC1=C(Br)N=CC(N)=N1 AK-31830 [0,1,0,0,0,1|2,0,0]=4 587 B9R1.69 CC1=C(C)C=C(I)C=C1 AK-87089 [0,1,0,0,0,1|2,0,0]=4 588 B9R1.69 CC1=C(C)N=C(Br)C=N1 AK100474 [0,1,0,0,0,1|2,0,0]=4 589 B9R1.69 CC1=C(C)N=C(Cl)C=N1 AK100473 [0,1,0,0,0,1|2,0,0]=4 590 B9R1.69 CC1=C(I)C=CC(Cl)=C1 AK-34259 [0,1,0,0,0,1|2,0,0]=4 591 B9R1.69 CC1=C(I)C=CC(N)=N1 AK-29500 [0,1,0,0,0,1|2,0,0]=4 592 B9R1.69 CC1=CC(Br)=CC=C1Br AK-87179 [0,1,0,0,0,1|2,0,0]=4 593 B9R1.69 CC1=CC(Br)=CC=C1Cl AK-35614 [0,1,0,0,0,1|2,0,0]=4 594 B9R1.69 CC1=CC(Br)=CC=C1I AK-32928 [0,1,0,0,0,1|2,0,0]=4 595 B9R1.69 CC1=CC(Br)=CN=C1F AK-25719 [0,1,0,0,0,1|2,0,0]=4 596 B9R1.69 CC1=CC(C)=NC=C1Br AK-80658 [0,1,0,0,0,1|2,0,0]=4 597 B9R1.69 CC1=CC(Cl)=CC=C1F AK-53753 [0,1,0,0,0,1|2,0,0]=4 598 B9R1.69 CC1=CC(Cl)=CN=C1Br AK-28447 [0,1,0,0,0,1|2,0,0]=4 599 B9R1.69 CC1=CC(Cl)=CN=C1Cl AK-35794 [0,1,0,0,0,1|2,0,0]=4 600 B9R1.69 CC1=CC(Cl)=CN=C1O AK-84432 [0,1,0,0,0,1|2,0,0]=4 601 B9R1.69 CC1=CC(F)=CC=C1Br AK-35216 [0,1,0,0,0,1|2,0,0]=4 602 B9R1.69 CC1=CC(F)=CC=C1I AK-86335 [0,1,0,0,0,1|2,0,0]=4 603 B9R1.69 CC1=CC(F)=CC=C1N AK-27007 [0,1,0,0,0,1|2,0,0]=4 604 B9R1.69 CC1=CC(I)=C(Br)C=C1 AK-40336 [0,1,0,0,0,1|2,0,0]=4 605 B9R1.69 CC1=CC(I)=CC=C1Br AK-34004 [0,1,0,0,0,1|2,0,0]=4 606 B9R1.69 CC1=CC(I)=CC=C1F AK-35217 [0,1,0,0,0,1|2,0,0]=4 607 B9R1.69 CC1=CC(I)=CN=C1Br AK-30274 [0,1,0,0,0,1|2,0,0]=4 608 B9R1.69 CC1=CC(I)=CN=C1Cl AK-30039 [0,1,0,0,0,1|2,0,0]=4 609 B9R1.69 CC1=CC(N)=CN=C1Br AK-25887 [0,1,0,0,0,1|2,0,0]=4 610 B9R1.69 CC1=CC(N)=CN=C1F AK-25540 [0,1,0,0,0,1|2,0,0]=4 611 B9R1.69 CC1=CC(O)=C(Br)C=C1 AK-89491 [0,1,0,0,0,1|2,0,0]=4 612 B9R1.69 CC1=CC(O)=CN=C1Br AK-41464 [0,1,0,0,0,1|2,0,0]=4 613 B9R1.69 CC1=CC=C(Br)C(Br)=C1 AK-86340 [0,1,0,0,0,1|2,0,0]=4 614 B9R1.69 CC1=CC=C(Br)C(Br)=N1 AK-29953 [0,1,0,0,0,1|2,0,0]=4 615 B9R1.69 CC1=CC=C(Br)C(C)=N1 AK-25808 [0,1,0,0,0,1|1,0,0]=3 616 B9R1.69 CC1=CC=C(Br)C(F)=C1 AK-43505 [0,1,0,0,0,1|2,0,0]=4 617 B9R1.69 CC1=CC=C(Br)C(F)=N1 AK-29244 [0,1,0,0,0,1|2,0,0]=4 618 B9R1.69 CC1=CC=C(Br)C(N)=N1 AK-33048 [0,1,0,0,0,1|2,0,0]=4 619 B9R1.69 CC1=CC=C(C)C(N)=N1 AK-29554 [0,1,0,0,0,1|2,0,0]=4 620 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 AK-51652 [0,1,0,0,0,1|2,0,0]=4 621 B9R1.69 CC1=CC=C(Cl)N=C1C AK121756 [0,1,0,0,0,1|2,0,0]=4 622 B9R1.69 CC1=CC=C(F)C(Br)=N1 AK-29239 [0,1,0,0,0,1|2,0,0]=4 623 B9R1.69 CC1=CC=C(F)C(Cl)=C1 AK-53765 [0,1,0,0,0,1|2,0,0]=4 624 B9R1.69 CC1=CC=C(F)C(Cl)=N1 AK-29237 [0,1,0,0,0,1|2,0,0]=4 625 B9R1.69 CC1=CC=C(F)C(I)=C1 AK115137 [0,1,0,0,0,1|2,0,0]=4 626 B9R1.69 CC1=CC=C(I)C(Br)=C1 AK117493 [0,1,0,0,0,1|2,0,0]=4 627 B9R1.69 CC1=CC=C(I)C(F)=C1 AK-35223 [0,1,0,0,0,1|2,0,0]=4 628 B9R1.69 CC1=CC=C(I)C(F)=N1 AK-36693 [0,1,0,0,0,1|2,0,0]=4 629 B9R1.69 CC1=CC=C(N)C(Br)=N1 AK-25340 [0,1,0,0,0,1|2,0,0]=4 630 B9R1.69 CC1=CC=C(N)C(N)=C1 AK-45900 [0,1,0,0,0,1|2,0,0]=4 631 B9R1.69 CC1=CC=C(O)C(Br)=N1 AK-31903 [0,1,0,0,0,1|2,0,0]=4 632 B9R1.69 CC1=CN=C(Br)C(C)=C1 AK-41105 [0,1,0,0,0,1|1,0,0]=3 633 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 AK-30276 [0,1,0,0,0,1|2,0,0]=4 634 B9R1.69 CC1=CN=C(Br)C(F)=C1 AK-37281 [0,1,0,0,0,1|2,0,0]=4 635 B9R1.69 CC1=CN=C(C)C(C)=N1 AK114354 [0,1,0,0,0,1|1,0,0]=3 636 B9R1.69 CC1=CN=C(C)C(Cl)=N1 AK-44807 [0,1,0,0,0,1|2,0,0]=4 637 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 AK-26896 [0,1,0,0,0,1|2,0,0]=4 638 B9R1.69 CC1=CN=C(Cl)C(C)=N1 AK-32060 [0,1,0,0,0,1|1,0,0]=3 639 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 AK-76719 [0,1,0,0,0,1|2,0,0]=4 640 B9R1.69 CC1=CN=C(Cl)C(N)=C1 AK-29196 [0,1,0,0,0,1|2,0,0]=4 641 B9R1.69 CC1=CN=C(F)C(Br)=C1 AK-27161 [0,1,0,0,0,1|2,0,0]=4 642 B9R1.69 CC1=CN=C(F)C(C)=C1 AK-61470 [0,1,0,0,0,1|1,0,0]=3 643 B9R1.69 CC1=NC(Br)=CC=C1Cl AK-51011 [0,1,0,0,0,1|2,0,0]=4 644 B9R1.69 CC1=NC(Br)=CC=C1N AK-25062 [0,1,0,0,0,1|2,0,0]=4 645 B9R1.69 CC1=NC(C)=C(Br)C=N1 AK100705 [0,1,0,0,0,1|2,0,0]=4 646 B9R1.69 CC1=NC(Cl)=CC=C1I AK-29931 [0,1,0,0,0,1|2,0,0]=4 647 B9R1.69 CC1=NC(Cl)=CN=C1Cl AK167866 [0,1,0,0,0,1|2,0,0]=4 648 B9R1.69 CC1=NC(F)=CC=C1Br AK-34913 [0,1,0,0,0,1|2,0,0]=4 649 B9R1.69 CC1=NC(F)=CC=C1O AK478670 [0,1,0,0,0,1|2,0,0]=4 650 B9R1.69 CC1=NC(I)=C(C)N=C1 AK-80700 [0,1,0,0,0,1|2,0,0]=4 651 B9R1.69 CC1=NC=C(N)C(C)=C1 AK-32962 [0,1,0,0,0,1|2,0,0]=4 652 B9R1.69 ClC1=C(C=C(C=C1)C)F AK-46384 [0,1,0,0,0,1|2,0,0]=4 653 B9R1.69 ClC1=C(C=C(C=C1)I)C AK-32929 [0,1,0,0,0,1|2,0,0]=4 654 B9R1.69 ClC1=CC=C(C(=N1)C)F AK-30362 [0,1,0,0,0,1|2,0,0]=4 655 B9R1.69 ClC1=CN=C(C(=C1)C)F AK-27062 [0,1,0,0,0,1|2,0,0]=4 656 B9R1.69 ClC1=NC=C(C=C1C)F AK-29981 [0,1,0,0,0,1|2,0,0]=4 657 B9R1.69 ClC1=NC=C(C=C1F)C AK-25816 [0,1,0,0,0,1|2,0,0]=4 658 B9R1.69 FC1=CN=C(C(=C1)C)N AK-26810 [0,1,0,0,0,1|2,0,0]=4 659 B9R1.69 FC1=NC=C(C=C1I)C AK-33428 [0,1,0,0,0,1|2,0,0]=4 660 B9R1.69 IC1=C(C=C(C=C1)O)C AK-46586 [0,1,0,0,0,1|2,0,0]=4 661 B9R1.69 NC1=CC(=CN=C1Br)C AK-29197 [0,1,0,0,0,1|2,0,0]=4 662 B9R1.69 NC1=CC(C)=C(Cl)N=C1 AK-25886 [0,1,0,0,0,1|2,0,0]=4 663 B9R1.69 NC1=CC(C)=CC=C1I AK-33114 [0,1,0,0,0,1|2,0,0]=4 664 B9R1.69 NC1=CC=C(Br)C(C)=C1 AK-46353 [0,1,0,0,0,1|2,0,0]=4 665 B9R1.69 NC1=CC=C(C)C=C1Br AK-35743 [0,1,0,0,0,1|2,0,0]=4 666 B9R1.69 NC1=CC=C(C)C=C1Cl AK-35861 [0,1,0,0,0,1|2,0,0]=4 667 B9R1.69 NC1=CC=C(C)C=C1F AK-25990 [0,1,0,0,0,1|2,0,0]=4 668 B9R1.69 NC1=CC=C(C)C=C1I AK-41007 [0,1,0,0,0,1|2,0,0]=4 669 B9R1.69 NC1=CC=C(C)N=C1C AK-39495 [0,1,0,0,0,1|1,0,0]=3 670 B9R1.69 NC1=CC=C(C)N=C1I AK140953 [0,1,0,0,0,1|2,0,0]=4 671 B9R1.69 NC1=CC=C(Cl)C(C)=C1 AK-54911 [0,1,0,0,0,1|2,0,0]=4 672 B9R1.69 NC1=CN=C(C)N=C1C AK-25843 [0,1,0,0,0,1|2,0,0]=4 673 B9R1.69 NC1=NC(=C(C=C1)F)C AK-37271 [0,1,0,0,0,1|2,0,0]=4 674 B9R1.69 NC1=NC(C)=C(C)C=C1 AK130279 [0,1,0,0,0,1|2,0,0]=4 675 B9R1.69 NC1=NC(C)=C(C)N=C1 AK-92908 [0,1,0,0,0,1|2,0,0]=4 676 B9R1.69 NC1=NC(C)=CC=C1I AK-77647 [0,1,0,0,0,1|2,0,0]=4 677 B9R1.69 NC1=NC(C)=CC=C1N AK150580 [0,1,0,0,0,1|2,0,0]=4 678 B9R1.69 NC1=NC(C)=CN=C1C AK-80606 [0,1,0,0,0,1|2,0,0]=4 679 B9R1.69 NC1=NC(C)=CN=C1Cl AK137305 [0,1,0,0,0,1|2,0,0]=4 680 B9R1.69 NC1=NC=C(Br)C=C1C AK-25805 [0,1,0,0,0,1|2,0,0]=4 681 B9R1.69 NC1=NC=C(C)C=C1C AK-68338 [0,1,0,0,0,1|1,0,0]=3 682 B9R1.69 NC1=NC=C(C)C=C1I AK135401 [0,1,0,0,0,1|2,0,0]=4 683 B9R1.69 NC1=NC=C(C=C1N)C AK-29062 [0,1,0,0,0,1|2,0,0]=4 684 B9R1.69 NC1=NC=C(Cl)C=C1C AK-30404 [0,1,0,0,0,1|2,0,0]=4 685 B9R1.69 NC1=NC=C(I)C=C1C AK-30269 [0,1,0,0,0,1|2,0,0]=4 686 B9R1.69 NC1=NC=C(N=C1Br)C AK-24581 [0,1,0,0,0,1|2,0,0]=4 687 B9R1.69 NC1=NC=C(N=C1C)Br AK-24942 [0,1,0,0,0,1|2,0,0]=4 688 B9R1.69 NC1=NC=C(N=C1Cl)C AK-23580 [0,1,0,0,0,1|2,0,0]=4 689 B9R1.69 O=C1C(C)=CC(Br)=CN1 AK-30177 [0,1,0,0,0,1|2,0,0]=4 690 B9R1.69 O=C1C(C)=CC(C=C1)=O AK307409 [0,1,0,0,0,1|2,0,0]=4 691 B9R1.69 O=C1C(Cl)=NC(C)=CN1 AK137298 [0,1,0,0,0,1|2,0,0]=4 692 B9R1.69 O=C1C(N)=CC(C)=CN1 AK-40029 [0,1,0,0,0,1|2,0,0]=4 693 B9R1.69 O=C1C(N)=NC=C(C)N1 AK143808 [0,1,0,0,0,1|2,0,0]=4 694 B9R1.69 O=C1C=CC(I)=C(C)N1 AK-53679 [0,1,0,0,0,1|2,0,0]=4 695 B9R1.69 OC1=CC(C)=C(Cl)N=C1 AK-29367 [0,1,0,0,0,1|2,0,0]=4 696 B9R1.69 OC1=CC(C)=CC=C1F AK-35958 [0,1,0,0,0,1|2,0,0]=4 697 B9R1.69 OC1=CC(C)=CC=C1N AK-86217 [0,1,0,0,0,1|2,0,0]=4 698 B9R1.69 OC1=CC(C)=CN=C1Cl AK126258 [0,1,0,0,0,1|2,0,0]=4 699 B9R1.69 OC1=CC=C(Br)N=C1C AK-61491 [0,1,0,0,0,1|2,0,0]=4 700 B9R1.69 OC1=CC=C(C)C=C1Br AK-36035 [0,1,0,0,0,1|2,0,0]=4 701 B9R1.69 OC1=CC=C(C)C=C1F AK-53739 [0,1,0,0,0,1|2,0,0]=4 702 B9R1.69 OC1=CC=C(C)C=C1I AK137668 [0,1,0,0,0,1|2,0,0]=4 703 B9R1.69 OC1=CC=C(C)C=C1O AK163402 [0,1,0,0,0,1|2,0,0]=4 704 B9R1.69 OC1=CC=C(C)N=C1C AK-28572 [0,1,0,0,0,1|1,0,0]=3 705 B9R1.69 OC1=CC=C(Cl)N=C1C AK-84114 [0,1,0,0,0,1|2,0,0]=4 706 B9R1.69 OC1=CC=C(N)C=C1C AK-34509 [0,1,0,0,0,1|2,0,0]=4 707 B9R1.69 OC1=CN=C(C)N=C1C AK-94007 [0,1,0,0,0,1|2,0,0]=4 708 B9R1.69 OC1=NC(C)=C(Br)C=C1 AK-27759 [0,1,0,0,0,1|2,0,0]=4 709 B9R1.69 OC1=NC=C(Br)N=C1C AK136185 [0,1,0,0,0,1|2,0,0]=4 710 B9R1.69 OC1=NC=C(C)C=C1Br AK-63321 [0,1,0,0,0,1|2,0,0]=4 711 B9R1.69 OC1=NC=C(I)C=C1C AK102572 [0,1,0,0,0,1|2,0,0]=4 712 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [0,1,0,0,0,1|2,0,0]=4 713 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [0,1,0,0,0,1|2,0,0]=4 714 B9R1.15 BrC1=CN=CN=C1NC AK-31820 [0,1,0,0,0,1|2,0,0]=4 715 B9R1.15 BrCC1=C(I)C=CC=C1 AK-54648 [0,1,0,0,0,1|2,0,0]=4 716 B9R1.15 BrCC1=NC=CC=C1Br AK158877 [0,1,0,0,0,1|2,0,0]=4 717 B9R1.15 C(C)C1=NC=NC=C1F AK-23771 [0,1,0,0,0,1|2,0,0]=4 718 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [0,1,0,0,0,1|2,0,0]=4 719 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [0,1,0,0,0,1|2,0,0]=4 720 B9R1.15 C1=C(C(=CC=C1)Cl)CO AK-46748 [0,1,0,0,0,1|2,0,0]=4 721 B9R1.15 C1=C(C(=CC=N1)C)C#N AK-28504 [0,1,0,0,0,1|1,0,1]=4 722 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [0,1,0,0,0,1|2,0,0]=4 723 B9R1.15 C1=CC=CC(=C1CO)Br AK-51234 [0,1,0,0,0,1|2,0,0]=4 724 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [0,1,0,0,0,1|2,0,0]=4 725 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [0,1,0,0,0,1|2,0,0]=4 726 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [0,1,0,0,0,1|2,0,0]=4 727 B9R1.15 C1=CC=NC(=C1C)C#N AK-25587 [0,1,0,0,0,1|1,0,1]=4 728 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [0,1,0,0,0,1|2,0,0]=4 729 B9R1.15 CC1=C(CBr)C=NC=C1 AK137963 [0,1,0,0,0,1|1,0,0]=3 730 B9R1.15 CC1=C(CCl)C=NC=C1 AK143692 [0,1,0,0,0,1|1,0,0]=3 731 B9R1.15 CC1=CC=CC=C1CC AK-49977 [0,1,0,0,0,1|1,0,0]=3 732 B9R1.15 CC1=CC=CN=C1CCl AK-77025 [0,1,0,0,0,1|1,0,0]=3 733 B9R1.15 CC1=CC=CN=C1OC AK126197 [0,1,0,0,0,1|1,0,0]=3 734 B9R1.15 CC1=NC=CC=C1C#N AK-32548 [0,1,0,0,0,1|1,0,1]=4 735 B9R1.15 CC1=NC=CN=C1CC AK114356 [0,1,0,0,0,1|2,0,0]=4 736 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [0,1,0,0,0,1|2,0,0]=4 737 B9R1.15 CCC1=C(Br)C=NC=C1 AK-81618 [0,1,0,0,0,1|2,0,0]=4 738 B9R1.15 CCC1=CN=CN=C1Cl AK-25151 [0,1,0,0,0,1|2,0,0]=4 739 B9R1.15 CCC1=NC=CC=C1Br AK128590 [0,1,0,0,0,1|2,0,0]=4 740 B9R1.15 CCC1=NC=NC=C1Br AK105597 [0,1,0,0,0,1|2,0,0]=4 741 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [0,1,0,0,0,1|2,0,0]=4 742 B9R1.15 CNC1=CC=CC=C1F AK-48931 [0,1,0,0,0,1|2,0,0]=4 743 B9R1.15 CNC1=CC=CN=C1Cl AK115045 [0,1,0,0,0,1|2,0,0]=4 744 B9R1.15 CNC1=NC=CC=C1Cl AK140218 [0,1,0,0,0,1|2,0,0]=4 745 B9R1.15 COC1=C(Br)C=NC=C1 AK-36460 [0,1,0,0,0,1|2,0,0]=4 746 B9R1.15 COC1=C(C)N=CC=N1 AK-29085 [0,1,0,0,0,1|2,0,0]=4 747 B9R1.15 COC1=C(I)C=NC=C1 AK-26421 [0,1,0,0,0,1|2,0,0]=4 748 B9R1.15 COC1=CC=CC=C1Br AK-76806 [0,1,0,0,0,1|2,0,0]=4 749 B9R1.15 COC1=CC=CN=C1Br AK-29048 [0,1,0,0,0,1|2,0,0]=4 750 B9R1.15 COC1=CC=CN=C1F AK-63160 [0,1,0,0,0,1|2,0,0]=4 751 B9R1.15 COC1=CN=CN=C1Cl AK-30681 [0,1,0,0,0,1|2,0,0]=4 752 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [0,1,0,0,0,1|2,0,0]=4 753 B9R1.15 COC1=NC=CC=C1F AK-33314 [0,1,0,0,0,1|2,0,0]=4 754 B9R1.15 COC1=NC=NC=C1Br AK133377 [0,1,0,0,0,1|2,0,0]=4 755 B9R1.15 COC1=NC=NC=C1Cl AK147276 [0,1,0,0,0,1|2,0,0]=4 756 B9R1.15 COC1=NC=NC=C1I AK-37534 [0,1,0,0,0,1|2,0,0]=4 757 B9R1.15 CSC1=NC=CN=C1C AK-53396 [0,1,0,0,0,1|2,0,0]=4 758 B9R1.15 ClC1=CC=CN=C1CBr AK138503 [0,1,0,0,0,1|2,0,0]=4 759 B9R1.15 ClCC1=NC=CC=C1Cl AK109982 [0,1,0,0,0,1|2,0,0]=4 760 B9R1.15 ClCC1=NC=CC=C1Cl AK138192 [0,1,0,0,0,1|2,0,0]=4 761 B9R1.15 FC1=C(C=CN=C1)CN AK-49033 [0,1,0,0,0,1|2,0,0]=4 762 B9R1.15 FC1=CC=CN=C1CBr AK128379 [0,1,0,0,0,1|2,0,0]=4 763 B9R1.15 FC1=CC=CN=C1CCl AK109609 [0,1,0,0,0,1|2,0,0]=4 764 B9R1.15 FC1=CC=CN=C1CO AK-29127 [0,1,0,0,0,1|2,0,0]=4 765 B9R1.15 FC1=NC=CC=C1CN AK-30140 [0,1,0,0,0,1|2,0,0]=4 766 B9R1.15 NC1=C(C=CN=C1)OC AK-27262 [0,1,0,0,0,1|2,0,0]=4 767 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [0,1,0,0,0,1|2,0,0]=4 768 B9R1.15 NC1=CC=CC=C1NC AK-35283 [0,1,0,0,0,1|2,0,0]=4 769 B9R1.15 NC1=CC=CN=C1OC AK-28363 [0,1,0,0,0,1|2,0,0]=4 770 B9R1.15 NC1=NC=CC=C1OC AK-25256 [0,1,0,0,0,1|2,0,0]=4 771 B9R1.15 NC1=NC=NC=C1OC AK115134 [0,1,0,0,0,1|2,0,0]=4 772 B9R1.15 NCC1=CC=CC=C1C AK-89642 [0,1,0,0,0,1|1,0,0]=3 773 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [0,1,0,0,0,1|2,0,0]=4 774 B9R1.15 NCC1=CC=CC=C1F AK-88519 [0,1,0,0,0,1|2,0,0]=4 775 B9R1.15 NCC1=CC=CC=C1I AK-94126 [0,1,0,0,0,1|2,0,0]=4 776 B9R1.15 NCC1=NC=CC=C1C AK122548 [0,1,0,0,0,1|1,0,0]=3 777 B9R1.15 NCC1=NC=CC=C1Cl AK-41569 [0,1,0,0,0,1|2,0,0]=4 778 B9R1.15 O=C1C(CN)=CC=CN1 AK-76048 [0,1,0,0,0,1|2,0,0]=4 779 B9R1.15 O=CC1=C(C)N=CC=C1 AK-35801 [0,1,0,0,0,1|1,0,1]=4 780 B9R1.15 O=CC1=NC=CC=C1C AK-26127 [0,1,0,0,0,1|1,0,1]=4 781 B9R1.15 OC1=CC=CC=C1CN AK-49022 [0,1,0,0,0,1|2,0,0]=4 782 B9R1.15 OC1=CC=CC=C1CN AK167666 [0,1,0,0,0,1|2,0,0]=4 783 B9R1.15 OC1=CC=CC=C1OC AK114448 [0,1,0,0,0,1|2,0,0]=4 784 B9R1.15 OC1=CC=CN=C1CN AK-82086 [0,1,0,0,0,1|2,0,0]=4 785 B9R1.15 OC1=CC=CN=C1OC AK261041 [0,1,0,0,0,1|2,0,0]=4 786 B9R1.15 OCC1=C(Br)C=CN=C1 AK-86110 [0,1,0,0,0,1|2,0,0]=4 787 B9R1.15 OCC1=C(Br)C=NC=C1 AK-38288 [0,1,0,0,0,1|2,0,0]=4 788 B9R1.15 OCC1=C(Cl)C=CN=C1 AK124400 [0,1,0,0,0,1|2,0,0]=4 789 B9R1.15 OCC1=C(F)C=NC=C1 AK-90171 [0,1,0,0,0,1|2,0,0]=4 790 B9R1.15 OCC1=C(N)C=CN=C1 AK-58822 [0,1,0,0,0,1|2,0,0]=4 791 B9R1.15 OCC1=C(N)C=NC=C1 AK-74165 [0,1,0,0,0,1|2,0,0]=4 792 B9R1.15 OCC1=CC=CC=C1I AK-77177 [0,1,0,0,0,1|2,0,0]=4 793 B9R1.15 OCC1=CC=CC=C1N AK-49868 [0,1,0,0,0,1|2,0,0]=4 794 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [0,1,0,0,0,1|2,0,0]=4 795 B9R1.15 OCC1=CC=CN=C1F AK-33110 [0,1,0,0,0,1|2,0,0]=4 796 B9R1.15 OCC1=NC=CC=C1Cl AK133056 [0,1,0,0,0,1|2,0,0]=4 797 B9R1.14 COC1=CSC=C1OC AK-24708 [0,2,0,0,0,0|0,0,0]=2 798 B9R1.14 N#CC1=CSC=C1C#N AK-59693 [0,2,0,0,0,0|0,0,2]=4 799 B9R1.27 CC1=NOC(C)=C1CCl AK-33949 [0,2,0,0,0,0|1,1,0]=4 800 B9R1.27 CC1=NOC(C)=C1CN AK-33105 [0,2,0,0,0,0|1,1,0]=4 801 B9R1.27 N#CC1=C(N)SC=C1O AK-43809 [0,2,0,0,0,0|1,0,1]=4 802 B9R1.27 O=C1NCC(C)=C1CC AK-26320 [0,2,0,0,0,0|1,0,1]=4 803 B9R1.41 CC(C1=CC=CN1C)=O AK148515 [0,2,0,0,0,0|2,0,0]=4 804 B9R1.41 CC(C1=CN=CN1C)=O AK140652 [0,2,0,0,0,0|2,0,0]=4 805 B9R1.41 O=C(C1=CSC=C1C)O AK-64461 [0,2,0,0,0,0|0,0,1]=3 806 B9R1.37 BrC1=C(Br)C(Br)=C(Br)S1 AK-76821 [0,2,0,0,0,0|2,0,0]=4 807 B9R1.37 O=C1C(C)=C(C)C(O1)=O AK-47494 [0,2,0,0,0,0|0,1,0]=3 808 B7R1.3 C1=C(C)C=NC=N1 AK-30562 [0,0,1,1,0,0|2,0,0]=4 809 B9R2.50 C1CC2=CC=CC=C12 AK109544 [0,0,0,1,0,1|1,0,0]=3 810 B9R2.3 C=12CNCC1C=NN2 AK-31553 [0,1,0,1,0,0|2,0,0]=4