0 B11R2.10 BrC1=CC2=C(N1)N=CC=C2 AK-42548 [0,0,0,0,0,0|3,0,1]=4 1 B11R2.10 BrC1=CC2=C(S1)C=CC=C2 AK-35557 [0,0,0,0,0,0|2,1,0]=3 2 B11R2.10 BrC1=CC2=CC=CN=C2S1 AK138413 [0,0,0,0,0,0|3,1,0]=4 3 B11R2.10 BrC1=C[N]2C(=N1)C=CC=C2 AK-27151 [0,0,0,0,0,0|3,0,0]=3 4 B11R2.10 BrC1=NC2=C(N1)C=CC=C2 AK-35600 [0,0,0,0,0,0|2,0,0]=2 5 B11R2.10 BrC1=NC2=CC=CN=C2S1 AK-27149 [0,0,0,0,0,0|2,1,0]=3 6 B11R2.10 C1=C([NH]C2=CC=CC=C12)C AK-44448 [0,0,0,0,0,0|1,0,1]=2 7 B11R2.10 C1=C2NC(=O)NC2=CC=C1 AK-45018 [0,0,0,0,0,0|2,0,1]=3 8 B11R2.10 C1=CC=CC2=C1C=C(Br)C2 AK-47275 [0,0,0,0,0,0|3,0,0]=3 9 B11R2.10 C1=CC=CC2=C1N=C(Cl)S2 AK-44922 [0,0,0,0,0,0|1,1,0]=2 10 B11R2.10 C1=CC=CC2=C1NC(S2)=O AK-49174 [0,0,0,0,0,0|1,1,1]=3 11 B11R2.10 C1=CC=CC2=C1SC(=N2)Br AK-27048 [0,0,0,0,0,0|1,1,0]=2 12 B11R2.10 C1=CC=NC2=C1OC(N2)=O AK-28047 [0,0,0,0,0,0|2,0,1]=3 13 B11R2.10 CC1=CC2=C(S1)C=CC=C2 AK110745 [0,0,0,0,0,0|1,1,0]=2 14 B11R2.10 CC1=CC2=CC=CC=C2C1 AK-79371 [0,0,0,0,0,0|2,0,0]=2 15 B11R2.10 CC1=CC2=CC=CN=C2N1 AK-25051 [0,0,0,0,0,0|2,0,1]=3 16 B11R2.10 CC1=NC2=C(N1)C=NC=N2 AK101630 [0,0,0,0,0,0|3,0,0]=3 17 B11R2.10 CC1=NC2=C(S1)C=CC=C2 AK-45781 [0,0,0,0,0,0|0,1,0]=1 18 B11R2.10 CC1=NC2=CC=CC=C2N1 AK-44028 [0,0,0,0,0,0|1,0,0]=1 19 B11R2.10 CC1=NC2=CC=CC=C2O1 AK161761 [0,0,0,0,0,0|0,0,0]=0 20 B11R2.10 CC1=NC2=NC=CC=C2N1 AK-39947 [0,0,0,0,0,0|2,0,0]=2 21 B11R2.10 CC1=NC2=NC=CC=C2O1 AK-30675 [0,0,0,0,0,0|1,0,0]=1 22 B11R2.10 ClC1=NC2=C(S1)C=CC=N2 AK-31093 [0,0,0,0,0,0|2,1,0]=3 23 B11R2.10 ClC1=NC2=C(S1)C=CN=C2 AK-31092 [0,0,0,0,0,0|2,1,0]=3 24 B11R2.10 ClC1=NC2=C(S1)N=CC=C2 AK-81049 [0,0,0,0,0,0|2,1,0]=3 25 B11R2.10 ClC1=NC2=CC=CC=C2N1 AK-26782 [0,0,0,0,0,0|2,0,0]=2 26 B11R2.10 ClC1=NC2=NC=CC=C2O1 AK170313 [0,0,0,0,0,0|2,0,0]=2 27 B11R2.10 ClC1=NN2C=CC=CC2=C1 AK-35822 [0,0,0,0,0,0|3,0,0]=3 28 B11R2.10 ClC=1NC2=C(C1)C=CC=C2 AK-48803 [0,0,0,0,0,0|2,0,1]=3 29 B11R2.10 IC1=CC2=C(N1)C=CC=C2 AK110346 [0,0,0,0,0,0|2,0,1]=3 30 B11R2.10 IC1=CC2=CC=CN=C2N1 AK-76575 [0,0,0,0,0,0|3,0,1]=4 31 B11R2.10 IC1=NC2=C(S1)C=CC=C2 AK-24182 [0,0,0,0,0,0|1,1,0]=2 32 B11R2.10 N1C2=CC=CN=C2NC1=O AK-24800 [0,0,0,0,0,0|3,0,1]=4 33 B11R2.10 N1C2=NC=CC=C2CC1=O AK-23546 [0,0,0,0,0,0|3,0,1]=4 34 B11R2.10 NC1=CC2=C(S1)C=CC=C2 AK-51344 [0,0,0,0,0,0|2,1,0]=3 35 B11R2.10 NC1=NC2=C(O1)C=CN=C2 AK-80598 [0,0,0,0,0,0|2,0,0]=2 36 B11R2.10 NC1=NC2=CC=CC=C2N1 AK-54965 [0,0,0,0,0,0|2,0,0]=2 37 B11R2.10 NC1=NC2=CC=CC=C2O1 AK-35247 [0,0,0,0,0,0|1,0,0]=1 38 B11R2.10 NC1=NC2=CC=CC=C2S1 AK-41354 [0,0,0,0,0,0|1,1,0]=2 39 B11R2.10 NC1=NN2C(C=NC=C2)=N1 AK341375 [0,0,0,0,0,0|4,0,0]=4 40 B11R2.10 NC1CC2=C(C=CC=C2)C1 AK-51756 [0,0,0,0,0,0|3,0,1]=4 41 B11R2.10 O=C1CC2=NC=CC=C2N1 AK-39930 [0,0,0,0,0,0|3,0,1]=4 42 B11R2.10 O=C1N=C2C=CC=CN2C1 AK-80162 [0,0,0,0,0,0|3,0,0]=3 43 B11R2.10 O=C1NC2=C(C1)C=CN=C2 AK-90208 [0,0,0,0,0,0|3,0,1]=4 44 B11R2.10 O=C1NC2=C(C=CC=C2)C1 AK-49964 [0,0,0,0,0,0|2,0,1]=3 45 B11R2.10 O=C1NC2=C(N1)C=NC=C2 AK161520 [0,0,0,0,0,0|3,0,1]=4 46 B11R2.10 O=C1NN2C=CC=CC2=C1 AK-89755 [0,0,0,0,0,0|3,0,1]=4 47 B11R2.10 O=C1OC2=CC=CC=C2C1 AK-77806 [0,0,0,0,0,0|2,0,0]=2 48 B11R2.10 O=C1SC2=CC=CN=C2N1 AK438250 [0,0,0,0,0,0|2,1,1]=4 49 B11R2.10 OC1=CC2=C(N1)N=CC=C2 AK103904 [0,0,0,0,0,0|3,0,1]=4 50 B11R2.10 OC1=CN2C=CC=CC2=N1 AK-88442 [0,0,0,0,0,0|3,0,0]=3 51 B11R2.10 OC1=NC2=CC=CC=C2O1 AK-35787 [0,0,0,0,0,0|1,0,0]=1 52 B11R2.10 OC1CC2=C(C=CC=C2)C1 AK-94248 [0,0,0,0,0,0|3,0,1]=4 53 B11R2.10 S=C1NC2=NC=CC=C2N1 AK-77047 [0,0,0,0,0,0|3,0,1]=4 54 B11R2.10 S=C1OC2=CC=CN=C2N1 AK-32376 [0,0,0,0,0,0|2,0,1]=3 55 B11R2.10 S=C1SC2=CC=CC=C2N1 AK-47877 [0,0,0,0,0,0|1,1,1]=3 56 B11R2.10 SC1=NC2=CC=CC=C2O1 AK161762 [0,0,0,0,0,0|1,0,0]=1 57 B11R2.10 SC1=NC2=NC=CC=C2O1 AK-49565 [0,0,0,0,0,0|2,0,0]=2 58 B10R2.7 C12=C(C=CS1)C=CN=C2 AK-77543 [1,0,0,0,0,0|2,1,0]=4 59 B10R2.7 C12=C(CNC1)C=CC=C2 AK-46308 [1,0,0,0,0,0|3,0,0]=4 60 B10R2.7 C12=C(NCC1)C=CC=C2 AK-49832 [1,0,0,0,0,0|1,0,2]=4 61 B10R2.7 C12=C(NN=C1)C=CC=C2 AK-49124 [1,0,0,0,0,0|2,0,1]=4 62 B10R2.7 C12=C(OC=N1)C=CN=C2 AK601670 [1,0,0,0,0,0|1,0,0]=2 63 B10R2.7 C12=C(SC=N1)C=CN=C2 AK186924 [1,0,0,0,0,0|1,1,0]=3 64 B10R2.7 C12=CC=CC=C1N=CN2 AK109037 [1,0,0,0,0,0|1,0,0]=2 65 B10R2.7 C12=CC=CC=C1OCO2 AK-48090 [1,0,0,0,0,0|1,0,1]=3 66 B10R2.7 C12=CC=NN1C=CC=N2 AK-43498 [1,0,0,0,0,0|3,0,0]=4 67 B10R2.7 C12=NC=CC=C1C=CN2 AK-26735 [1,0,0,0,0,0|2,0,1]=4 68 B10R2.7 C12=NC=CC=C1N=CO2 AK-85804 [1,0,0,0,0,0|1,0,0]=2 69 B10R2.7 C12=NC=CC=C1OC=C2 AK119994 [1,0,0,0,0,0|2,0,0]=3 70 B10R2.7 C12=NC=CC=C1OC=N2 AK-85807 [1,0,0,0,0,0|1,0,0]=2 71 B10R2.7 C12=NC=CN1C=CC=C2 AK-27769 [1,0,0,0,0,0|2,0,0]=3 72 B10R2.7 C12=NC=CN1C=CN=C2 AK-26789 [1,0,0,0,0,0|3,0,0]=4 73 B10R2.7 C12=NC=CN=C1N=CN2 AK113549 [1,0,0,0,0,0|3,0,0]=4 74 B10R2.7 C12=NN=CN1C=CC=C2 AK-72623 [1,0,0,0,0,0|3,0,0]=4 75 B10R2.7 C12=NN=NN1C=CC=C2 AK121984 [1,0,0,0,0,0|3,0,0]=4 76 B10R2.7 C12=NNC=C1C=CN=C2 AK-46860 [1,0,0,0,0,0|3,0,0]=4 77 B10R2.7 C1=CC2=C(N=C1)C=C[NH]2 AK-29974 [1,0,0,0,0,0|2,0,1]=4 78 B10R2.7 C1=CC=CC2=C1CCO2 AK-35322 [1,0,0,0,0,0|1,0,1]=3 79 B10R2.7 C1=CC=CC2=C1N=CO2 AK-47416 [1,0,0,0,0,0|0,0,0]=1 80 B10R2.7 C1=CC=CC2=NSN=C12 AK-46656 [1,0,0,0,0,0|2,0,0]=3 81 B10R2.7 C1=CN=C2C=CC=N[N]12 AK-27120 [1,0,0,0,0,0|3,0,0]=4 82 B10R2.7 C1=CSC2=C1C=CC=C2 AK-44148 [1,0,0,0,0,0|1,1,0]=3 83 B10R2.7 C1=CSC2=C1C=NC=C2 AK-39315 [1,0,0,0,0,0|2,1,0]=4 84 B10R2.7 C1=C[NH]C2=C1C=CN=C2 AK-21984 [1,0,0,0,0,0|2,0,1]=4 85 B10R2.7 C1=C[NH]C2=C1C=NC=C2 AK-29973 [1,0,0,0,0,0|2,0,1]=4 86 B10R2.7 C1=NC=NC2=C1[NH]C=N2 AK-46541 [1,0,0,0,0,0|3,0,0]=4 87 B10R2.7 C1=NN2C=CC=CC2=N1 AK-32334 [1,0,0,0,0,0|2,0,0]=3 88 B10R2.7 C=12NC=NC1C=CN=C2 AK-63980 [1,0,0,0,0,0|2,0,0]=3 89 B10R2.7 C=12SC=NC1C=CN=C2 AK-31380 [1,0,0,0,0,0|1,1,0]=3 90 B10R2.7 N12C=NC=CC1=NC=C2 AK-68059 [1,0,0,0,0,0|3,0,0]=4 91 B10R2.7 N1=C2[N](C=C1)C=CC=N2 AK-24166 [1,0,0,0,0,0|3,0,0]=4 92 B10R2.7 N1N=NC2=C1C=CC=C2 AK-44446 [1,0,0,0,0,0|2,0,0]=3 93 B10R2.7 O1N=C2C=CC=CC2=N1 AK-34472 [1,0,0,0,0,0|2,0,0]=3 94 B10R2.7 S1C=CC2=C1C=CC=N2 AK-55220 [1,0,0,0,0,0|2,1,0]=4 95 B10R2.7 S1C=CC2=C1N=CC=C2 AK-30780 [1,0,0,0,0,0|2,1,0]=4 96 B12R2.18 BrC1=C(Br)SC2=CC=CC=C21 AK101330 [0,1,0,0,0,0|2,1,0]=4 97 B12R2.18 C1=C([N](C2=CC=CC=C12)C)C AK-47660 [0,1,0,0,0,0|1,0,1]=3 98 B12R2.18 CC1=C(Br)C2=CC=CC=C2S1 AK-28158 [0,1,0,0,0,0|1,1,0]=3 99 B12R2.18 CC1C(C)NC2=C1C=CC=C2 AK115892 [0,1,0,0,0,0|1,0,2]=4 100 B12R2.18 CN1C(I)=CC2=C1C=CC=C2 AK665664 [0,1,0,0,0,0|2,0,1]=4 101 B12R2.18 ClC1=C(Br)N=C2C=CC=CN21 AK-27971 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.18 O=C1C(CC2=C1C=CC=C2)=O AK-60402 [0,1,0,0,0,0|3,0,0]=4 103 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O AK-29599 [0,1,0,0,0,0|2,0,1]=4 104 B12R2.32 BrCC1=NC2=C(S1)C=CC=C2 AK-32768 [0,1,0,0,0,0|0,1,0]=2 105 B12R2.32 C1=C(C#N)SC2=C1C=CC=C2 AK-29384 [0,1,0,0,0,0|1,1,1]=4 106 B12R2.32 C1=C(OC2=C1C=CC=C2)C#N AK-23549 [0,1,0,0,0,0|1,0,1]=3 107 B12R2.32 C1=CC=CC2=C1[NH]C(=N2)CN AK-35733 [0,1,0,0,0,0|1,0,0]=2 108 B12R2.32 C1=CC=CC2=C1[NH]C(=N2)CO AK-27112 [0,1,0,0,0,0|1,0,0]=2 109 B12R2.32 CCC1=CC2=C(N1)C=CC=C2 AK-29204 [0,1,0,0,0,0|1,0,1]=3 110 B12R2.32 CCC1=NC2=CC=CC=C2N1 AK-31912 [0,1,0,0,0,0|1,0,0]=2 111 B12R2.32 CCC1=NC2=CC=CC=C2O1 AK551044 [0,1,0,0,0,0|0,0,0]=1 112 B12R2.32 CCC1=NC2=NC=CC=C2O1 AK-85808 [0,1,0,0,0,0|1,0,0]=2 113 B12R2.32 CNC1=NC2=C(N1)C=CC=C2 AK-95284 [0,1,0,0,0,0|1,0,0]=2 114 B12R2.32 CNC1CC2=C(C=CC=C2)C1 AK119636 [0,1,0,0,0,0|2,0,1]=4 115 B12R2.32 CSC1=NC2=C(S1)C=CC=C2 AK111081 [0,1,0,0,0,0|0,1,0]=2 116 B12R2.32 CSC1=NC2=CC=CC=C2O1 AK108390 [0,1,0,0,0,0|0,0,0]=1 117 B12R2.32 CSC1=NC2=CC=CN=C2O1 AK-28870 [0,1,0,0,0,0|1,0,0]=2 118 B12R2.32 ClCC1=NC2=C(O1)C=CC=C2 AK-61808 [0,1,0,0,0,0|0,0,0]=1 119 B12R2.32 ClCC1=NC2=CC=CC=C2N1 AK-45696 [0,1,0,0,0,0|1,0,0]=2 120 B12R2.32 ClCC1=NC2=CC=CC=C2S1 AK-51559 [0,1,0,0,0,0|0,1,0]=2 121 B12R2.32 N#CC1=NC2=CC=CC=C2S1 AK112486 [0,1,0,0,0,0|0,1,1]=3 122 B12R2.32 N#CC=1NC2=C(C1)C=CC=C2 AK123403 [0,1,0,0,0,0|1,0,2]=4 123 B12R2.32 NCC1=NC2=C(N1)C=CC=C2 AK-59651 [0,1,0,0,0,0|1,0,0]=2 124 B12R2.32 NCC1=NC2=CC=CC=C2N1 AK-39566 [0,1,0,0,0,0|1,0,0]=2 125 B12R2.32 NCC1=NC2=CC=CC=C2S1 AK123577 [0,1,0,0,0,0|0,1,0]=2 126 B12R2.32 NCC=1NC2=C(C1)C=CC=C2 AK-27799 [0,1,0,0,0,0|1,0,1]=3 127 B12R2.32 NNC1=NC2=C(N1)C=CC=C2 AK-84611 [0,1,0,0,0,0|2,0,0]=3 128 B12R2.32 NNC1=NC2=CC=CC=C2S1 AK116049 [0,1,0,0,0,0|1,1,0]=3 129 B12R2.32 O1C2=C(N=C1CO)C=CC=C2 AK-31640 [0,1,0,0,0,0|0,0,0]=1 130 B12R2.32 O=CC1=CC2=CC=CC=C2O1 AK-25961 [0,1,0,0,0,0|1,0,1]=3 131 B12R2.32 O=CC1=NC2=CC=CC=C2N1 AK-25780 [0,1,0,0,0,0|1,0,1]=3 132 B12R2.32 O=CC1=NC2=CC=CC=C2S1 AK-30101 [0,1,0,0,0,0|0,1,1]=3 133 B12R2.32 OCC1=CC2=CC=CC=C2S1 AK-48826 [0,1,0,0,0,0|1,1,0]=3 134 B12R2.32 OCC1OC2=CC=CC=C2C1 AK-50020 [0,1,0,0,0,0|1,0,1]=3 135 B12R2.32 OCC=1NC2=C(C1)C=CC=C2 AK-86119 [0,1,0,0,0,0|1,0,1]=3 136 B12R2.32 S1C(=CC2=C1C=CC=C2)C=O AK-42941 [0,1,0,0,0,0|1,1,1]=4 137 B12R2.95 FC1(F)OC2=CC=CC=C2O1 AK-53693 [0,1,0,0,0,0|2,0,1]=4 138 B12R2.202 BrC1=CC=CC2=C[N](N=C12)C AK-26845 [0,1,0,0,0,0|2,0,0]=3 139 B12R2.202 BrC1=CC=CC2=NC(Br)=NN12 AK119915 [0,1,0,0,0,0|3,0,0]=4 140 B12R2.202 BrC1=NC2=C(S1)C=NC=C2Cl AK-70928 [0,1,0,0,0,0|2,1,0]=4 141 B12R2.202 C1=C(C2=C(C=C1)SC(=N2)Cl)Cl AK-23569 [0,1,0,0,0,0|1,1,0]=3 142 B12R2.202 C1=C2NC(CC2=C(Br)C=C1)=O AK-39917 [0,1,0,0,0,0|2,0,1]=4 143 B12R2.202 C1=CC=C(C2=C1SC(=N2)N)Cl AK-26844 [0,1,0,0,0,0|1,1,0]=3 144 B12R2.202 CC1=CC2=C(Br)C=CN=C2N1 AK-37464 [0,1,0,0,0,0|2,0,1]=4 145 B12R2.202 CC1=CC2=C(N1)N=CC=C2Cl AK109567 [0,1,0,0,0,0|2,0,1]=4 146 B12R2.202 CC1=C[N]2C(=N1)C(=CC=C2)N AK-23646 [0,1,0,0,0,0|2,0,0]=3 147 B12R2.202 CC1=NC2=C(Br)C=CC=C2S1 AK-77270 [0,1,0,0,0,0|0,1,0]=2 148 B12R2.202 CC1=NC2=C(Cl)C=CN=C2N1 AK155600 [0,1,0,0,0,0|2,0,0]=3 149 B12R2.202 CC1=NC2=C(O1)C(Br)=CN=C2 AK-80599 [0,1,0,0,0,0|1,0,0]=2 150 B12R2.202 CC=1CC2=C(C1)C=CC=C2Br AK-80547 [0,1,0,0,0,0|2,0,0]=3 151 B12R2.202 CC=1NC2=C(C1)C(=CC=C2)Br AK-67965 [0,1,0,0,0,0|1,0,1]=3 152 B12R2.202 CC=1SC2=C(C1)C(=NC=C2)Cl AK-27414 [0,1,0,0,0,0|2,1,0]=4 153 B12R2.202 CN1C=C2C(C=CC=C2Br)=N1 AK-26849 [0,1,0,0,0,0|2,0,0]=3 154 B12R2.202 CN1C=C2C=CC=C(N)C2=N1 AK-27864 [0,1,0,0,0,0|2,0,0]=3 155 B12R2.202 CN1N=C2C(Cl)=NC=CC2=C1 AK161283 [0,1,0,0,0,0|3,0,0]=4 156 B12R2.202 C[N]1C=C2C(=CC=CC2=N1)N AK-27891 [0,1,0,0,0,0|2,0,0]=3 157 B12R2.202 ClC1=C2N=C(Br)SC2=CC=C1 AK-24713 [0,1,0,0,0,0|1,1,0]=3 158 B12R2.202 ClC1=NC2=C(S1)C(Cl)=CC=C2 AK-88036 [0,1,0,0,0,0|1,1,0]=3 159 B12R2.202 ClC1=NC2=C(S1)C=CC=C2Br AK-39763 [0,1,0,0,0,0|1,1,0]=3 160 B12R2.202 ClC1=NC2=C(S1)C=CC=C2F AK-23621 [0,1,0,0,0,0|1,1,0]=3 161 B12R2.202 ClC1=NC2=C(S1)C=NC=C2Cl AK-31091 [0,1,0,0,0,0|2,1,0]=4 162 B12R2.202 ClC1=NC=C[N]2C1=NC(=C2)C AK-24571 [0,1,0,0,0,0|3,0,0]=4 163 B12R2.202 FC1=C2NC(Cl)=NC2=CC=C1 AK-30683 [0,1,0,0,0,0|2,0,0]=3 164 B12R2.202 FC1=CC=CC2=C1NC(=O)S2 AK-87026 [0,1,0,0,0,0|1,1,1]=4 165 B12R2.202 NC1=C2N=C(Br)SC2=CC=C1 AK503000 [0,1,0,0,0,0|1,1,0]=3 166 B12R2.202 NC1=C2NC(C)=NC2=NC=N1 AK137156 [0,1,0,0,0,0|3,0,0]=4 167 B12R2.202 NC1=NC2=C(Br)C=CC=C2O1 AK134831 [0,1,0,0,0,0|1,0,0]=2 168 B12R2.202 NC1=NC2=C(C)C=CC=C2N1 AK151278 [0,1,0,0,0,0|2,0,0]=3 169 B12R2.202 NC1=NC2=C(C)C=CC=C2S1 AK-80123 [0,1,0,0,0,0|1,1,0]=3 170 B12R2.202 NC1=NC2=C(F)C=CC=C2S1 AK-87186 [0,1,0,0,0,0|1,1,0]=3 171 B12R2.202 NC1=NC2=C(N1)C=CC=C2Br AK100725 [0,1,0,0,0,0|2,0,0]=3 172 B12R2.202 NC1=NC2=C(O)C=CC=C2O1 AK-48635 [0,1,0,0,0,0|1,0,0]=2 173 B12R2.202 NC1=NC2=C(S1)C(Cl)=CC=C2 AK-40851 [0,1,0,0,0,0|1,1,0]=3 174 B12R2.202 NC1=NC2=C(S1)C=CC=C2Br AK-72571 [0,1,0,0,0,0|1,1,0]=3 175 B12R2.202 NC1=NC2=CC=CC(Br)=C2O1 AK134675 [0,1,0,0,0,0|1,0,0]=2 176 B12R2.202 NC1=NC2=CC=CC(C)=C2S1 AK128623 [0,1,0,0,0,0|1,1,0]=3 177 B12R2.202 NC1=NN2C(Br)=CC=CC2=N1 AK-31316 [0,1,0,0,0,0|3,0,0]=4 178 B12R2.202 NC1=NN2C=CC=C(Br)C2=N1 AK-32288 [0,1,0,0,0,0|3,0,0]=4 179 B12R2.202 O=C1C=2C=C(C)SC2C=CN1 AK-49958 [0,1,0,0,0,0|2,1,0]=4 180 B12R2.202 O=C1CC2=C(C(Cl)=CC=C2)C1 AK113491 [0,1,0,0,0,0|3,0,0]=4 181 B12R2.202 O=C1NC2=C(C(C)=CC=C2)C1 AK-57812 [0,1,0,0,0,0|2,0,1]=4 182 B12R2.202 O=C1NC2=C(C(Cl)=CC=C2)C1 AK-34054 [0,1,0,0,0,0|2,0,1]=4 183 B12R2.202 O=C1NC2=C(C(F)=CC=C2)C1 AK-33206 [0,1,0,0,0,0|2,0,1]=4 184 B12R2.202 O=C1NC2=C(C(O)=CC=C2)C1 AK-58192 [0,1,0,0,0,0|2,0,1]=4 185 B12R2.202 O=C1NC2=C(C=CC=C2Br)C1 AK-41628 [0,1,0,0,0,0|2,0,1]=4 186 B12R2.202 O=C1NC2=C(C=CC=C2Cl)C1 AK-31070 [0,1,0,0,0,0|2,0,1]=4 187 B12R2.202 O=C1NC2=C(C=CC=C2F)C1 AK-51558 [0,1,0,0,0,0|2,0,1]=4 188 B12R2.202 O=C1NC2=C(F)C=CC=C2N1 AK-46854 [0,1,0,0,0,0|2,0,1]=4 189 B12R2.202 OC1=C2N=C(N)SC2=CC=C1 AK-31877 [0,1,0,0,0,0|1,1,0]=3 190 B12R2.202 OC1=CC=CC2=C1C=C(C)N2 AK-23777 [0,1,0,0,0,0|1,0,1]=3 191 B12R2.202 OC1=CC=CN2C1=NC(C)=C2 AK-23645 [0,1,0,0,0,0|2,0,0]=3 192 B12R2.202 S=C1SC2=C(Cl)C=CC=C2N1 AK128744 [0,1,0,0,0,0|1,1,1]=4 193 B12R2.202 S=C1SC2=CC=CC(C)=C2N1 AK119588 [0,1,0,0,0,0|1,1,1]=4 194 B12R2.202 S=C1SC2=CC=CC(F)=C2N1 AK119590 [0,1,0,0,0,0|1,1,1]=4 195 B12R2.202 SC1=NC2=C(S1)C=CC=C2Cl AK101648 [0,1,0,0,0,0|1,1,0]=3 196 B12R2.606 BrC1=CC2=C(N=C(S2)Cl)C=C1 AK-26344 [0,1,0,0,0,0|1,1,0]=3 197 B12R2.606 BrC1=CC2=C(NC(=O)O2)C=C1 AK-33961 [0,1,0,0,0,0|1,0,1]=3 198 B12R2.606 BrC1=CC2=C(NC(N2)=O)C=C1 AK-22228 [0,1,0,0,0,0|2,0,1]=4 199 B12R2.606 BrC1=CC2=C(OC(=O)N2)C=C1 AK-86848 [0,1,0,0,0,0|1,0,1]=3 200 B12R2.606 BrC1=CC2=C(SC(=O)N2)C=C1 AK-87034 [0,1,0,0,0,0|1,1,1]=4 201 B12R2.606 BrC1=CC=C2CC(=O)CC2=C1 AK-32489 [0,1,0,0,0,0|3,0,0]=4 202 B12R2.606 BrC1=CN=C2C(=C1)N=C(S2)C AK-39873 [0,1,0,0,0,0|1,1,0]=3 203 B12R2.606 BrC1=CN=C2C(=C1)OC(=N2)C AK-30676 [0,1,0,0,0,0|1,0,0]=2 204 B12R2.606 BrC1=CN=C2C(=C1)OC(N2)=O AK-24539 [0,1,0,0,0,0|2,0,1]=4 205 B12R2.606 BrC1=C[N]2C(=NC(=C2)C)C=N1 AK-28078 [0,1,0,0,0,0|3,0,0]=4 206 B12R2.606 BrC1=C[N]2C(=NC(=N2)N)C=C1 AK-31317 [0,1,0,0,0,0|3,0,0]=4 207 B12R2.606 BrC1=NC2=C(S1)C=C(C=C2)Cl AK-28070 [0,1,0,0,0,0|1,1,0]=3 208 B12R2.606 BrC1=NC2=C(S1)C=C(C=C2)F AK-25211 [0,1,0,0,0,0|1,1,0]=3 209 B12R2.606 BrC1=NC2=C(S1)C=CC(=C2)Br AK-46567 [0,1,0,0,0,0|1,1,0]=3 210 B12R2.606 C1=C(C=C2C(=C1)N=C(S2)N)Br AK-27192 [0,1,0,0,0,0|1,1,0]=3 211 B12R2.606 C1=C(C=CC2=C1NC(N2)=O)N AK-27188 [0,1,0,0,0,0|2,0,1]=4 212 B12R2.606 C1=C([NH]C2=CC=C(C=C12)C)C AK-32967 [0,1,0,0,0,0|1,0,1]=3 213 B12R2.606 C1=C2C(=CC=C1N)N=C([NH]2)C AK-26727 [0,1,0,0,0,0|1,0,0]=2 214 B12R2.606 C1=CC(=CC2=C1N=C(N)S2)F AK-34786 [0,1,0,0,0,0|1,1,0]=3 215 B12R2.606 C1=CC(=CC2=C1N=C(S2)Cl)Cl AK-49112 [0,1,0,0,0,0|1,1,0]=3 216 B12R2.606 C1=CC(=CC2=C1NC(=O)S2)Br AK-35883 [0,1,0,0,0,0|1,1,1]=4 217 B12R2.606 C1=CC(=CC2=C1SC(=N2)C)Br AK-32280 [0,1,0,0,0,0|0,1,0]=2 218 B12R2.606 C1=CC(=CC2=C1SC(=N2)N)Cl AK-44951 [0,1,0,0,0,0|1,1,0]=3 219 B12R2.606 C1=CC2=C(C=C1Cl)N=C(Cl)S2 AK-29101 [0,1,0,0,0,0|1,1,0]=3 220 B12R2.606 CC1=CC2=C(N1)C=C(Cl)C=C2 AK-49978 [0,1,0,0,0,0|1,0,1]=3 221 B12R2.606 CC1=CC2=C(N1)C=C(F)C=C2 AK-82140 [0,1,0,0,0,0|1,0,1]=3 222 B12R2.606 CC1=CC2=C(N1)C=C(O)C=C2 AK105293 [0,1,0,0,0,0|1,0,1]=3 223 B12R2.606 CC1=CC2=C(OC(N)=N2)C=C1 AK-48427 [0,1,0,0,0,0|1,0,0]=2 224 B12R2.606 CC1=CN2N=C(Cl)C=CC2=N1 AK-31442 [0,1,0,0,0,0|3,0,0]=4 225 B12R2.606 CC1=CN2N=C(N)C=CC2=N1 AK-87289 [0,1,0,0,0,0|3,0,0]=4 226 B12R2.606 CC1=NC2=C(N1)C=CC(F)=C2 AK-88922 [0,1,0,0,0,0|1,0,0]=2 227 B12R2.606 CC1=NC2=C(N1)C=CC(O)=C2 AK-99427 [0,1,0,0,0,0|1,0,0]=2 228 B12R2.606 CC1=NC2=C(O1)C=C(Cl)C=C2 AK-85814 [0,1,0,0,0,0|0,0,0]=1 229 B12R2.606 CC1=NC2=C(O1)C=C(N)C=C2 AK-29411 [0,1,0,0,0,0|0,0,0]=1 230 B12R2.606 CC1=NC2=C(O1)C=CC(O)=C2 AK104913 [0,1,0,0,0,0|0,0,0]=1 231 B12R2.606 CC1=NC2=C(S1)C=C(Cl)C=C2 AK-82308 [0,1,0,0,0,0|0,1,0]=2 232 B12R2.606 CC1=NC2=CC(Br)=CC=C2N1 AK-32365 [0,1,0,0,0,0|1,0,0]=2 233 B12R2.606 CC1=NC2=CC(Br)=CC=C2O1 AK-30558 [0,1,0,0,0,0|0,0,0]=1 234 B12R2.606 CC1=NC2=CC(Br)=CN=C2O1 AK-77463 [0,1,0,0,0,0|1,0,0]=2 235 B12R2.606 CC1=NC2=CC(Cl)=CC=C2O1 AK-54057 [0,1,0,0,0,0|0,0,0]=1 236 B12R2.606 CC1=NC2=CC(F)=CC=C2O1 AK202356 [0,1,0,0,0,0|0,0,0]=1 237 B12R2.606 CC1=NC2=CC(I)=CC=C2N1 AK155408 [0,1,0,0,0,0|1,0,0]=2 238 B12R2.606 CC1=NC2=CC=C(Br)C=C2S1 AK-24992 [0,1,0,0,0,0|0,1,0]=2 239 B12R2.606 CC1=NC2=CC=C(Br)N=C2N1 AK-51030 [0,1,0,0,0,0|2,0,0]=3 240 B12R2.606 CC1=NC2=CC=C(Cl)N=C2N1 AK-37517 [0,1,0,0,0,0|2,0,0]=3 241 B12R2.606 CC1=NC2=CC=C(F)C=C2S1 AK128469 [0,1,0,0,0,0|0,1,0]=2 242 B12R2.606 CC1=NN2C=C(Br)C=CC2=N1 AK-78953 [0,1,0,0,0,0|2,0,0]=3 243 B12R2.606 CC1=NN2C=CC(Br)=CC2=N1 AK100790 [0,1,0,0,0,0|2,0,0]=3 244 B12R2.606 CC1=NN2C=CC(Cl)=NC2=C1 AK-43473 [0,1,0,0,0,0|3,0,0]=4 245 B12R2.606 CC1NC2=C(C=C(F)C=C2)C1 AK-89513 [0,1,0,0,0,0|1,0,2]=4 246 B12R2.606 CC=1NC2=C(C1)C=C(C=C2)Br AK-25283 [0,1,0,0,0,0|1,0,1]=3 247 B12R2.606 CC=1NC2=C(C1)C=C(C=C2)Cl AK-32804 [0,1,0,0,0,0|1,0,1]=3 248 B12R2.606 CC=1NC2=C(C1)C=C(C=N2)Br AK-37639 [0,1,0,0,0,0|2,0,1]=4 249 B12R2.606 CC=1NC2=C(C1)C=CC(=C2)Br AK-67966 [0,1,0,0,0,0|1,0,1]=3 250 B12R2.606 CN1C=C2C=C(I)C=CC2=N1 AK-27908 [0,1,0,0,0,0|2,0,0]=3 251 B12R2.606 CN1N=C2C=C(Br)C=CC2=C1 AK-27927 [0,1,0,0,0,0|2,0,0]=3 252 B12R2.606 CN1N=C2C=C(Cl)C=CC2=C1 AK-27928 [0,1,0,0,0,0|2,0,0]=3 253 B12R2.606 CN1N=C2C=CC(Br)=CC2=C1 AK-26848 [0,1,0,0,0,0|2,0,0]=3 254 B12R2.606 CN1N=C2C=CC(Cl)=CC2=C1 AK-27906 [0,1,0,0,0,0|2,0,0]=3 255 B12R2.606 ClC1=CC2=C(NC(=O)S2)C=C1 AK-30262 [0,1,0,0,0,0|1,1,1]=4 256 B12R2.606 ClC1=CC=C2C(NC(Br)=N2)=C1 AK543190 [0,1,0,0,0,0|2,0,0]=3 257 B12R2.606 ClC1=CC=C2SC(Br)=NC2=C1 AK-40892 [0,1,0,0,0,0|1,1,0]=3 258 B12R2.606 ClC1=NC2=C(O1)C=CC(=C2)Cl AK-26747 [0,1,0,0,0,0|1,0,0]=2 259 B12R2.606 ClC1=NC2=CC(Br)=CC=C2O1 AK117626 [0,1,0,0,0,0|1,0,0]=2 260 B12R2.606 ClC1=NC2=CC(Br)=CC=C2S1 AK-39745 [0,1,0,0,0,0|1,1,0]=3 261 B12R2.606 FC1=CC2=C(OC(S)=N2)C=C1 AK111312 [0,1,0,0,0,0|1,0,0]=2 262 B12R2.606 FC1=CC2=C(SC(Cl)=N2)C=C1 AK-67885 [0,1,0,0,0,0|1,1,0]=3 263 B12R2.606 FC1=CC=C2C(N=C(Cl)N2)=C1 AK-32821 [0,1,0,0,0,0|2,0,0]=3 264 B12R2.606 FC1=CC=C2N=C(Cl)SC2=C1 AK-27043 [0,1,0,0,0,0|1,1,0]=3 265 B12R2.606 FC1=CC=C2NC(=O)SC2=C1 AK-30083 [0,1,0,0,0,0|1,1,1]=4 266 B12R2.606 FC1=CC=C2[NH]C(=CC2=C1)C AK-26800 [0,1,0,0,0,0|1,0,1]=3 267 B12R2.606 FC1=CN2C(C=C1)=NC(Br)=C2 AK-92879 [0,1,0,0,0,0|3,0,0]=4 268 B12R2.606 IC1=CC=C2NC(Cl)=NC2=C1 AK-77743 [0,1,0,0,0,0|2,0,0]=3 269 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)Cl AK-29546 [0,1,0,0,0,0|1,1,0]=3 270 B12R2.606 NC1=CC2=C(CN(C)C2)C=C1 AK173245 [0,1,0,0,0,0|3,0,0]=4 271 B12R2.606 NC1=CC2=C(NC(=O)S2)C=C1 AK-86990 [0,1,0,0,0,0|1,1,1]=4 272 B12R2.606 NC1=CC2=NN(C)C=C2C=C1 AK-27926 [0,1,0,0,0,0|2,0,0]=3 273 B12R2.606 NC1=CC=C2N=C(Cl)SC2=C1 AK-27954 [0,1,0,0,0,0|1,1,0]=3 274 B12R2.606 NC1=CC=C2NC(C)=NC2=C1 AK-28192 [0,1,0,0,0,0|1,0,0]=2 275 B12R2.606 NC1=NC2=C(N1)C=CC(Br)=C2 AK-40170 [0,1,0,0,0,0|2,0,0]=3 276 B12R2.606 NC1=NC2=C(O1)C=C(Br)C=C2 AK-35461 [0,1,0,0,0,0|1,0,0]=2 277 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)Br AK-24051 [0,1,0,0,0,0|1,1,0]=3 278 B12R2.606 NC1=NC2=C(S1)C=CC(F)=C2 AK-51569 [0,1,0,0,0,0|1,1,0]=3 279 B12R2.606 NC1=NC2=CC(=CN=C2S1)Br AK-31882 [0,1,0,0,0,0|2,1,0]=4 280 B12R2.606 NC1=NC2=CC(Br)=CC=C2O1 AK-40298 [0,1,0,0,0,0|1,0,0]=2 281 B12R2.606 NC1=NC2=CC=C(Cl)C=C2S1 AK-40064 [0,1,0,0,0,0|1,1,0]=3 282 B12R2.606 NC1=NC2=NC(F)=CC=C2S1 AK502327 [0,1,0,0,0,0|2,1,0]=4 283 B12R2.606 NC1=NN2C=C(Cl)C=CC2=N1 AK135391 [0,1,0,0,0,0|3,0,0]=4 284 B12R2.606 NC1=NN2C=CC(Br)=CC2=N1 AK-39350 [0,1,0,0,0,0|3,0,0]=4 285 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 AK154493 [0,1,0,0,0,0|3,0,0]=4 286 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)C1 AK-39225 [0,1,0,0,0,0|2,0,1]=4 287 B12R2.606 O=C1NC2=C(C=C(F)C=C2)C1 AK-23028 [0,1,0,0,0,0|2,0,1]=4 288 B12R2.606 O=C1NC2=C(C=C(N)C=C2)C1 AK-37753 [0,1,0,0,0,0|2,0,1]=4 289 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)C1 AK-26491 [0,1,0,0,0,0|2,0,1]=4 290 B12R2.606 O=C1NC2=C(C=CC(C)=C2)C1 AK-79359 [0,1,0,0,0,0|2,0,1]=4 291 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)C1 AK-29404 [0,1,0,0,0,0|2,0,1]=4 292 B12R2.606 O=C1NC2=C(C=CC(N)=C2)C1 AK-28791 [0,1,0,0,0,0|2,0,1]=4 293 B12R2.606 O=C1NC2=CC=C(C)C=C2N1 AK-92933 [0,1,0,0,0,0|2,0,1]=4 294 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 AK-22225 [0,1,0,0,0,0|2,0,1]=4 295 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 AK-22224 [0,1,0,0,0,0|2,0,1]=4 296 B12R2.606 O=C1OC2=CC(Cl)=CN=C2N1 AK-32208 [0,1,0,0,0,0|2,0,1]=4 297 B12R2.606 O=C1OC2=CC=C(F)C=C2N1 AK157798 [0,1,0,0,0,0|1,0,1]=3 298 B12R2.606 OC1=CC=C2N=C(C)SC2=C1 AK-36112 [0,1,0,0,0,0|0,1,0]=2 299 B12R2.606 OC1=CC=C2N=C(N)SC2=C1 AK-34436 [0,1,0,0,0,0|1,1,0]=3 300 B12R2.606 OC1=CC=C2NC(N)=NC2=C1 AK126168 [0,1,0,0,0,0|2,0,0]=3 301 B12R2.606 S=C1NC2=CC=C(Br)C=C2N1 AK166989 [0,1,0,0,0,0|2,0,1]=4 302 B12R2.606 S=C1NC2=CC=C(F)C=C2N1 AK109690 [0,1,0,0,0,0|2,0,1]=4 303 B12R2.606 S=C1OC2=CC=C(Br)C=C2N1 AK142820 [0,1,0,0,0,0|1,0,1]=3 304 B12R2.606 S=C1OC2=CC=C(Cl)C=C2N1 AK111072 [0,1,0,0,0,0|1,0,1]=3 305 B12R2.606 S=C1SC2=CC(Br)=CC=C2N1 AK105878 [0,1,0,0,0,0|1,1,1]=4 306 B12R2.606 SC1=NC2=CC(Br)=CC=C2S1 AK-24346 [0,1,0,0,0,0|1,1,0]=3 307 B12R2.606 SC1=NC2=CC=C(C)C=C2S1 AK160955 [0,1,0,0,0,0|1,1,0]=3 308 B12R2.606 SC1=NC2=CC=C(Cl)C=C2S1 AK101653 [0,1,0,0,0,0|1,1,0]=3 309 B10R1.4 CC1=CC=CC=C1CNC AK-89673 [0,0,1,0,0,0|3,0,0]=4 310 B10R1.4 CCOC1=C(N)C=CN=C1 AK100670 [0,0,1,0,0,0|1,0,2]=4 311 B10R1.4 CCOC1=NC=CC=C1Br AK-45982 [0,0,1,0,0,0|2,0,1]=4 312 B10R1.4 CNCC1=CC=CC=C1Br AK-16712 [0,0,1,0,0,0|3,0,0]=4 313 B10R1.4 CNCC1=CC=CC=C1F AK-16716 [0,0,1,0,0,0|3,0,0]=4 314 B10R1.4 NC1=C(OCC)C=CN=C1 AK-59659 [0,0,1,0,0,0|1,0,2]=4 315 B10R1.4 O=C1C(OCC)=CC=CN1 AK130647 [0,0,1,0,0,0|2,0,1]=4 316 B10R1.4 OC1=CC=CC=C1CCN AK114741 [0,0,1,0,0,0|2,0,1]=4 317 B10R1.4 OC1=CC=CC=C1COC AK151421 [0,0,1,0,0,0|2,0,0]=3 318 B10R1.4 OC1=CC=CC=C1OCC AK-94233 [0,0,1,0,0,0|1,0,1]=3 319 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [0,0,1,0,0,0|2,0,1]=4 320 B10R1.18 C1=C(C=CN=C1)CC(O)=O AK-45111 [0,0,1,0,0,0|3,0,0]=4 321 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [0,0,1,0,0,0|3,0,0]=4 322 B10R1.18 CC(C)OC1=CC=CC=C1 AK110874 [0,0,1,0,0,0|1,0,1]=3 323 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [0,0,1,0,0,0|2,0,1]=4 324 B10R1.18 CC(OC1=CC=CN=C1)C AK167273 [0,0,1,0,0,0|2,0,1]=4 325 B10R1.18 CC(OC1=NC=CC=C1)C AK-47912 [0,0,1,0,0,0|2,0,1]=4 326 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,1,0,0,0|2,0,0]=3 327 B10R1.18 FC(F)OC1=CC=CC=C1 AK161726 [0,0,1,0,0,0|2,0,1]=4 328 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [0,0,1,0,0,0|2,0,0]=3 329 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [0,0,1,0,0,0|2,0,0]=3 330 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [0,0,1,0,0,0|2,0,1]=4 331 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [0,0,1,0,0,0|3,0,0]=4 332 B10R1.18 OC(=N)NC1=CC=CC=C1 AK-65147 [0,0,1,0,0,0|1,0,1]=3 333 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [0,0,1,0,0,0|3,0,0]=4 334 B10R1.18 S=C(Cl)OC1=CC=CC=C1 AK163079 [0,0,1,0,0,0|2,0,0]=3 335 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [0,0,1,0,0,0|1,1,1]=4 336 B10R2.320 BrC1C2=CC=CC=C2C1 AK163275 [0,0,0,0,1,0|2,0,1]=4 337 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [0,0,0,0,1,0|2,0,0]=3 338 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 AK-23692 [0,0,0,0,0,1|2,0,0]=3 339 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 AK-27162 [0,0,0,0,0,1|2,0,0]=3 340 B12R2.24 BrC1=CC2=CC=CC=C2N=N1 AK-87992 [0,0,0,0,0,1|2,0,0]=3 341 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 AK-49506 [0,0,0,0,0,1|3,0,0]=4 342 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 AK-31792 [0,0,0,0,0,1|2,0,0]=3 343 B12R2.24 BrC1=NC2=CN=CC=C2C=C1 AK-78425 [0,0,0,0,0,1|3,0,0]=4 344 B12R2.24 C1=C(N)N=CC2=CC=CC=C12 AK-27774 [0,0,0,0,0,1|2,0,0]=3 345 B12R2.24 C1=C2C(=CC=C1Br)C=CC=C2 AK-35732 [0,0,0,0,0,1|3,0,0]=4 346 B12R2.24 C1=C2C(=NC=C1Cl)C=CC=C2 AK-39638 [0,0,0,0,0,1|2,0,0]=3 347 B12R2.24 C1=C2C(=NC=C1O)C=CC=C2 AK-26151 [0,0,0,0,0,1|2,0,0]=3 348 B12R2.24 C1=CC2=C(N=C1N)C=CC=C2 AK-26798 [0,0,0,0,0,1|2,0,0]=3 349 B12R2.24 C1=CC=CC2=C1NC(=O)CC2 AK-26121 [0,0,0,0,0,1|2,0,1]=4 350 B12R2.24 C1=CC=CC2=C1NC(=O)CO2 AK-46795 [0,0,0,0,0,1|1,0,1]=3 351 B12R2.24 C1=CC=CC2=CC=C(N=C12)Br AK-24234 [0,0,0,0,0,1|2,0,0]=3 352 B12R2.24 C1=CC=CC2=CC=C(N=C12)Cl AK-27768 [0,0,0,0,0,1|2,0,0]=3 353 B12R2.24 C1=NC(=NC2=C1C=CC=C2)Cl AK-27695 [0,0,0,0,0,1|2,0,0]=3 354 B12R2.24 CC1=CC2=CC=CC=C2N=C1 AK-72496 [0,0,0,0,0,1|1,0,0]=2 355 B12R2.24 CC1=NC2=NC=CC=C2C=C1 AK-44284 [0,0,0,0,0,1|2,0,0]=3 356 B12R2.24 CC1CC2=C(CN1)C=CC=C2 AK-77462 [0,0,0,0,0,1|1,0,2]=4 357 B12R2.24 CC1CCC2=CC=CC=C2N1 AK-33768 [0,0,0,0,0,1|1,0,2]=4 358 B12R2.24 CC1CNC2=C(C=CC=C2)C1 AK146007 [0,0,0,0,0,1|1,0,2]=4 359 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 AK-24474 [0,0,0,0,0,1|2,0,0]=3 360 B12R2.24 ClC1=CC=C2C=CC=NC2=N1 AK-28846 [0,0,0,0,0,1|3,0,0]=4 361 B12R2.24 ClC1=CN=C2N=CC=CC2=C1 AK-48179 [0,0,0,0,0,1|3,0,0]=4 362 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 AK-47004 [0,0,0,0,0,1|2,0,0]=3 363 B12R2.24 ClC1=NC2=CC=CN=C2C=C1 AK-38087 [0,0,0,0,0,1|3,0,0]=4 364 B12R2.24 ClC1=NC2=CC=CN=C2N=C1 AK-33457 [0,0,0,0,0,1|3,0,0]=4 365 B12R2.24 ClC1=NC2=NC=CC=C2N=C1 AK128390 [0,0,0,0,0,1|3,0,0]=4 366 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 AK110894 [0,0,0,0,0,1|3,0,0]=4 367 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 AK-30450 [0,0,0,0,0,1|2,0,0]=3 368 B12R2.24 NC1=NC2=CC=CC=C2C=N1 AK-24681 [0,0,0,0,0,1|2,0,0]=3 369 B12R2.24 NC1=NC2=CC=CN=C2C=C1 AK-33784 [0,0,0,0,0,1|3,0,0]=4 370 B12R2.24 NC1=NC2=NC=CC=C2C=C1 AK-60468 [0,0,0,0,0,1|3,0,0]=4 371 B12R2.24 O=C1CC2=CC=CC=C2CO1 AK-35166 [0,0,0,0,0,1|2,0,0]=3 372 B12R2.24 O=C1COC2=CC=CC=C2C1 AK-96048 [0,0,0,0,0,1|2,0,0]=3 373 B12R2.24 O=C1COC2=CC=CN=C2N1 AK-81532 [0,0,0,0,0,1|2,0,1]=4 374 B12R2.24 O=C1NC2=C(C=CC=C2)CN1 AK143293 [0,0,0,0,0,1|2,0,1]=4 375 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 AK100046 [0,0,0,0,0,1|2,0,0]=3 376 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 AK-28738 [0,0,0,0,0,1|2,0,0]=3 377 B12R2.1041 NC1=CC2=CC=CC=CC2=C1 AK-79905 [0,0,0,0,0,1|3,0,0]=4 378 B9R1.8 CCOC1=NC=CC=C1 AK-88755 [1,0,1,0,0,0|1,0,1]=4 379 B9R1.8 CNNC1=CC=CC=C1 AK119038 [1,0,1,0,0,0|1,0,1]=4 380 B9R1.8 ONCC1=CC=CC=C1 AK-49662 [1,0,1,0,0,0|2,0,0]=4 381 B9R1.8 ONCC1=CC=CC=C1 AK110567 [1,0,1,0,0,0|2,0,0]=4 382 B9R1.15 BrC1=C(C=NC=C1)OC AK-46696 [1,0,1,0,0,0|2,0,0]=4 383 B9R1.15 BrC1=CC=CN=C1OC AK-33153 [1,0,1,0,0,0|2,0,0]=4 384 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [1,0,1,0,0,0|1,0,1]=4 385 B9R1.15 C1=C(C(=CN=C1)O)C=O AK-23522 [1,0,1,0,0,0|2,0,0]=4 386 B9R1.15 C1=C(I)C(=NC=C1)OC AK-25295 [1,0,1,0,0,0|2,0,0]=4 387 B9R1.15 C1=CC=CC(=C1C#N)O AK-47282 [1,0,1,0,0,0|1,0,1]=4 388 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [1,0,1,0,0,0|1,0,1]=4 389 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [1,0,1,0,0,0|1,0,0]=3 390 B9R1.15 C=CC1=CC=CC=C1Cl AK114259 [1,0,1,0,0,0|1,0,1]=4 391 B9R1.15 CC1=CC=CC=C1CC AK-49977 [1,0,1,0,0,0|1,0,1]=4 392 B9R1.15 CC1=CC=CN=C1OC AK126197 [1,0,1,0,0,0|2,0,0]=4 393 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [1,0,1,0,0,0|1,0,1]=4 394 B9R1.15 CNC1=CC=CC=C1F AK-48931 [1,0,1,0,0,0|1,0,1]=4 395 B9R1.15 COC1=C(Br)C=NC=C1 AK-36460 [1,0,1,0,0,0|2,0,0]=4 396 B9R1.15 COC1=C(I)C=NC=C1 AK-26421 [1,0,1,0,0,0|2,0,0]=4 397 B9R1.15 COC1=CC=CC=C1Br AK-76806 [1,0,1,0,0,0|1,0,0]=3 398 B9R1.15 COC1=CC=CN=C1Br AK-29048 [1,0,1,0,0,0|2,0,0]=4 399 B9R1.15 COC1=CC=CN=C1F AK-63160 [1,0,1,0,0,0|2,0,0]=4 400 B9R1.15 COC1=NC=CC=C1Cl AK-33154 [1,0,1,0,0,0|2,0,0]=4 401 B9R1.15 COC1=NC=CC=C1F AK-33314 [1,0,1,0,0,0|2,0,0]=4 402 B9R1.15 NC1=C(C=CN=C1)OC AK-27262 [1,0,1,0,0,0|1,0,1]=4 403 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,0,1,0,0,0|1,0,1]=4 404 B9R1.15 NC1=C(OC)C=NC=C1 AK-46304 [1,0,1,0,0,0|1,0,1]=4 405 B9R1.15 NC1=CC=CC=C1C=C AK100084 [1,0,1,0,0,0|0,0,2]=4 406 B9R1.15 NC1=CC=CC=C1NC AK-35283 [1,0,1,0,0,0|1,0,1]=4 407 B9R1.15 NC1=CC=CN=C1OC AK-28363 [1,0,1,0,0,0|1,0,1]=4 408 B9R1.15 NC1=NC=CC=C1OC AK-25256 [1,0,1,0,0,0|1,0,1]=4 409 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,0,1,0,0,0|2,0,0]=4 410 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,0,1,0,0,0|2,0,0]=4 411 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,0,1,0,0,0|2,0,0]=4 412 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,0,1,0,0,0|1,0,1]=4 413 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [1,0,1,0,0,0|2,0,0]=4 414 B9R1.15 OC1=CC=CC=C1CN AK-49022 [1,0,1,0,0,0|1,0,1]=4 415 B9R1.15 OC1=CC=CC=C1CN AK167666 [1,0,1,0,0,0|1,0,1]=4 416 B9R1.15 OC1=CC=CC=C1OC AK114448 [1,0,1,0,0,0|1,0,0]=3 417 B9R1.15 OC1=CC=CN=C1OC AK261041 [1,0,1,0,0,0|2,0,0]=4 418 B9R1.12 O=C\C=C\C1=CC=CO1 AK-88542 [1,0,1,0,0,0|2,0,0]=4 419 B11R1.13 FC1=C(F)C(OCC)=CC=C1 AK-45507 [0,1,1,0,0,0|1,0,1]=4 420 B11R1.17 CCCOC1=C(O)C=CC=C1 AK111500 [0,1,1,0,0,0|1,0,1]=4 421 B11R1.17 OC1=CC=CC=C1OCC=C AK544045 [0,1,1,0,0,0|1,0,1]=4 422 B11R1.41 CNCC1=CC=CC=C1OC AK-89681 [0,1,1,0,0,0|2,0,0]=4 423 B11R1.41 CNCC1=CC=CC=C1OC AK161757 [0,1,1,0,0,0|2,0,0]=4 424 B11R1.41 N#CC1=CC=CC=C1OCC AK158954 [0,1,1,0,0,0|0,0,2]=4 425 B11R1.41 O=CC1=CC=CC=C1OCC AK156421 [0,1,1,0,0,0|1,0,1]=4 426 B11R1.41 OCC1=CC=CC=C1CNC AK146712 [0,1,1,0,0,0|2,0,0]=4 427 B11R1.81 CCCC1=C(O)C=C(O)C=C1 AK-81520 [0,1,1,0,0,0|1,0,1]=4 428 B11R1.81 NC1=CC(C)=CC=C1OCC AK327686 [0,1,1,0,0,0|0,0,2]=4 429 B11R1.81 NC1=CC=C(OCC)C(Cl)=C1 AK121334 [0,1,1,0,0,0|1,0,1]=4 430 B11R1.81 NC1=CC=C(OCC)C(N)=C1 AK-93490 [0,1,1,0,0,0|0,0,2]=4 431 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,1,1,0,0,0|2,0,0]=4 432 B11R1.86 C1=C(OC(C)C)C(=CC=C1)N AK-39887 [0,1,1,0,0,0|0,0,2]=4 433 B11R1.86 C1=CC=CC(=C1CC(O)=O)O AK-47284 [0,1,1,0,0,0|2,0,0]=4 434 B11R1.86 CC(C)OC1=CC=CC=C1Br AK-45390 [0,1,1,0,0,0|1,0,1]=4 435 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,1,1,0,0,0|2,0,0]=4 436 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,1,1,0,0,0|1,0,1]=4 437 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,1,1,0,0,0|0,0,1]=3 438 B11R1.86 CC(NC1=NC=CC=C1O)=O AK124571 [0,1,1,0,0,0|1,0,1]=4 439 B11R1.605 CCOC1=C(F)C=CC=C1F AK-87527 [0,1,1,0,0,0|1,0,1]=4 440 B11R1.20 C1=C(C=CC(=C1)F)CC(O)=O AK-49121 [0,1,1,0,0,0|2,0,0]=4 441 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,1,1,0,0,0|1,0,1]=4 442 B11R1.20 C1=CC(=CC=C1N)CC(O)=O AK-47573 [0,1,1,0,0,0|2,0,0]=4 443 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,1,1,0,0,0|0,0,2]=4 444 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,1,1,0,0,0|0,0,2]=4 445 B11R1.20 NC1=CC=C(OC(C)C)C=C1 AK-42665 [0,1,1,0,0,0|1,0,1]=4 446 B11R1.20 O=C(O)CC1=CC=C(C)C=C1 AK-45538 [0,1,1,0,0,0|2,0,0]=4 447 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AK-45403 [0,1,1,0,0,0|2,0,0]=4 448 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AK-45378 [0,1,1,0,0,0|2,0,0]=4 449 B11R1.20 OC(=O)CC1=CC=C(Cl)C=C1 AK-76702 [0,1,1,0,0,0|2,0,0]=4 450 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AK101098 [0,1,1,0,0,0|2,0,0]=4 451 B11R1.36 C1=C(C(C(O)=O)Br)C=CC=C1 AK-47433 [0,1,1,0,0,0|2,0,0]=4 452 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 AK-50598 [0,1,1,0,0,0|2,0,0]=4 453 B11R1.36 C1=CC=CC=C1C(C(O)=O)O AK-54084 [0,1,1,0,0,0|2,0,0]=4 454 B11R1.36 CC(C(C1=CC=CC=C1)=O)=O AK116651 [0,1,1,0,0,0|1,0,1]=4 455 B11R1.36 C[C@@H](C1=CC=CC=C1)C(O)=O AK-42526 [0,1,1,0,0,0|2,0,0]=4 456 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 AK608029 [0,1,1,0,0,0|1,0,1]=4 457 B11R1.36 C[C@H](C1=CC=CC=C1)C(O)=O AK-42515 [0,1,1,0,0,0|2,0,0]=4 458 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 AK608030 [0,1,1,0,0,0|1,0,1]=4 459 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 AK107681 [0,1,1,0,0,0|2,0,0]=4 460 B11R1.36 O=C(O)C(N)C1=CC=CC=C1 AK-46549 [0,1,1,0,0,0|2,0,0]=4 461 B11R1.36 O=C(O)[C@@H](N)C1=CC=CC=C1 AK-48119 [0,1,1,0,0,0|2,0,0]=4 462 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK-44130 [0,1,1,0,0,0|2,0,0]=4 463 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK105883 [0,1,1,0,0,0|2,0,0]=4 464 B11R1.36 [C@@H](O)(C1=CC=CC=C1)C(=O)O AK-47567 [0,1,1,0,0,0|2,0,0]=4 465 B11R1.36 [C@H](C1=CC=CC=C1)(C(O)=O)O AK-42339 [0,1,1,0,0,0|2,0,0]=4 466 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [0,1,1,0,0,0|0,0,2]=4 467 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [0,1,1,0,0,0|1,0,1]=4 468 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [0,1,1,0,0,0|1,0,0]=3 469 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [0,1,1,0,0,0|1,0,0]=3 470 B11R1.157 C1=C(C=CC=C1Cl)CC(O)=O AK-47464 [0,1,1,0,0,0|2,0,0]=4 471 B11R1.157 C1=C(C=CC=C1F)CC(O)=O AK-72993 [0,1,1,0,0,0|2,0,0]=4 472 B11R1.157 C1=C(C=CC=C1O)CC(O)=O AK-48396 [0,1,1,0,0,0|2,0,0]=4 473 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,1,0,0,0|1,0,1]=4 474 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,1,0,0,0|1,0,1]=4 475 B11R1.157 CC(NC1=CC=CC(N)=C1)=O AK-76549 [0,1,1,0,0,0|0,0,2]=4 476 B11R1.157 CC(NC1=CC=CC(O)=C1)=O AK-84439 [0,1,1,0,0,0|0,0,2]=4 477 B11R1.157 CC(OC1=CC=CC(Br)=C1)=O AK-80146 [0,1,1,0,0,0|1,0,0]=3 478 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,1,0,0,0|1,0,0]=3 479 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AK-42053 [0,1,1,0,0,0|2,0,0]=4 480 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AK-61642 [0,1,1,0,0,0|2,0,0]=4 481 B11R2.1 BrC1=C2C=CC=CN2N=C1 AK-28449 [1,1,0,0,0,0|2,0,0]=4 482 B11R2.1 BrC1=CN=C2C=CC=CN21 AK-35317 [1,1,0,0,0,0|2,0,0]=4 483 B11R2.1 BrC1=COC2=C1C=CC=C2 AK-90311 [1,1,0,0,0,0|1,0,0]=3 484 B11R2.1 BrC1=CSC2=C1C=CC=C2 AK-27164 [1,1,0,0,0,0|1,1,0]=4 485 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [1,1,0,0,0,0|1,0,1]=4 486 B11R2.1 C1=CC=CC2=C([NH]N=C12)Cl AK-25715 [1,1,0,0,0,0|2,0,0]=4 487 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [1,1,0,0,0,0|1,0,1]=4 488 B11R2.1 CC1=CCC2=CC=CC=C12 AK-79878 [1,1,0,0,0,0|2,0,0]=4 489 B11R2.1 CN1C=CC2=C1C=CC=C2 AK-84423 [1,1,0,0,0,0|1,0,1]=4 490 B11R2.1 CN1C=NC2=C1C=CC=C2 AK-51670 [1,1,0,0,0,0|1,0,0]=3 491 B11R2.1 ClC1=C2C=CC=CN2N=C1 AK165560 [1,1,0,0,0,0|2,0,0]=4 492 B11R2.1 ClC1=NOC2=C1C=CC=C2 AK-24058 [1,1,0,0,0,0|2,0,0]=4 493 B11R2.1 NN1C=CC2=C1C=CC=C2 AK-49867 [1,1,0,0,0,0|1,0,1]=4 494 B11R2.1 NN1N=NC2=CC=CC=C21 AK113523 [1,1,0,0,0,0|2,0,0]=4 495 B11R2.1 N[C@H]1COC2=CC=CC=C12 AK172653 [1,1,0,0,0,0|1,0,1]=4 496 B11R2.1 O1C2=C(C(=N1)N)C=CC=C2 AK-23544 [1,1,0,0,0,0|2,0,0]=4 497 B11R2.1 S1C=C(C2=C1C=CC=C2)N AK-28603 [1,1,0,0,0,0|1,1,0]=4 498 B11R2.36 BrC1=CC2=C(C=C1)C=CC2 AK113550 [1,1,0,0,0,0|2,0,0]=4 499 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 AK-24397 [1,1,0,0,0,0|2,0,0]=4 500 B11R2.36 BrC1=CC2=C(C=C1)SC=C2 AK-26768 [1,1,0,0,0,0|1,1,0]=4 501 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 AK-30499 [1,1,0,0,0,0|0,1,0]=3 502 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 AK-27128 [1,1,0,0,0,0|1,1,0]=4 503 B11R2.36 BrC1=CC2=C(C=NO2)C=C1 AK-40991 [1,1,0,0,0,0|2,0,0]=4 504 B11R2.36 BrC1=CC2=C(N=CO2)C=C1 AK-27167 [1,1,0,0,0,0|0,0,0]=2 505 B11R2.36 BrC1=CC2=C(NN=N2)C=C1 AK-34667 [1,1,0,0,0,0|2,0,0]=4 506 B11R2.36 BrC1=CC2=CC=NN2C=C1 AK-93394 [1,1,0,0,0,0|2,0,0]=4 507 B11R2.36 BrC1=CC2=NC=CN2C=C1 AK-27152 [1,1,0,0,0,0|2,0,0]=4 508 B11R2.36 BrC1=CC2=NC=NN2C=C1 AK-28394 [1,1,0,0,0,0|2,0,0]=4 509 B11R2.36 BrC1=CC2=NON=C2C=C1 AK-32042 [1,1,0,0,0,0|2,0,0]=4 510 B11R2.36 BrC1=CC=C2C(N=CN2)=N1 AK-27503 [1,1,0,0,0,0|2,0,0]=4 511 B11R2.36 BrC1=CC=C2C=COC2=C1 AK113765 [1,1,0,0,0,0|1,0,0]=3 512 B11R2.36 BrC1=CC=C2CC=CC2=C1 AK-36299 [1,1,0,0,0,0|2,0,0]=4 513 B11R2.36 BrC1=CC=C2CCOC2=C1 AK114300 [1,1,0,0,0,0|1,0,1]=4 514 B11R2.36 BrC1=CC=C2N=CSC2=C1 AK-23853 [1,1,0,0,0,0|0,1,0]=3 515 B11R2.36 BrC1=CC=C2NC=NC2=C1 AK-29293 [1,1,0,0,0,0|1,0,0]=3 516 B11R2.36 BrC1=CC=C2OC=CC2=C1 AK-32378 [1,1,0,0,0,0|1,0,0]=3 517 B11R2.36 BrC1=CC=C2OC=NC2=C1 AK-27046 [1,1,0,0,0,0|0,0,0]=2 518 B11R2.36 BrC1=CC=C2OCOC2=C1 AK-34440 [1,1,0,0,0,0|1,0,1]=4 519 B11R2.36 BrC1=CN2C(C=C1)=NC=C2 AK-23855 [1,1,0,0,0,0|2,0,0]=4 520 B11R2.36 BrC1=CN2C(C=C1)=NC=N2 AK-25050 [1,1,0,0,0,0|2,0,0]=4 521 B11R2.36 BrC1=CN2N=CC=C2C=C1 AK-76581 [1,1,0,0,0,0|2,0,0]=4 522 B11R2.36 BrC1=CN=C2C(=C1)N=CS2 AK-26808 [1,1,0,0,0,0|1,1,0]=4 523 B11R2.36 BrC1=CN=C2C(=C1)OC=N2 AK-30677 [1,1,0,0,0,0|1,0,0]=3 524 B11R2.36 C1=C(Br)C=NC2=C1[NH]C=N2 AK-24151 [1,1,0,0,0,0|2,0,0]=4 525 B11R2.36 C1=C(O)C=CC2=C1SC=N2 AK-23865 [1,1,0,0,0,0|0,1,0]=3 526 B11R2.36 C1=C2C(=CC=C1C)[NH]C=C2 AK-30411 [1,1,0,0,0,0|1,0,1]=4 527 B11R2.36 C1=CC(=CC2=C1N=CS2)N AK-23846 [1,1,0,0,0,0|0,1,0]=3 528 B11R2.36 C1=CC(=CC2=C1OC=N2)Cl AK-25489 [1,1,0,0,0,0|0,0,0]=2 529 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Br AK-31145 [1,1,0,0,0,0|1,0,1]=4 530 B11R2.36 C1=CC(=CC2=C1[NH]C=C2)Cl AK-32262 [1,1,0,0,0,0|1,0,1]=4 531 B11R2.36 C1=CC2=C([NH]1)C=CC(=C2)O AK-39838 [1,1,0,0,0,0|1,0,1]=4 532 B11R2.36 C1=C[NH]C2=C1C=CC(=C2)Br AK-24752 [1,1,0,0,0,0|1,0,1]=4 533 B11R2.36 CC1=CC2=C(C=C1)C=CN2 AK-16454 [1,1,0,0,0,0|1,0,1]=4 534 B11R2.36 CC1=CC2=C(NN=N2)C=C1 AK-58651 [1,1,0,0,0,0|2,0,0]=4 535 B11R2.36 CC1=CC2=NSN=C2C=C1 AK142033 [1,1,0,0,0,0|2,0,0]=4 536 B11R2.36 CC1=CC=C2C=CSC2=C1 AK-61037 [1,1,0,0,0,0|1,1,0]=4 537 B11R2.36 CC1=CC=C2NC=NC2=C1 AK-87161 [1,1,0,0,0,0|1,0,0]=3 538 B11R2.36 CC1=NC2=C(NC=N2)C=C1 AK-67595 [1,1,0,0,0,0|2,0,0]=4 539 B11R2.36 ClC1=CC2=C(C=C1)C=CN2 AK-27245 [1,1,0,0,0,0|1,0,1]=4 540 B11R2.36 ClC1=CC2=C(C=C1)N=CS2 AK-59706 [1,1,0,0,0,0|0,1,0]=3 541 B11R2.36 ClC1=CC2=C(C=C1)SC=C2 AK-25573 [1,1,0,0,0,0|1,1,0]=4 542 B11R2.36 ClC1=CC2=C(C=N1)N=CN2 AK-64620 [1,1,0,0,0,0|2,0,0]=4 543 B11R2.36 ClC1=CC2=C(CC=C2)C=C1 AK115909 [1,1,0,0,0,0|2,0,0]=4 544 B11R2.36 ClC1=CC2=C(SC=N2)C=C1 AK-86852 [1,1,0,0,0,0|0,1,0]=3 545 B11R2.36 ClC1=CC2=CC=NN2C=C1 AK151041 [1,1,0,0,0,0|2,0,0]=4 546 B11R2.36 ClC1=CC2=NC=CN2C=C1 AK-24970 [1,1,0,0,0,0|2,0,0]=4 547 B11R2.36 ClC1=CC=C2C(NC=N2)=C1 AK206316 [1,1,0,0,0,0|1,0,0]=3 548 B11R2.36 ClC1=CC=C2C(NC=N2)=N1 AK-35460 [1,1,0,0,0,0|2,0,0]=4 549 B11R2.36 ClC1=CC=C2NN=NC2=C1 AK403403 [1,1,0,0,0,0|2,0,0]=4 550 B11R2.36 ClC1=CC=C2OCCC2=C1 AK143639 [1,1,0,0,0,0|1,0,1]=4 551 B11R2.36 ClC1=CN2C(C=C1)=NC=C2 AK-26874 [1,1,0,0,0,0|2,0,0]=4 552 B11R2.36 FC1=CC2=C(C=C1)C=CN2 AK-26628 [1,1,0,0,0,0|1,0,1]=4 553 B11R2.36 FC1=CC2=C(NC=C2)C=C1 AK-30363 [1,1,0,0,0,0|1,0,1]=4 554 B11R2.36 FC1=CC2=C(OC=C2)C=C1 AK-81560 [1,1,0,0,0,0|1,0,0]=3 555 B11R2.36 FC1=CC2=NC=CN2C=C1 AK111515 [1,1,0,0,0,0|2,0,0]=4 556 B11R2.36 FC1=CC=C2NC=NC2=C1 AK126224 [1,1,0,0,0,0|1,0,0]=3 557 B11R2.36 IC1=CC2=C(C=C1)N=CN2 AK-77092 [1,1,0,0,0,0|1,0,0]=3 558 B11R2.36 IC1=CC2=C(C=CN2)C=C1 AK-31785 [1,1,0,0,0,0|1,0,1]=4 559 B11R2.36 IC1=CN2C(C=C1)=NC=C2 AK165565 [1,1,0,0,0,0|2,0,0]=4 560 B11R2.36 IC1=CN2C(C=C1)=NC=N2 AK-31894 [1,1,0,0,0,0|2,0,0]=4 561 B11R2.36 N1=C2[N](C=C1)C=C(C=C2)N AK-26823 [1,1,0,0,0,0|2,0,0]=4 562 B11R2.36 NC1=CC2=C(C=C1)C=NO2 AK-36485 [1,1,0,0,0,0|2,0,0]=4 563 B11R2.36 NC1=CC2=C(NC=C2)C=C1 AK-35447 [1,1,0,0,0,0|1,0,1]=4 564 B11R2.36 NC1=CC2=C(OCO2)C=C1 AK-33266 [1,1,0,0,0,0|1,0,1]=4 565 B11R2.36 NC1=CC2=C(ON=C2)C=C1 AK-64412 [1,1,0,0,0,0|2,0,0]=4 566 B11R2.36 NC1=CC2=CC=NN2C=C1 AK109816 [1,1,0,0,0,0|2,0,0]=4 567 B11R2.36 NC1=CC2=NNN=C2C=C1 AK-29169 [1,1,0,0,0,0|2,0,0]=4 568 B11R2.36 NC1=CC2=NSN=C2C=C1 AK-36648 [1,1,0,0,0,0|2,0,0]=4 569 B11R2.36 NC1=CC=C2N=NSC2=C1 AK321515 [1,1,0,0,0,0|1,1,0]=4 570 B11R2.36 NC1=CC=C2OCCC2=C1 AK109466 [1,1,0,0,0,0|1,0,1]=4 571 B11R2.36 NC1=CC=C2OCOC2=C1 AK100870 [1,1,0,0,0,0|1,0,1]=4 572 B11R2.36 NC1=CC=C2SC=NC2=C1 AK-24849 [1,1,0,0,0,0|0,1,0]=3 573 B11R2.36 O1C2=C(N=C1)C=CC(=C2)N AK-32056 [1,1,0,0,0,0|0,0,0]=2 574 B11R2.36 O=C1C=CC2=C(NC=N2)N1 AK-67949 [1,1,0,0,0,0|2,0,0]=4 575 B11R2.36 OC1=CC2=C(C=NO2)C=C1 AK-24400 [1,1,0,0,0,0|2,0,0]=4 576 B11R2.36 OC1=CC2=C(SC=N2)C=C1 AK-40507 [1,1,0,0,0,0|0,1,0]=3 577 B11R2.36 OC1=CC2=NC=CN2C=C1 AK104038 [1,1,0,0,0,0|2,0,0]=4 578 B11R2.36 OC1=CC=C2NC=NC2=C1 AK-45322 [1,1,0,0,0,0|1,0,0]=3 579 B11R2.106 BrC1=C2C=NOC2=CC=C1 AK-31241 [1,1,0,0,0,0|2,0,0]=4 580 B11R2.106 BrC1=C2N=COC2=CC=C1 AK-27160 [1,1,0,0,0,0|0,0,0]=2 581 B11R2.106 BrC1=C2OC=CC2=CC=C1 AK-32541 [1,1,0,0,0,0|1,0,0]=3 582 B11R2.106 BrC1=C2OCCC2=CC=C1 AK-49553 [1,1,0,0,0,0|1,0,1]=4 583 B11R2.106 BrC1=C2OCOC2=CC=C1 AK-32027 [1,1,0,0,0,0|1,0,1]=4 584 B11R2.106 BrC1=C2SC=NC2=CC=C1 AK-28450 [1,1,0,0,0,0|0,1,0]=3 585 B11R2.106 BrC1=CC=CC2=C1CC=C2 AK121794 [1,1,0,0,0,0|2,0,0]=4 586 B11R2.106 BrC1=CC=CC2=C1N=CS2 AK-36331 [1,1,0,0,0,0|0,1,0]=3 587 B11R2.106 BrC1=CC=CC2=C1N=C[NH]2 AK-32245 [1,1,0,0,0,0|1,0,0]=3 588 B11R2.106 BrC1=CC=CC2=C1NC=C2 AK-27182 [1,1,0,0,0,0|1,0,1]=4 589 B11R2.106 BrC1=CC=CC2=C1OC=N2 AK-68227 [1,1,0,0,0,0|0,0,0]=2 590 B11R2.106 BrC1=CC=CC2=NC=CN12 AK-22003 [1,1,0,0,0,0|2,0,0]=4 591 B11R2.106 BrC1=CC=CC2=NC=N[N]12 AK-28397 [1,1,0,0,0,0|2,0,0]=4 592 B11R2.106 BrC1=CC=CC2=NSN=C21 AK-88367 [1,1,0,0,0,0|2,0,0]=4 593 B11R2.106 BrC1=CC=NC2=C1N=CN2 AK-50437 [1,1,0,0,0,0|2,0,0]=4 594 B11R2.106 BrC1=CN=CC2=C1OC=N2 AK138483 [1,1,0,0,0,0|1,0,0]=3 595 B11R2.106 BrC1=CN=CC2=C1[NH]C=N2 AK-28159 [1,1,0,0,0,0|2,0,0]=4 596 B11R2.106 C1=CC=C(C2=C1[NH]C=C2)Cl AK-29938 [1,1,0,0,0,0|1,0,1]=4 597 B11R2.106 C1=CN=C2[N]1C(=CC=C2)N AK-30097 [1,1,0,0,0,0|2,0,0]=4 598 B11R2.106 C1=CN=C2[N]1C=CC=C2Br AK-28149 [1,1,0,0,0,0|2,0,0]=4 599 B11R2.106 C1=CSC2=C1C=CC=C2Br AK-33264 [1,1,0,0,0,0|1,1,0]=4 600 B11R2.106 C1=CSC2=CC=CC(=C12)Br AK-28145 [1,1,0,0,0,0|1,1,0]=4 601 B11R2.106 C1=C[NH]C2=C1C(=CC=C2)Br AK-16402 [1,1,0,0,0,0|1,0,1]=4 602 B11R2.106 CC1=C2NC=NC2=CC=C1 AK140118 [1,1,0,0,0,0|1,0,0]=3 603 B11R2.106 CC1=CC=CC2=C1C=CN2 AK-45790 [1,1,0,0,0,0|1,0,1]=4 604 B11R2.106 CC1=CC=CC2=C1C=CS2 AK-33268 [1,1,0,0,0,0|1,1,0]=4 605 B11R2.106 CC1=CC=CC2=C1NC=C2 AK-36907 [1,1,0,0,0,0|1,0,1]=4 606 B11R2.106 ClC1=C2C(OC=C2)=NC=C1 AK112848 [1,1,0,0,0,0|2,0,0]=4 607 B11R2.106 ClC1=C2C=CSC2=CC=C1 AK319040 [1,1,0,0,0,0|1,1,0]=4 608 B11R2.106 ClC1=C2CC=CC2=CC=C1 AK-80051 [1,1,0,0,0,0|2,0,0]=4 609 B11R2.106 ClC1=C2NC=NC2=CC=C1 AK139813 [1,1,0,0,0,0|1,0,0]=3 610 B11R2.106 ClC1=C2NN=NC2=CC=C1 AK125386 [1,1,0,0,0,0|2,0,0]=4 611 B11R2.106 ClC1=C2[NH]C=NC2=NC=C1 AK-30306 [1,1,0,0,0,0|2,0,0]=4 612 B11R2.106 ClC1=CC=CC2=NC=C[N]12 AK-68247 [1,1,0,0,0,0|2,0,0]=4 613 B11R2.106 ClC1=NC=CC2=C1C=CO2 AK-32518 [1,1,0,0,0,0|2,0,0]=4 614 B11R2.106 ClC1=NC=CC2=C1N=CS2 AK201535 [1,1,0,0,0,0|1,1,0]=4 615 B11R2.106 ClC1=NC=CC2=C1N=C[NH]2 AK-23756 [1,1,0,0,0,0|2,0,0]=4 616 B11R2.106 FC1=C2C(C=CS2)=CC=C1 AK120871 [1,1,0,0,0,0|1,1,0]=4 617 B11R2.106 FC1=CC=CC2=C1C=CN2 AK-25895 [1,1,0,0,0,0|1,0,1]=4 618 B11R2.106 FC1=CC=CC2=C1NC=C2 AK-29993 [1,1,0,0,0,0|1,0,1]=4 619 B11R2.106 N1=C2[N](C=C1)C=CC=C2N AK-27772 [1,1,0,0,0,0|2,0,0]=4 620 B11R2.106 NC1=C2CCOC2=CC=C1 AK-83274 [1,1,0,0,0,0|1,0,1]=4 621 B11R2.106 NC1=C2NC=NC2=CC=C1 AK-30023 [1,1,0,0,0,0|1,0,0]=3 622 B11R2.106 NC1=C2OCCC2=CC=C1 AK142017 [1,1,0,0,0,0|1,0,1]=4 623 B11R2.106 NC1=C2OCOC2=CC=C1 AK-38427 [1,1,0,0,0,0|1,0,1]=4 624 B11R2.106 NC1=CC=CC2=C1C=CN2 AK-28017 [1,1,0,0,0,0|1,0,1]=4 625 B11R2.106 O=C1C2=C(OC=C2)C=CN1 AK-39776 [1,1,0,0,0,0|2,0,0]=4 626 B11R2.106 OC1=C2C(NC=N2)=CC=C1 AK114476 [1,1,0,0,0,0|1,0,0]=3 627 B11R2.106 OC1=CC=CC2=C1N=CS2 AK-31451 [1,1,0,0,0,0|0,1,0]=3 628 B11R2.106 OC1=CC=CC2=C1NC=C2 AK-48053 [1,1,0,0,0,0|1,0,1]=4 629 B11R2.106 OC1=CC=CN2C1=NC=C2 AK126257 [1,1,0,0,0,0|2,0,0]=4 630 B11R2.106 S1C2=C(N=C1)C=CC=C2N AK-29780 [1,1,0,0,0,0|0,1,0]=3 631 B11R2.988 OCC1C2=CC=CC=C2C1 AK550201 [0,1,0,0,1,0|1,0,1]=4 632 B13R2.32 BrC1=C(Br)N=CC2=C1C=CC=C2 AK-49733 [0,1,0,0,0,1|2,0,0]=4 633 B13R2.32 CC1=C(N)C2=C(C=CC=C2)C=C1 AK-81542 [0,1,0,0,0,1|2,0,0]=4 634 B13R2.32 CC1=C(O)C2=C(C=CC=C2)C=C1 AK-45771 [0,1,0,0,0,1|2,0,0]=4 635 B13R2.32 ClC1=C(Br)C=NC2=C1C=CC=C2 AK-36273 [0,1,0,0,0,1|2,0,0]=4 636 B13R2.32 ClC1=C(C2=CC=CC=C2C=N1)N AK-24958 [0,1,0,0,0,1|2,0,0]=4 637 B13R2.32 IC1=C(Cl)C2=CC=CC=C2N=C1 AK114474 [0,1,0,0,0,1|2,0,0]=4 638 B13R2.32 NC1=C(C=NC2=CC=CC=C12)Br AK-23731 [0,1,0,0,0,1|2,0,0]=4 639 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 AK156251 [0,1,0,0,0,1|2,0,0]=4 640 B13R2.32 NC1=C(N=CC2=CC=CC=C12)Br AK-24957 [0,1,0,0,0,1|2,0,0]=4 641 B13R2.32 OC1=C(C)C2=CC=CC=C2N=C1 AK131001 [0,1,0,0,0,1|2,0,0]=4 642 B13R2.32 OC1=C(I)C=NC2=CC=CC=C12 AK146195 [0,1,0,0,0,1|2,0,0]=4 643 B13R2.32 OC1=C2C=CC=CC2=NN=C1Br AK137688 [0,1,0,0,0,1|2,0,0]=4 644 B13R2.57 BrCC1=CC=C2C=CC=CC2=C1 AK-48607 [0,1,0,0,0,1|2,0,0]=4 645 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 AK-35655 [0,1,0,0,0,1|1,0,0]=3 646 B13R2.57 C1=C2C(=CC=C1)C=C(C=C2)CO AK-48971 [0,1,0,0,0,1|2,0,0]=4 647 B13R2.57 C1=NC(=CC2=C1C=CC=C2)C=O AK-24631 [0,1,0,0,0,1|1,0,1]=4 648 B13R2.57 C1=NC(=CC2=CC=CC=C12)CN AK-39317 [0,1,0,0,0,1|1,0,0]=3 649 B13R2.57 C1=NC(=CC2=CC=CC=C12)CO AK-24630 [0,1,0,0,0,1|1,0,0]=3 650 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 AK110812 [0,1,0,0,0,1|2,0,0]=4 651 B13R2.57 COC1=CC2=CC=CC=C2N=C1 AK-39637 [0,1,0,0,0,1|1,0,0]=3 652 B13R2.57 COC1=NC2=CC=CC=C2C=C1 AK-94453 [0,1,0,0,0,1|1,0,0]=3 653 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47007 [0,1,0,0,0,1|1,0,0]=3 654 B13R2.57 ClCC1=CC2=C(C=N1)C=CC=C2 AK-47121 [0,1,0,0,0,1|1,0,0]=3 655 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 AK-77406 [0,1,0,0,0,1|1,0,0]=3 656 B13R2.57 N#CC1=CC2=C(C=N1)C=CC=C2 AK-34461 [0,1,0,0,0,1|1,0,1]=4 657 B13R2.57 NCC1=CC2=C(C=CC=C2)C=C1 AK-33985 [0,1,0,0,0,1|2,0,0]=4 658 B13R2.57 NCC1=CC2=C(C=N1)C=CC=C2 AK162840 [0,1,0,0,0,1|1,0,0]=3 659 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 AK-49046 [0,1,0,0,0,1|2,0,0]=4 660 B13R2.57 NCC1CCC2=C(O1)C=CC=C2 AK552036 [0,1,0,0,0,1|1,0,1]=4 661 B13R2.57 NC[C@H]1CCC2=C(O1)C=CC=C2 AK130937 [0,1,0,0,0,1|1,0,1]=4 662 B13R2.57 NNC1=CC2=C(C=CC=C2)N=C1 AK-82067 [0,1,0,0,0,1|2,0,0]=4 663 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 AK-30242 [0,1,0,0,0,1|1,0,1]=4 664 B13R2.57 O=CC1=NC2=C(C=CC=C2)N=C1 AK-25470 [0,1,0,0,0,1|1,0,1]=4 665 B13R2.57 OCC1=CC2=NC=CC=C2N=C1 AK470825 [0,1,0,0,0,1|2,0,0]=4 666 B13R2.155 BrC1=CC2=C(C=C1)OCC(N2)=O AK-26843 [0,1,0,0,0,1|1,0,1]=4 667 B13R2.155 BrC1=CC2=NC(N)=NC=C2C=C1 AK-30515 [0,1,0,0,0,1|2,0,0]=4 668 B13R2.155 BrC1=CC=C2C(=C1)N=C(C=N2)Cl AK-26677 [0,1,0,0,0,1|2,0,0]=4 669 B13R2.155 BrC1=CC=C2C(=C1)N=C(N=C2)Cl AK-24796 [0,1,0,0,0,1|2,0,0]=4 670 B13R2.155 C1=CC(=CC2=C1C=CC(O2)=O)O AK-26455 [0,1,0,0,0,1|2,0,0]=4 671 B13R2.155 CC1=NC2=C(C=CC(Br)=C2)C=C1 AK111212 [0,1,0,0,0,1|1,0,0]=3 672 B13R2.155 CC1=NC2=CC(Br)=CC=C2C=N1 AK-42108 [0,1,0,0,0,1|1,0,0]=3 673 B13R2.155 CC1=NC2=CC(Cl)=CC=C2C=C1 AK-23874 [0,1,0,0,0,1|1,0,0]=3 674 B13R2.155 ClC1=CC2=C(C=N1)C=CC(Br)=C2 AK-40954 [0,1,0,0,0,1|2,0,0]=4 675 B13R2.155 ClC1=CC=C2OCC(=O)CC2=C1 AK-96205 [0,1,0,0,0,1|2,0,0]=4 676 B13R2.155 ClC1=NC2=C(C=CC(Br)=C2)C=C1 AK-37014 [0,1,0,0,0,1|2,0,0]=4 677 B13R2.155 ClC1=NC2=CC(=CC=C2N=C1)C AK-26907 [0,1,0,0,0,1|2,0,0]=4 678 B13R2.155 FC1=CC2=C(C=NC(Cl)=C2)C=C1 AK310526 [0,1,0,0,0,1|2,0,0]=4 679 B13R2.155 FC1=CC=C2N=CC(Cl)=NC2=C1 AK119922 [0,1,0,0,0,1|2,0,0]=4 680 B13R2.155 IC1=CC=C2N=CC(Br)=CC2=C1 AK127010 [0,1,0,0,0,1|2,0,0]=4 681 B13R2.155 NC1=CC2=C(C=CC(Br)=C2)C=N1 AK-27230 [0,1,0,0,0,1|2,0,0]=4 682 B13R2.155 NC1=CC2=C(OCC(=O)N2)C=C1 AK-30183 [0,1,0,0,0,1|1,0,1]=4 683 B13R2.155 NC1=CC=C2N=CC(Br)=CC2=C1 AK105869 [0,1,0,0,0,1|2,0,0]=4 684 B13R2.155 NC1=NC2=CC(Br)=CC=C2C=C1 AK126950 [0,1,0,0,0,1|2,0,0]=4 685 B13R2.155 O=C1NC2=C(C=CC(Br)=C2)N=C1 AK-26676 [0,1,0,0,0,1|2,0,0]=4 686 B13R2.155 OC1=CC2=C(C=C1)N=CC(Br)=C2 AK-89992 [0,1,0,0,0,1|2,0,0]=4 687 B13R2.155 OC1=CC2=CC(Br)=CC=C2N=C1 AK-43231 [0,1,0,0,0,1|2,0,0]=4 688 B13R2.155 OC1=CC=C2N=CC(I)=CC2=C1 AK138167 [0,1,0,0,0,1|2,0,0]=4 689 B13R2.155 OC1=NC2=CC(=CC=C2C=C1)O AK-26280 [0,1,0,0,0,1|2,0,0]=4 690 B13R2.162 BrC1=C2N=C(N=CC2=CC=C1)Cl AK-27609 [0,1,0,0,0,1|2,0,0]=4 691 B13R2.162 BrC1=CC2=C(C=N1)C=CC=C2N AK-28566 [0,1,0,0,0,1|2,0,0]=4 692 B13R2.162 BrC1=CC=CC2=C1OC(C=C2)=O AK-24668 [0,1,0,0,0,1|2,0,0]=4 693 B13R2.162 BrC1=NC2=C(C=CC=C2Br)C=C1 AK103449 [0,1,0,0,0,1|2,0,0]=4 694 B13R2.162 C1=C2C(=NC(=C1)C)C(=CC=C2)O AK-28678 [0,1,0,0,0,1|1,0,0]=3 695 B13R2.162 C1=CC2=CC=CC(=C2N=C1C)N AK-28486 [0,1,0,0,0,1|1,0,0]=3 696 B13R2.162 CC1=C2N=C(Cl)C=CC2=CC=C1 AK-93928 [0,1,0,0,0,1|2,0,0]=4 697 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 AK-31867 [0,1,0,0,0,1|1,0,0]=3 698 B13R2.162 CC1=NC2=C(C=CC=C2C)C=C1 AK111198 [0,1,0,0,0,1|1,0,0]=3 699 B13R2.162 ClC1=C2N=C(Cl)C=CC2=CC=C1 AK-54989 [0,1,0,0,0,1|2,0,0]=4 700 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 AK-33570 [0,1,0,0,0,1|2,0,0]=4 701 B13R2.162 ClC1=NC2=C(C=CC=C2N=C1)Cl AK-26905 [0,1,0,0,0,1|2,0,0]=4 702 B13R2.162 ClC1=NC2=C(Cl)C=CC=C2C=N1 AK-31852 [0,1,0,0,0,1|2,0,0]=4 703 B13R2.162 NC1=C2C=C(C)C=CC2=CC=C1 AK150342 [0,1,0,0,0,1|2,0,0]=4 704 B13R2.162 NC1=CC=CC2=C1C=C(Cl)N=C2 AK-24676 [0,1,0,0,0,1|2,0,0]=4 705 B13R2.162 NC1=NC2=C(Br)C=CC=C2C=C1 AK164599 [0,1,0,0,0,1|2,0,0]=4 706 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 AK-65356 [0,1,0,0,0,1|2,0,0]=4 707 B13R2.162 OC1=C2C=C(F)C=NC2=CC=C1 AK164644 [0,1,0,0,0,1|2,0,0]=4 708 B13R2.162 OC1=C2N=C(Br)C=CC2=CC=C1 AK145826 [0,1,0,0,0,1|2,0,0]=4 709 B13R2.162 OC1=C2N=C(Cl)C=CC2=CC=C1 AK112608 [0,1,0,0,0,1|2,0,0]=4 710 B13R2.162 OC1=CC=CC2=C1NC(CO2)=O AK-24440 [0,1,0,0,0,1|1,0,1]=4 711 B13R2.162 OC1=NC2=C(Cl)C=CC=C2C=C1 AK-32524 [0,1,0,0,0,1|2,0,0]=4 712 B13R2.328 BrC1=NC(=CC2=CC=CC=C12)Br AK-24473 [0,1,0,0,0,1|2,0,0]=4 713 B13R2.328 BrC1=NC2=C(C=CC=C2)C(Br)=C1 AK-72566 [0,1,0,0,0,1|2,0,0]=4 714 B13R2.328 BrC1=NC2=CC=CC=C2C(=N1)Br AK-24255 [0,1,0,0,0,1|2,0,0]=4 715 B13R2.328 BrC1=NC2=CC=CC=C2C(N)=C1 AK-31026 [0,1,0,0,0,1|2,0,0]=4 716 B13R2.328 C1=CC2=C(C=C1)N=C(N=C2Cl)Cl AK-28695 [0,1,0,0,0,1|2,0,0]=4 717 B13R2.328 C1=CC=CC2=C1N=C(N=C2C)C AK-46661 [0,1,0,0,0,1|1,0,0]=3 718 B13R2.328 CC1=C2C=CC=CC2=NC(Cl)=N1 AK-30464 [0,1,0,0,0,1|2,0,0]=4 719 B13R2.328 CC1=CC(Br)=C2C=CC=CC2=C1 AK127805 [0,1,0,0,0,1|2,0,0]=4 720 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 AK143362 [0,1,0,0,0,1|2,0,0]=4 721 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 AK-54599 [0,1,0,0,0,1|1,0,0]=3 722 B13R2.328 CC1=CC(Cl)=NC2=C1C=CC=C2 AK-74209 [0,1,0,0,0,1|2,0,0]=4 723 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 AK-94090 [0,1,0,0,0,1|1,0,0]=3 724 B13R2.328 ClC1=CC2=C(C(Cl)=N1)C=CC=C2 AK-28004 [0,1,0,0,0,1|2,0,0]=4 725 B13R2.328 ClC1=NC(=NC2=CC=CC=C12)C AK-30091 [0,1,0,0,0,1|1,0,0]=3 726 B13R2.328 ClC1=NC2=C(C=CC=C2)C(Cl)=C1 AK-36160 [0,1,0,0,0,1|2,0,0]=4 727 B13R2.328 NC1=CC(C)=NC2=CC=CC=C12 AK-32600 [0,1,0,0,0,1|1,0,0]=3 728 B13R2.328 NC1=CC(Cl)=NC2=C1C=CC=C2 AK-31025 [0,1,0,0,0,1|2,0,0]=4 729 B13R2.328 NC1=NC(Cl)=CC2=C1C=CC=C2 AK147558 [0,1,0,0,0,1|2,0,0]=4 730 B13R2.328 NC1=NC(Cl)=NC2=CC=CC=C12 AK-30469 [0,1,0,0,0,1|2,0,0]=4 731 B13R2.328 NC1=NC2=CC=CC=C2C(Br)=C1 AK151251 [0,1,0,0,0,1|2,0,0]=4 732 B13R2.328 NC1=NC2=CC=CC=C2C(N)=N1 AK-78965 [0,1,0,0,0,1|2,0,0]=4 733 B13R2.328 O=C1NC(=O)C2=CC=CC=C2O1 AK-55016 [0,1,0,0,0,1|1,0,1]=4 734 B13R2.328 O=C1NC(Cl)=NC2=C1C=CC=C2 AK-84561 [0,1,0,0,0,1|2,0,0]=4 735 B13R2.328 O=C1OC2=C(C=CC=C2)C(O)=C1 AK-49238 [0,1,0,0,0,1|2,0,0]=4 736 B13R2.328 OC1=C2C=CC=CC2=NC(C)=N1 AK-47027 [0,1,0,0,0,1|1,0,0]=3 737 B13R2.328 OC1=CC(C)=NC2=CC=CC=C12 AK499556 [0,1,0,0,0,1|1,0,0]=3 738 B13R2.328 OC1=NC(N)=C2C=CC=CC2=N1 AK-24683 [0,1,0,0,0,1|2,0,0]=4 739 B13R2.328 OC1=NC2=CC=CC=C2C(C)=C1 AK-38350 [0,1,0,0,0,1|2,0,0]=4 740 B13R2.369 BrC1=NC2=CC=CC=C2C=C1Br AK-39851 [0,1,0,0,0,1|2,0,0]=4 741 B13R2.369 CC1=NC2=CC=CC=C2C=C1N AK-30794 [0,1,0,0,0,1|1,0,0]=3 742 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl AK-79092 [0,1,0,0,0,1|2,0,0]=4 743 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl AK-32080 [0,1,0,0,0,1|2,0,0]=4 744 B13R2.369 NC1=NC2=CC=CC=C2C=C1Br AK-75962 [0,1,0,0,0,1|2,0,0]=4 745 B13R2.369 NC1=NC2=CC=CC=C2N=C1Cl AK113688 [0,1,0,0,0,1|2,0,0]=4 746 B13R2.369 NC1=NC2=CC=CC=C2N=C1N AK388486 [0,1,0,0,0,1|2,0,0]=4 747 B13R2.369 OC1=CC2=C(C=CC=C2)N=C1Cl AK-82046 [0,1,0,0,0,1|2,0,0]=4 748 B13R2.3683 BrC1=CC=C2C(=C1)C=NC(=C2)N AK-24946 [0,1,0,0,0,1|2,0,0]=4 749 B13R2.3683 BrC1=CC=C2N=C(C=NC2=C1)Cl AK-27466 [0,1,0,0,0,1|2,0,0]=4 750 B13R2.3683 BrC1=CC=C2N=C(C=NC2=C1)O AK-27835 [0,1,0,0,0,1|2,0,0]=4 751 B13R2.3683 BrC1=CC=C2N=C(N=CC2=C1)Cl AK-24533 [0,1,0,0,0,1|2,0,0]=4 752 B13R2.3683 BrC1=CC=C2OC(=O)CCC2=C1 AK-72713 [0,1,0,0,0,1|2,0,0]=4 753 B13R2.3683 BrC1=NC2=CC=C(C=C2C=N1)Br AK-23576 [0,1,0,0,0,1|2,0,0]=4 754 B13R2.3683 C1=C(Br)C=CC2=C1C=CC(O2)=O AK-26888 [0,1,0,0,0,1|2,0,0]=4 755 B13R2.3683 C1=C(C)C=CC2=C1C=CC(O2)=O AK-47577 [0,1,0,0,0,1|2,0,0]=4 756 B13R2.3683 C1=C2C(=CC=C1Cl)NC(=O)C=N2 AK-23500 [0,1,0,0,0,1|2,0,0]=4 757 B13R2.3683 CC1=CC2=CN=C(Cl)N=C2C=C1 AK126963 [0,1,0,0,0,1|2,0,0]=4 758 B13R2.3683 CC1=CC=C2N=C(Br)C=CC2=C1 AK-34594 [0,1,0,0,0,1|2,0,0]=4 759 B13R2.3683 CC1=NC2=C(C=C1)C=C(F)C=C2 AK-27111 [0,1,0,0,0,1|1,0,0]=3 760 B13R2.3683 CC1=NC2=CC=C(Br)C=C2C=C1 AK-26649 [0,1,0,0,0,1|1,0,0]=3 761 B13R2.3683 ClC1=CC2=C(C=C(Br)C=C2)N=C1 AK102533 [0,1,0,0,0,1|2,0,0]=4 762 B13R2.3683 ClC1=CC=C2N=C(Cl)C=CC2=C1 AK-39625 [0,1,0,0,0,1|2,0,0]=4 763 B13R2.3683 ClC1=CC=C2N=C(Cl)C=NC2=C1 AK-38040 [0,1,0,0,0,1|2,0,0]=4 764 B13R2.3683 ClC1=CC=C2N=C(N)N=NC2=C1 AK-38589 [0,1,0,0,0,1|2,0,0]=4 765 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 AK-27465 [0,1,0,0,0,1|2,0,0]=4 766 B13R2.3683 ClC1=NC2=CC=C(C=C2N=C1)F AK-24548 [0,1,0,0,0,1|2,0,0]=4 767 B13R2.3683 FC1=CC=C2N=C(Cl)C=CC2=C1 AK-93820 [0,1,0,0,0,1|2,0,0]=4 768 B13R2.3683 FC1=CC=C2NC(C=NC2=C1)=O AK-24547 [0,1,0,0,0,1|2,0,0]=4 769 B13R2.3683 NC1=CC2=C(C=C(Cl)C=C2)N=C1 AK-49305 [0,1,0,0,0,1|2,0,0]=4 770 B13R2.3683 NC1=CC2=CC=C(Br)C=C2N=C1 AK122789 [0,1,0,0,0,1|2,0,0]=4 771 B13R2.3683 NC1=NC2=CC=C(F)C=C2C=C1 AK135326 [0,1,0,0,0,1|2,0,0]=4 772 B13R2.3683 NC1=NC=C2C=C(Br)C=CC2=N1 AK-23849 [0,1,0,0,0,1|2,0,0]=4 773 B13R2.3683 O=C1CCC2=C(O1)C=CC(I)=C2 AK544562 [0,1,0,0,0,1|2,0,0]=4 774 B13R2.3683 O=C1NC2=C(C=C(N)C=C2)N=C1 AK128588 [0,1,0,0,0,1|2,0,0]=4 775 B13R2.3683 O=C1NC2=CC=C(Br)C=C2OC1 AK-31795 [0,1,0,0,0,1|1,0,1]=4 776 B13R2.3683 O=C1NC2=CC=C(Cl)C=C2OC1 AK-29067 [0,1,0,0,0,1|1,0,1]=4 777 B13R2.3683 O=C1NC2=CC=C(F)C=C2OC1 AK-30233 [0,1,0,0,0,1|1,0,1]=4 778 B13R2.3683 O=C1NC2=CC=C(I)C=C2OC1 AK-77082 [0,1,0,0,0,1|1,0,1]=4 779 B13R2.3683 OC1=CC=C2N=C(Cl)C=CC2=C1 AK-89425 [0,1,0,0,0,1|2,0,0]=4 780 B13R2.3683 OC1=NC2=CC=C(I)C=C2C=C1 AK-51648 [0,1,0,0,0,1|2,0,0]=4 781 B13R2.5179 CC1=NC2=C(C=C1)C(Cl)=CC=C2 AK111211 [0,1,0,0,0,1|1,0,0]=3 782 B13R2.5179 ClC1=C2C=CC(Cl)=NC2=CC=C1 AK123291 [0,1,0,0,0,1|2,0,0]=4 783 B13R2.5179 FC1=CC2=CC=CC(Br)=C2N=C1 AK164694 [0,1,0,0,0,1|2,0,0]=4 784 B13R2.5179 IC1=CC2=CC=CC(Cl)=C2N=C1 AK471124 [0,1,0,0,0,1|2,0,0]=4 785 B13R2.5179 NC1=C2C=CC(C)=CC2=CC=C1 AK150347 [0,1,0,0,0,1|2,0,0]=4 786 B13R2.5179 NC1=C2C=CC(C)=NC2=CC=C1 AK-81688 [0,1,0,0,0,1|1,0,0]=3 787 B13R2.5179 NC1=C2N=CC(Br)=CC2=CC=C1 AK103131 [0,1,0,0,0,1|2,0,0]=4 788 B13R2.5179 NC1=NC2=CC=CC(Cl)=C2C=C1 AK156291 [0,1,0,0,0,1|2,0,0]=4 789 B13R2.45 CN1C(CN)=NC2=C1C=CC=C2 AK-68772 [0,2,0,0,0,0|1,0,0]=3 790 B13R2.45 O=CC1=NC2=CC=CC=C2N1C AK-27082 [0,2,0,0,0,0|1,0,1]=4 791 B13R2.135 C1=CC=CC2=C1C(=C(C)[NH]2)C=O AK-16445 [0,2,0,0,0,0|1,0,1]=4 792 B13R2.135 CC=1N(CC)C2=C(C1)C=CC=C2 AK-87148 [0,2,0,0,0,0|1,0,1]=4 793 B13R2.135 CCN1C(Cl)=NC2=CC=CC=C12 AK158159 [0,2,0,0,0,0|2,0,0]=4 794 B13R2.135 N#CC1=C(C)NC2=C1C=CC=C2 AK-46068 [0,2,0,0,0,0|1,0,1]=4 795 B13R2.359 C1=CC=C2C(C(=NC2=C1)C)(C)C AK-47497 [0,2,0,0,0,0|1,0,0]=3 796 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 AK-78906 [0,2,0,0,0,0|1,0,1]=4 797 B13R2.3028 CC1=C(C)NC2=C1C=C(Br)C=C2 AK-49810 [0,2,0,0,0,0|1,0,1]=4 798 B13R2.3028 CC1=C(C)NC2=C1C=C(Cl)C=C2 AK-50295 [0,2,0,0,0,0|1,0,1]=4 799 B13R2.3028 CN1N=C2C=CC(Br)=CC2=C1C AK-79857 [0,2,0,0,0,0|2,0,0]=4 800 B13R2.4856 NC1=NC2=CC=CC(C)=C2N1C AK145901 [0,2,0,0,0,0|2,0,0]=4 801 B13R2.5190 CN1N=C2C=C(N)C=CC2=C1C AK-87346 [0,2,0,0,0,0|2,0,0]=4 802 B13R2.5190 NC1=CC2=NN(C)C(C)=C2C=C1 AK-94426 [0,2,0,0,0,0|2,0,0]=4 803 B13R2.5190 NC1=NC2=CC(C)=CC=C2N1C AK-48225 [0,2,0,0,0,0|2,0,0]=4 804 B13R2.5190 O=C1OC2=CC(Br)=CC=C2N1C AK166925 [0,2,0,0,0,0|1,0,1]=4 805 B13R2.26 C1=CC=CC2=C1[NH]C(=N2)CC#N AK-45709 [0,2,0,0,0,0|1,0,0]=3 806 B13R2.26 C1=CC=CC2=C1[NH]C(=N2)CCC AK-31915 [0,2,0,0,0,0|1,0,0]=3 807 B13R2.26 NCCC1=NC2=CC=CC=C2N1 AK-39478 [0,2,0,0,0,0|1,0,0]=3 808 B13R2.26 NCCC1=NC2=CC=CC=C2N1 AK-64394 [0,2,0,0,0,0|1,0,0]=3 809 B13R2.26 NCCC1=NC2=CC=CC=C2N1 AK155868 [0,2,0,0,0,0|1,0,0]=3 810 B13R2.43 CCC1=NC2=C(O1)C=CC(Br)=C2 AK-85672 [0,2,0,0,0,0|0,0,0]=2 811 B13R2.43 CCC1=NC2=CC=C(Cl)C=C2N1 AK144850 [0,2,0,0,0,0|1,0,0]=3 812 B13R2.43 CCN1N=C2C=CC(N)=CC2=C1 AK-40028 [0,2,0,0,0,0|2,0,0]=4 813 B13R2.43 CNC1=NC2=C(S1)C=C(Br)C=C2 AK109897 [0,2,0,0,0,0|0,1,0]=3 814 B13R2.43 N#CC1=NC2=CC=C(O)C=C2S1 AK-24194 [0,2,0,0,0,0|0,1,1]=4 815 B13R2.43 NC1=CC=C2C=C(CC)OC2=C1 AK445388 [0,2,0,0,0,0|1,0,0]=3 816 B13R2.43 NCC=1NC2=C(C1)C=C(C=C2)Cl AK144775 [0,2,0,0,0,0|1,0,1]=4 817 B13R2.43 NNC1=NC2=CC=C(Cl)C=C2O1 AK325881 [0,2,0,0,0,0|1,0,0]=3 818 B13R2.43 NNC1=NC2=CC=C(F)C=C2S1 AK343463 [0,2,0,0,0,0|1,1,0]=4 819 B13R2.43 O=CC1=NC2=CC=C(F)C=C2N1 AK-36724 [0,2,0,0,0,0|1,0,1]=4 820 B13R2.43 OCC1=NC2=C(N1)C=CC(F)=C2 AK-89007 [0,2,0,0,0,0|1,0,0]=3 821 B13R2.43 OCC1=NC2=C(N1)N=CC(Br)=C2 AK-29660 [0,2,0,0,0,0|2,0,0]=4 822 B13R2.43 OCC1=NC2=CC(Br)=CC=C2N1 AK121254 [0,2,0,0,0,0|1,0,0]=3 823 B13R2.43 OCC1=NC2=CC=C(Cl)C=C2N1 AK-99068 [0,2,0,0,0,0|1,0,0]=3 824 B13R2.54 CC1=C2N=C(NN)SC2=CC=C1 AK163351 [0,2,0,0,0,0|1,1,0]=4 825 B13R2.54 CC1=CC=CN2C1=NC(CCl)=C2 AK106013 [0,2,0,0,0,0|2,0,0]=4 826 B13R2.54 OCC1OC2=C(Br)C=CC=C2C1 AK130601 [0,2,0,0,0,0|1,0,1]=4 827 B13R2.435 BrC(C1=NC2=CC=CC=C2S1)Br AK143305 [0,2,0,0,0,0|0,1,0]=3 828 B13R2.435 C1=C(C(C)=O)SC2=C1C=CC=C2 AK-47399 [0,2,0,0,0,0|1,1,0]=4 829 B13R2.435 C1=C(C(O)=O)OC2=C1C=CC=C2 AK-29301 [0,2,0,0,0,0|1,0,1]=4 830 B13R2.435 C1=C2C(=CC=C1)[NH]C(=N2)C(=O)O AK-27807 [0,2,0,0,0,0|1,0,1]=4 831 B13R2.435 CC(C1=NC2=CC=CC=C2N1)=O AK106395 [0,2,0,0,0,0|1,0,0]=3 832 B13R2.435 FC(C1=NC2=CC=CC=C2N1)F AK-31910 [0,2,0,0,0,0|1,0,0]=3 833 B13R2.435 NC(=O)C1=NC2=C(N1)C=CC=C2 AK-89515 [0,2,0,0,0,0|1,0,1]=4 834 B13R2.435 O1C2=C(N=C1C(C)=O)C=CC=C2 AK-31935 [0,2,0,0,0,0|0,0,0]=2 835 B13R2.435 O=C(C=1NC2=C(C1)C=CC=C2)C AK-45604 [0,2,0,0,0,0|1,0,1]=4 836 B13R2.435 S1C2=C(N=C1C(=O)O)C=CC=C2 AK-40963 [0,2,0,0,0,0|0,1,1]=4 837 B13R2.3051 CC1(C)OC2=CC=C(Br)C=C2O1 AK115913 [0,2,0,0,0,0|1,0,1]=4 838 B13R2.3050 CC1=C(Br)C2=CN(C)N=C2C=C1 AK112689 [0,2,0,0,0,0|2,0,0]=4 839 B13R2.3050 CC1=CN2C=CC(I)=C(Cl)C2=N1 AK332698 [0,2,0,0,0,0|2,0,0]=4 840 B13R2.3050 CC=1NC2=C(C1)C(=C(C=C2)F)F AK-26368 [0,2,0,0,0,0|1,0,1]=4 841 B13R2.3050 CC=1NC2=C(C1)C(=C(C=C2)O)F AK-34534 [0,2,0,0,0,0|1,0,1]=4 842 B13R2.3050 CN1C=C2C(C=CC(Br)=C2C)=N1 AK-79851 [0,2,0,0,0,0|2,0,0]=4 843 B13R2.3050 NC1=C(F)C2=C(NC(C)=C2)C=C1 AK110452 [0,2,0,0,0,0|1,0,1]=4 844 B13R2.3050 NC1=NC2=C(C)C(Br)=CC=C2S1 AK550384 [0,2,0,0,0,0|1,1,0]=4 845 B13R2.5139 CC1=CC=C(C)C2=C1SC(N)=N2 AK111084 [0,2,0,0,0,0|1,1,0]=4 846 B13R2.5397 CC1=CC(Br)=CC2=CN(C)N=C12 AK174046 [0,2,0,0,0,0|2,0,0]=4 847 B13R2.5397 CC1=NN2C=C(Cl)C=C(Br)C2=N1 AK110610 [0,2,0,0,0,0|2,0,0]=4 848 B13R2.5397 ClC1=CC(Cl)=C2N=C(N)SC2=C1 AK-24050 [0,2,0,0,0,0|1,1,0]=4 849 B13R2.5397 ClC1=NC2=C(S1)C(Cl)=CC(Cl)=C2 AK-87481 [0,2,0,0,0,0|1,1,0]=4 850 B13R2.5397 ClC1=NC2=C(S1)C=C(C=C2F)F AK-24715 [0,2,0,0,0,0|1,1,0]=4 851 B13R2.5397 NC1=NC2=C(S1)C(Cl)=CC(Cl)=C2 AK-59566 [0,2,0,0,0,0|1,1,0]=4 852 B13R2.5397 NC1=NC2=C(S1)C(F)=CC(F)=C2 AK-87484 [0,2,0,0,0,0|1,1,0]=4 853 B13R2.5397 NC1=NC2=C(S1)C=C(Br)C=C2Br AK-63640 [0,2,0,0,0,0|1,1,0]=4 854 B13R2.2121 BrC1=NC2=C(S1)C=C(C=C2)OC AK-23615 [0,2,0,0,0,0|1,1,0]=4 855 B13R2.2121 C1=CC(=CC2=C1N=C(N)S2)OC AK-26975 [0,2,0,0,0,0|1,1,0]=4 856 B13R2.2121 CC1=NC2=C(S1)C=CC(=C2)C#N AK-88006 [0,2,0,0,0,0|0,1,0]=3 857 B13R2.2121 CC=1NC2=C(C1)C=C(C=C2)OC AK-32805 [0,2,0,0,0,0|1,0,1]=4 858 B13R2.2121 CN1N=C2C=CC(OC)=CC2=C1 AK270401 [0,2,0,0,0,0|2,0,0]=4 859 B13R2.2121 COC1=CC2=C(NC(N)=N2)C=C1 AK-35886 [0,2,0,0,0,0|2,0,0]=4 860 B13R2.2121 COC1=CC2=C(NC(S)=N2)C=C1 AK101104 [0,2,0,0,0,0|2,0,0]=4 861 B13R2.2121 COC1=CC2=C(SC(S)=N2)C=C1 AK-35637 [0,2,0,0,0,0|1,1,0]=4 862 B13R2.2121 COC1=CC=C2N=C(Cl)SC2=C1 AK-23628 [0,2,0,0,0,0|1,1,0]=4 863 B13R2.2121 ClC1=NC2=C(N1)C=CC(=C2)C#N AK-30377 [0,2,0,0,0,0|2,0,0]=4 864 B13R2.2121 ClC1=NC2=C(S1)C=C(C=C2)C#N AK-24749 [0,2,0,0,0,0|1,1,0]=4 865 B13R2.2121 ClC1=NC2=C(S1)C=CC(=C2)C#N AK-80680 [0,2,0,0,0,0|1,1,0]=4 866 B13R2.2121 N#CC1=CC=C2N=C(Br)SC2=C1 AK-50904 [0,2,0,0,0,0|1,1,0]=4 867 B13R2.2121 N#CC1=CC=C2NC(N)=NC2=C1 AK116191 [0,2,0,0,0,0|2,0,0]=4 868 B13R2.2121 N#CC1=CC=C2SC(N)=NC2=C1 AK-80117 [0,2,0,0,0,0|1,1,0]=4 869 B13R2.2121 NC1=NC2=C(S1)C=C(C=C2)C#N AK-27224 [0,2,0,0,0,0|1,1,0]=4 870 B13R2.2121 OCC1=CC=C2N=C(C)OC2=C1 AK128726 [0,2,0,0,0,0|0,0,0]=2 871 B13R2.2121 SC1=NC2=CC=C(C=C2S1)C#N AK102446 [0,2,0,0,0,0|1,1,0]=4 872 B13R2.13083 CC1=NC2=C(O1)C=C(N)C(Cl)=C2 AK-34685 [0,2,0,0,0,0|0,0,0]=2 873 B13R2.13083 CC1=NC2=C(S1)C=C(N)C(C)=C2 AK-80708 [0,2,0,0,0,0|0,1,0]=3 874 B13R2.13083 CC1=NC2=CC(Cl)=C(Cl)C=C2N1 AK-47655 [0,2,0,0,0,0|1,0,0]=3 875 B13R2.13083 ClC1=C(Cl)C=C2C(NC(Cl)=N2)=C1 AK-31973 [0,2,0,0,0,0|2,0,0]=4 876 B13R2.13083 NC1=C(C)C=C2SC(C)=NC2=C1 AK-80764 [0,2,0,0,0,0|0,1,0]=3 877 B13R2.13083 NC1=NC2=CC(F)=C(Cl)C=C2S1 AK455616 [0,2,0,0,0,0|1,1,0]=4 878 B13R2.13083 SC1=NC2=CC(C)=C(C)C=C2S1 AK127099 [0,2,0,0,0,0|1,1,0]=4 879 B13R2.13083 SC1=NC2=CC(Cl)=C(Cl)C=C2N1 AK115008 [0,2,0,0,0,0|2,0,0]=4 880 B11R2.20 C12=CC=CC=C1NCCO2 AK-45913 [0,0,1,1,0,0|0,0,2]=4 881 B11R2.20 C1=C2C(=NC=N1)C=CC=C2 AK-46565 [0,0,1,1,0,0|2,0,0]=4 882 B11R2.20 C1=CC=C2N=NC=CC2=C1 AK-64450 [0,0,1,1,0,0|2,0,0]=4 883 B11R2.20 C1=CC=CC2=NC=CN=C12 AK-51744 [0,0,1,1,0,0|1,0,1]=4 884 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [0,0,1,0,1,0|1,0,1]=4 885 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [0,0,1,0,1,0|1,0,1]=4 886 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [0,0,1,0,1,0|2,0,0]=4 887 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [0,0,1,0,1,0|1,0,1]=4 888 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [0,0,1,0,1,0|0,0,2]=4 889 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [0,0,1,0,1,0|0,0,1]=3 890 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [0,0,1,0,1,0|1,0,1]=4 891 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [0,0,1,0,1,0|1,0,1]=4 892 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [0,0,1,0,1,0|1,0,1]=4 893 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [0,0,1,0,1,0|1,0,0]=3 894 B9R1.6 N=C(N)C1=CC=NC=C1 AK-84875 [0,0,1,0,1,0|2,0,0]=4 895 B9R1.6 N=C(N)C1=CC=NC=C1 AK546382 [0,0,1,0,1,0|2,0,0]=4 896 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [0,0,1,0,1,0|2,0,0]=4 897 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [0,0,1,0,1,0|2,0,0]=4 898 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [0,0,1,0,1,0|1,0,0]=3 899 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [0,0,1,0,1,0|1,0,1]=4 900 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [0,0,1,0,1,0|1,0,1]=4 901 B9R1.6 O=C(O)C1=CN=CC=C1 AK-46486 [0,0,1,0,1,0|2,0,0]=4 902 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [0,0,1,0,1,0|2,0,0]=4 903 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [0,0,1,0,1,0|2,0,0]=4 904 B9R2.50 C1CC2=CC=CC=C12 AK109544 [1,0,0,0,1,0|1,0,1]=4 905 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [0,0,1,0,0,1|1,0,1]=4 906 B11R1.91 N=C(N)SCC1=CC=CC=C1 AK307386 [0,0,1,0,0,1|1,1,0]=4 907 B11R1.91 NC(OCC1=CC=CC=C1)=O AK-77001 [0,0,1,0,0,1|1,0,1]=4 908 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AK-86834 [0,0,1,0,0,1|2,0,0]=4 909 B11R1.91 O=C(O)CCC1=CC=CC=C1 AK-94756 [0,0,1,0,0,1|2,0,0]=4 910 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [0,0,1,0,0,1|2,0,0]=4 911 B11R1.91 O=C([O-])COC1=CC=CC=C1 AK-96067 [0,0,1,0,0,1|2,0,0]=4 912 B11R1.91 OC(=O)COC1=CC=CC=C1 AK-76874 [0,0,1,0,0,1|2,0,0]=4