0 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 DY800619 [0,0,0,0,0,0|2,0,1]=3 1 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 NO22136 [0,0,0,0,0,0|1,1,0]=2 2 B12R2.18 CC1=C(N)N2C=CC=CC2=N1 NO21690 [0,0,0,0,0,0|3,0,0]=3 3 B12R2.18 CC1=CC2=CC=CC=C2N1C NO10010 [0,0,0,0,0,0|2,0,0]=2 4 B12R2.18 CC1=NC2=C(C=CC=C2)N1C DY451150 [0,0,0,0,0,0|2,0,0]=2 5 B12R2.18 CN1C(=O)CC2=CC=CN=C21 DY527541 [0,0,0,0,0,0|4,0,0]=4 6 B12R2.18 CN1C(Cl)=NC2=C1C=CC=C2 DY534483 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.18 CN1C(N)=CC2=CC=CC=C21 DY106654 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 DY528933 [0,0,0,0,0,0|3,0,0]=3 9 B12R2.18 O=C1C2=CC=CC=C2CC1Br DY772371 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.18 O=C1NC2=CC=CC=C2C1=O NO11506 [0,0,0,0,0,0|3,0,0]=3 11 B12R2.18 O=C1SC2=C(C=CC=C2)C1=O DY556599 [0,0,0,0,0,0|2,1,0]=3 12 B11R2.1 BrC1=C2C=CC=CN2N=C1 NO17352 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 BrC1=CC=C2C=CC=CN12 DY674727 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 BrC1=CNC2=CC=CN=C12 NO13195 [1,0,0,0,0,0|3,0,0]=4 15 B11R2.1 BrC1=CNC2=CN=CC=C12 NO18417 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.1 BrC1=COC2=C1C=CC=C2 NO20626 [1,0,0,0,0,0|1,0,0]=2 17 B11R2.1 BrC1=COC2=CC=CN=C12 DY580287 [1,0,0,0,0,0|2,0,0]=3 18 B11R2.1 BrC1=CSC2=NC=CC=C12 NO15651 [1,0,0,0,0,0|2,1,0]=4 19 B11R2.1 CC1=CCC2=CC=CC=C12 DY106180 [1,0,0,0,0,0|1,0,0]=2 20 B11R2.1 CC1=CNC2=C1C=NC=N2 NO17951 [1,0,0,0,0,0|3,0,0]=4 21 B11R2.1 CC1=CNC2=CC=CC=C12 NO11030 [1,0,0,0,0,0|1,0,0]=2 22 B11R2.1 CC1=CNC2=NC=CC=C12 NO22368 [1,0,0,0,0,0|2,0,0]=3 23 B11R2.1 CC1=CSC2=C1N=CN=C2 DY681137 [1,0,0,0,0,0|2,1,0]=4 24 B11R2.1 CC1=NNC2=CC=CC=C21 NO17372 [1,0,0,0,0,0|2,0,0]=3 25 B11R2.1 CC1=NNC2=NC=CC=C12 NO20725 [1,0,0,0,0,0|3,0,0]=4 26 B11R2.1 CC1=NOC2=C1C=CC=C2 NO22352 [1,0,0,0,0,0|1,0,0]=2 27 B11R2.1 CN1C=CC2=CC=CC=C21 NO11026 [1,0,0,0,0,0|2,0,0]=3 28 B11R2.1 CN1C=CC2=CC=CN=C21 NO20755 [1,0,0,0,0,0|3,0,0]=4 29 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 DY546033 [1,0,0,0,0,0|1,1,0]=3 30 B11R2.1 ClC1=CSC2=NC=CC=C12 DY674919 [1,0,0,0,0,0|2,1,0]=4 31 B11R2.1 ClC1=NOC2=C1C=CC=C2 NO19970 [1,0,0,0,0,0|2,0,0]=3 32 B11R2.1 IC1=CNC2=CC=CN=C12 NO15332 [1,0,0,0,0,0|3,0,0]=4 33 B11R2.1 IC1=CNC2=CN=CC=C12 NO15083 [1,0,0,0,0,0|3,0,0]=4 34 B11R2.1 IC1=CSC2=C1C=CC=C2 NO22329 [1,0,0,0,0,0|1,1,0]=3 35 B11R2.1 NC1=C2C=CC=CC2=NS1 DY751663 [1,0,0,0,0,0|3,0,0]=4 36 B11R2.1 NC1=C2C=CC=CN2N=C1 DY519951 [1,0,0,0,0,0|3,0,0]=4 37 B11R2.1 NC1=CNC2=CC=CC=C12 DY585665 [1,0,0,0,0,0|2,0,0]=3 38 B11R2.1 NC1=CNC2=CC=CC=C12 DY585666 [1,0,0,0,0,0|2,0,0]=3 39 B11R2.1 NC1=CNC2=NC=CC=C12 DY535557 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.1 NC1=CSC2=C1C=CC=C2 NO13998 [1,0,0,0,0,0|1,1,0]=3 41 B11R2.1 NC1=NCC2=CC=CC=C21 DY459738 [1,0,0,0,0,0|3,0,0]=4 42 B11R2.1 NC1=NNC2=CC=CC=C21 NO20708 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.1 NC1=NOC2=C1C=CC=C2 NO20240 [1,0,0,0,0,0|2,0,0]=3 44 B11R2.1 NC1=NOC2=CC=CN=C21 NO12630 [1,0,0,0,0,0|3,0,0]=4 45 B11R2.1 NC1=NOC2=CN=CC=C21 DY507662 [1,0,0,0,0,0|3,0,0]=4 46 B11R2.1 NC1=NSC2=C1C=CC=C2 NO13975 [1,0,0,0,0,0|2,1,0]=4 47 B11R2.1 NN1C=CC2=CC=CC=C21 NO19942 [1,0,0,0,0,0|3,0,0]=4 48 B11R2.1 O=C1CCC2=CC=CC=C12 NO18668 [1,0,0,0,0,0|2,0,1]=4 49 B11R2.1 O=C1COC2=NC=CC=C12 DY441318 [1,0,0,0,0,0|2,0,1]=4 50 B11R2.1 O=C1CSC2=C1C=CC=C2 NO20606 [1,0,0,0,0,0|1,1,1]=4 51 B11R2.1 O=C1N=NC2=CC=CC=C12 DY762524 [1,0,0,0,0,0|3,0,0]=4 52 B11R2.1 O=C1NCC2=CC=CC=C12 NO11515 [1,0,0,0,0,0|3,0,0]=4 53 B11R2.1 O=C1NSC2=C1C=CC=C2 NO14057 [1,0,0,0,0,0|2,1,0]=4 54 B11R2.1 O=C1OCC2=CC=CC=C12 NO11853 [1,0,0,0,0,0|3,0,0]=4 55 B11R2.1 OC1=NOC2=NC=CC=C12 DY683137 [1,0,0,0,0,0|3,0,0]=4 56 B11R2.10 BrC1=CC2=CC=CC=C2C1 NO21490 [1,0,0,0,0,0|2,0,0]=3 57 B11R2.10 BrC1=CN2C=CC=CC2=N1 NO12525 [1,0,0,0,0,0|3,0,0]=4 58 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 NO21331 [1,0,0,0,0,0|3,0,0]=4 59 B11R2.10 BrC1=NC2=C(C=CC=C2)S1 NO14031 [1,0,0,0,0,0|2,1,0]=4 60 B11R2.10 CC1=CC2=C(C=CN=C2)N1 NO15018 [1,0,0,0,0,0|2,0,0]=3 61 B11R2.10 CC1=CC2=C(C=CN=C2)O1 DY673188 [1,0,0,0,0,0|1,0,0]=2 62 B11R2.10 CC1=CC2=CC=CC=C2N1 NO18563 [1,0,0,0,0,0|1,0,0]=2 63 B11R2.10 CC1=CC2=CC=CN=C2N1 NO19733 [1,0,0,0,0,0|2,0,0]=3 64 B11R2.10 CC1=CC2=NC=CC=C2N1 NO15017 [1,0,0,0,0,0|2,0,0]=3 65 B11R2.10 CC1=CN2C=CC=CC2=N1 NO21691 [1,0,0,0,0,0|2,0,0]=3 66 B11R2.10 CC1=NC2=C(C=CC=C2)N1 NO15288 [1,0,0,0,0,0|2,0,0]=3 67 B11R2.10 CC1=NC2=C(C=CC=C2)S1 NO21687 [1,0,0,0,0,0|1,1,0]=3 68 B11R2.10 CC1=NC2=NC=CC=C2N1 NO21659 [1,0,0,0,0,0|3,0,0]=4 69 B11R2.10 CC1=NC2=NC=CC=C2O1 DY445727 [1,0,0,0,0,0|2,0,0]=3 70 B11R2.10 CC1=NN2C=CC=NC2=C1 DY571905 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.10 C[C@@H]1CC2=CC=CC=C2N1 DY541863 [1,0,0,0,0,0|1,0,2]=4 72 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 NO21427 [1,0,0,0,0,0|3,0,0]=4 73 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 NO20002 [1,0,0,0,0,0|2,1,0]=4 74 B11R2.10 ClC1=NN2C=CC=CC2=C1 NO17263 [1,0,0,0,0,0|3,0,0]=4 75 B11R2.10 IC1=CC2=CC=CN=C2N1 NO15616 [1,0,0,0,0,0|3,0,0]=4 76 B11R2.10 NC1=NC2=C(C=CC=C2)N1 NO16315 [1,0,0,0,0,0|3,0,0]=4 77 B11R2.10 NC1=NC2=C(C=CN=C2)O1 NO16592 [1,0,0,0,0,0|3,0,0]=4 78 B11R2.10 NC1=NN2C=CC=CC2=C1 DY672366 [1,0,0,0,0,0|3,0,0]=4 79 B11R2.10 O=C1CC2=C(C=CC=C2)O1 DY20944 [1,0,0,0,0,0|1,0,1]=3 80 B11R2.10 O=C1CC2=CC=CC=C2C1 NO16080 [1,0,0,0,0,0|2,0,1]=4 81 B11R2.10 O=C1CC2=CC=CC=C2N1 NO15184 [1,0,0,0,0,0|2,0,1]=4 82 B11R2.10 O=C1NC2=C(C=CC=C2)O1 NO15190 [1,0,0,0,0,0|2,0,0]=3 83 B11R2.10 O=C1NC2=NC=CC=C2O1 NO18902 [1,0,0,0,0,0|3,0,0]=4 84 B11R2.10 O=C1OC2=C(C=CC=C2)O1 NO10973 [1,0,0,0,0,0|2,0,0]=3 85 B11R2.10 OC1=CC2=C(C=CC=C2)O1 DY751579 [1,0,0,0,0,0|1,0,0]=2 86 B11R2.10 OC1=CC2=CC=CC=C2N1 DY726793 [1,0,0,0,0,0|2,0,0]=3 87 B11R2.10 OC1=CC2=NC=CC=C2N1 DY670456 [1,0,0,0,0,0|3,0,0]=4 88 B11R2.10 OC1=CN2C=CC=CC2=N1 NO15598 [1,0,0,0,0,0|3,0,0]=4 89 B11R2.10 OC1=NC2=C(C=CC=C2)N1 NO20242 [1,0,0,0,0,0|3,0,0]=4 90 B11R2.10 S=C1NC2=C(C=CN=C2)O1 DY511371 [1,0,0,0,0,0|3,0,0]=4 91 B11R2.10 S=C1NC2=NC=CC=C2O1 DY558729 [1,0,0,0,0,0|3,0,0]=4 92 B11R2.10 SC1=NC2=C(C=CC=C2)N1 DY20678 [1,0,0,0,0,0|3,0,0]=4 93 B11R2.10 SC1=NC2=C(C=CC=C2)O1 DY20463 [1,0,0,0,0,0|2,0,0]=3 94 B11R2.10 SC1=NC2=C(C=CC=C2)S1 DY752305 [1,0,0,0,0,0|2,1,0]=4 95 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 DY510753 [0,1,0,0,0,0|0,0,1]=2 96 B13R2.45 CCC1CC2=CC=CC=C2C1=O DY744733 [0,1,0,0,0,0|2,0,1]=4 97 B13R2.45 CN1C(CBr)=NC2=C1C=CC=C2 NO13411 [0,1,0,0,0,0|2,0,0]=3 98 B13R2.45 CN1C(CN)=NC2=C1C=CC=C2 DY558909 [0,1,0,0,0,0|2,0,0]=3 99 B13R2.45 CNC1=CC2=CC=CC=C2N1C DY731161 [0,1,0,0,0,0|2,0,0]=3 100 B13R2.45 C[N+]1=C(CCl)SC2=C1C=CC=C2 DY751915 [0,1,0,0,0,0|1,1,0]=3 101 B13R2.45 Cc1c(CO)oc2ccccc12 DY560265 [0,1,0,0,0,0|0,0,0]=1 102 B13R2.45 N#CC1=C(N)C2=C(C=CC=C2)O1 DY563865 [0,1,0,0,0,0|1,0,1]=3 103 B13R2.45 O=CC1=C(Br)C2=C(C=CC=C2)S1 DY449848 [0,1,0,0,0,0|1,1,1]=4 104 B13R2.45 O=CC1=C(Br)C2=CC=CC=C2N1 DY578985 [0,1,0,0,0,0|2,0,1]=4 105 B13R2.135 CC1=C(C#N)C2=CC=CC=C2N1 DY731425 [0,1,0,0,0,0|1,0,1]=3 106 B13R2.135 CC1=C(C=O)C2=CC=CC=C2N1 NO10068 [0,1,0,0,0,0|1,0,1]=3 107 B13R2.135 CC1=C(C=O)C2=CC=CN=C2N1 NO14361 [0,1,0,0,0,0|2,0,1]=4 108 B13R2.135 CC1=C(CN)C2=CC=CC=C2N1 DY728281 [0,1,0,0,0,0|1,0,0]=2 109 B13R2.135 CCN1C(=N)SC2=C1C=CC=C2 DY537909 [0,1,0,0,0,0|2,1,0]=4 110 B13R2.135 CCN1C(=S)NC2=C1C=CC=C2 DY552903 [0,1,0,0,0,0|3,0,0]=4 111 B13R2.135 CN1C=C2C=CC=CC2=C1C#N DY727963 [0,1,0,0,0,0|2,0,1]=4 112 B13R2.135 CN1N=C2C=CC=CC2=C1CO DY561867 [0,1,0,0,0,0|2,0,0]=3 113 B13R2.359 CC1=Nc2ccccc2C1(C)C DY445122 [0,1,0,0,0,0|1,0,1]=3 114 B13R2.3028 CC1=C(Br)NC2=CC=C(Cl)C=C21 DY727333 [0,1,0,0,0,0|2,0,0]=3 115 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 NO10988 [0,1,0,0,0,0|3,0,0]=4 116 B13R2.3028 CC1=CC=C2NC(Cl)=C(C)C2=C1 DY727423 [0,1,0,0,0,0|2,0,0]=3 117 B13R2.3028 CC1=NC2=CC=C(Cl)N=C2N1C DY677742 [0,1,0,0,0,0|3,0,0]=4 118 B13R2.3028 CC1C(=O)NC2=CC=C(Br)C=C21 NO14604 [0,1,0,0,0,0|2,0,1]=4 119 B13R2.3028 CC1CC2=CC=C(Cl)C=C2C1=O DY549909 [0,1,0,0,0,0|2,0,1]=4 120 B13R2.3028 CN1C(=O)NC2=C1C=C(Br)C=C2 DY547539 [0,1,0,0,0,0|3,0,0]=4 121 B13R2.3028 CN1C(=O)OC2=C1C=C(N)C=C2 DY606357 [0,1,0,0,0,0|2,0,0]=3 122 B13R2.3028 CN1C(Cl)=NC2=C1C=C(Br)C=C2 DY749977 [0,1,0,0,0,0|3,0,0]=4 123 B13R2.3028 CN1CC2=CC=C(N)C=C2C1=O DY446650 [0,1,0,0,0,0|3,0,0]=4 124 B13R2.3028 CN1N=C2C=CC(Br)=CC2=C1Cl DY513861 [0,1,0,0,0,0|3,0,0]=4 125 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O NO22039 [0,1,0,0,0,0|3,0,0]=4 126 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O NO10615 [0,1,0,0,0,0|3,0,0]=4 127 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 DY538653 [0,1,0,0,0,0|3,0,0]=4 128 B13R2.3085 CN1C(=O)C(N)C2=CC=CC=C21 DY629948 [0,1,0,0,0,0|3,0,0]=4 129 B13R2.3085 CN1C2=C(C=CC=C2)[N+](C)=C1Cl DY822748 [0,1,0,0,0,0|3,0,0]=4 130 B13R2.4825 CC1=C2C=CC=C(Br)C2=NN1C DY101935 [0,1,0,0,0,0|2,0,0]=3 131 B13R2.4825 CC1=NN2C(Cl)=CC=NC2=C1C DY556473 [0,1,0,0,0,0|3,0,0]=4 132 B13R2.4825 CC1C(=O)NC2=C(F)C=CC=C21 DY520137 [0,1,0,0,0,0|2,0,1]=4 133 B13R2.4825 CN1C(=O)CC2=C(Br)C=CC=C21 DY583929 [0,1,0,0,0,0|3,0,0]=4 134 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O NO13925 [0,1,0,0,0,0|3,0,0]=4 135 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O NO20590 [0,1,0,0,0,0|3,0,0]=4 136 B13R2.4825 O=C1NC2=C(F)C=CC=C2C1=O NO10646 [0,1,0,0,0,0|3,0,0]=4 137 B13R2.4856 CC1=C(C)C2=C(N=CN=C2Cl)S1 DY584520 [0,1,0,0,0,0|2,1,0]=4 138 B13R2.4856 CC1=C(N)N2C(Br)=CC=CC2=N1 DY760994 [0,1,0,0,0,0|3,0,0]=4 139 B13R2.4856 CC1=C(N)N2C(Cl)=CC=CC2=N1 DY677766 [0,1,0,0,0,0|3,0,0]=4 140 B13R2.4856 CC1=CC=CC2=C1N(C)C(N)=N2 DY750025 [0,1,0,0,0,0|3,0,0]=4 141 B13R2.4856 CN1CC2=CC=CC(Cl)=C2C1=O DY630630 [0,1,0,0,0,0|3,0,0]=4 142 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O NO13924 [0,1,0,0,0,0|3,0,0]=4 143 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O NO22789 [0,1,0,0,0,0|3,0,0]=4 144 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O NO22839 [0,1,0,0,0,0|3,0,0]=4 145 B13R2.4856 O=C1NC2=CC=CC(I)=C2C1=O DY538959 [0,1,0,0,0,0|3,0,0]=4 146 B13R2.5190 CC1=CC2=CC(N)=CC=C2N1C DY602226 [0,1,0,0,0,0|2,0,0]=3 147 B13R2.5190 CC1C(=O)NC2=CC(F)=CC=C21 DY520155 [0,1,0,0,0,0|2,0,1]=4 148 B13R2.5190 CN1C(=O)CC2=CC(O)=CC=C21 DY562935 [0,1,0,0,0,0|3,0,0]=4 149 B13R2.5190 CN1CC2=CC(Br)=CC=C2C1=O NO12956 [0,1,0,0,0,0|3,0,0]=4 150 B13R2.5190 CN1CC2=CC(Cl)=CC=C2C1=O DY630364 [0,1,0,0,0,0|3,0,0]=4 151 B13R2.5190 NC1=CC=C2C(=O)C(=O)NC2=C1 DY630509 [0,1,0,0,0,0|3,0,0]=4 152 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O NO10616 [0,1,0,0,0,0|3,0,0]=4 153 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O NO10704 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 NO19083 [0,0,1,0,0,0|1,0,1]=3 155 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 DY713899 [0,0,1,0,0,0|2,0,1]=4 156 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 NO14544 [0,0,1,0,0,0|1,0,1]=3 157 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 DY789267 [0,0,1,0,0,0|2,0,1]=4 158 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 NO10890 [0,0,1,0,0,0|1,0,1]=3 159 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 DY620130 [0,0,1,0,0,0|1,0,2]=4 160 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 NO14083 [0,0,1,0,0,0|2,0,1]=4 161 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 NO11192 [0,0,1,0,0,0|2,0,1]=4 162 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 NO15279 [0,0,1,0,0,0|2,0,1]=4 163 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 NO10862 [0,0,1,0,0,0|2,0,1]=4 164 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 NO10861 [0,0,1,0,0,0|2,0,1]=4 165 B11R1.40 CCC(=O)OC1=CC=CC=C1 DY584283 [0,0,1,0,0,0|1,0,1]=3 166 B11R1.40 CNC(=O)OC1=CC=CC=C1 DY584385 [0,0,1,0,0,0|2,0,0]=3 167 B11R1.40 CNC(=S)NC1=CC=CC=C1 DY793797 [0,0,1,0,0,0|3,0,0]=4 168 B11R1.41 C#CC1=C(OCC)C=CC=C1 DY789147 [0,0,1,0,0,0|0,0,3]=4 169 B11R1.41 CNCC1=C(OC)C=CC=C1 DY584503 [0,0,1,0,0,0|3,0,0]=4 170 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 NO15813 [0,0,1,0,0,0|2,0,1]=4 171 B11R1.222 CCC(C)C1=C(N)C=CC=C1 NO21765 [0,0,1,0,0,0|1,0,2]=4 172 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 NO20442 [0,0,1,0,0,0|3,0,0]=4 173 B11R1.222 COC(=N)C1=C(O)N=CC=C1 DY662303 [0,0,1,0,0,0|3,0,0]=4 174 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 DY20192 [0,0,1,0,0,0|3,0,0]=4 175 B11R1.222 COC(=O)C1=C(F)C=CC=C1 NO11605 [0,0,1,0,0,0|3,0,0]=4 176 B11R1.222 COC(=O)C1=C(I)C=CC=C1 NO15277 [0,0,1,0,0,0|3,0,0]=4 177 B11R1.222 COC(=O)C1=C(O)C=NC=C1 NO11627 [0,0,1,0,0,0|3,0,0]=4 178 B11R1.222 COC(=O)C1=NC=CC=C1O NO21936 [0,0,1,0,0,0|3,0,0]=4 179 B11R1.222 C\C(=N/O)C1=C(O)C=CC=C1 DY745441 [0,0,1,0,0,0|2,0,0]=3 180 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 NO11942 [0,0,1,0,0,0|3,0,0]=4 181 B13R2.32 BrC1=C(Br)C2=CC=CC=C2C=N1 NO14781 [0,0,0,0,0,1|3,0,0]=4 182 B13R2.32 CC1=C(C)C2=CC=CC=C2CC1 DY558111 [0,0,0,0,0,1|1,0,0]=2 183 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 DY689294 [0,0,0,0,0,1|2,0,0]=3 184 B13R2.32 CC1=C(N)C2=CC=CC=C2C=C1 DY447699 [0,0,0,0,0,1|2,0,0]=3 185 B13R2.32 CC1=C(N)C=CC2=CC=CC=C21 DY768787 [0,0,0,0,0,1|2,0,0]=3 186 B13R2.32 CC1=C(O)C2=CC=CC=C2C=C1 NO11396 [0,0,0,0,0,1|2,0,0]=3 187 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br NO16280 [0,0,0,0,0,1|3,0,0]=4 188 B13R2.32 CC1=CC=C2C=CC=NC2=C1Br DY691018 [0,0,0,0,0,1|3,0,0]=4 189 B13R2.32 CC1=CC=C2C=CC=NC2=C1C DY690535 [0,0,0,0,0,1|2,0,0]=3 190 B13R2.32 CN1C(=O)N=CC2=CC=CC=C21 DY781468 [0,0,0,0,0,1|3,0,0]=4 191 B13R2.32 CN1C=CC2=CC=CC=C2C1=O NO16983 [0,0,0,0,0,1|3,0,0]=4 192 B13R2.32 ClC1=C(Br)C2=CC=CC=C2C=C1 DY764063 [0,0,0,0,0,1|3,0,0]=4 193 B13R2.32 FC1=C(I)C2=CC=CC=C2N=C1 DY688830 [0,0,0,0,0,1|3,0,0]=4 194 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 NO18266 [0,0,0,0,0,1|3,0,0]=4 195 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 NO12478 [0,0,0,0,0,1|3,0,0]=4 196 B13R2.32 NC1=C(I)C=CC2=CC=CC=C21 DY768955 [0,0,0,0,0,1|3,0,0]=4 197 B13R2.32 NC1=C(O)C=CC2=CC=CC=C21 NO20594 [0,0,0,0,0,1|3,0,0]=4 198 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 NO11263 [0,0,0,0,0,1|3,0,0]=4 199 B13R2.328 BrC1=CC(I)=CC2=CC=CC=C12 DY431929 [0,0,0,0,0,1|3,0,0]=4 200 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=N1 NO12194 [0,0,0,0,0,1|3,0,0]=4 201 B13R2.328 CC1=C2N=CC=CC2=CC(Br)=C1 DY690129 [0,0,0,0,0,1|3,0,0]=4 202 B13R2.328 CC1=CC(Br)=C2N=CC=CC2=C1 DY446981 [0,0,0,0,0,1|3,0,0]=4 203 B13R2.328 CC1=CC(Br)=NC2=CC=CC=C12 DY440080 [0,0,0,0,0,1|2,0,0]=3 204 B13R2.328 CC1=CC(N)=NC2=CC=CC=C12 DY689517 [0,0,0,0,0,1|2,0,0]=3 205 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 NO10067 [0,0,0,0,0,1|2,0,0]=3 206 B13R2.328 CC1=CC2=CC=CC=C2C(Br)=C1 NO17170 [0,0,0,0,0,1|2,0,0]=3 207 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 DY33405 [0,0,0,0,0,1|2,0,0]=3 208 B13R2.328 CC1=NC(Cl)=NC2=CC=CC=C21 NO21451 [0,0,0,0,0,1|2,0,0]=3 209 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)O1 NO21531 [0,0,0,0,0,1|2,0,0]=3 210 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 NO22654 [0,0,0,0,0,1|2,0,0]=3 211 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=N1 NO12359 [0,0,0,0,0,1|2,0,0]=3 212 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 DY562977 [0,0,0,0,0,1|2,0,0]=3 213 B13R2.328 CC1=NC2=CC=CC=C2C(O)=N1 DY532125 [0,0,0,0,0,1|2,0,0]=3 214 B13R2.328 CC1=NC2=CC=CC=C2N(C)C1 DY783814 [0,0,0,0,0,1|2,0,0]=3 215 B13R2.328 ClC1=CC(Cl)=NC2=CC=CC=C12 NO10935 [0,0,0,0,0,1|3,0,0]=4 216 B13R2.328 ClC1=NC2=CC=CC=C2C(Cl)=N1 NO19961 [0,0,0,0,0,1|3,0,0]=4 217 B13R2.328 FC1=NC2=CC=CC=C2C(F)=N1 DY560805 [0,0,0,0,0,1|3,0,0]=4 218 B13R2.328 NC1=CC(=O)NC2=CC=CC=C12 NO22591 [0,0,0,0,0,1|3,0,0]=4 219 B13R2.328 NC1=CC(Cl)=NC2=CC=CC=C12 NO22546 [0,0,0,0,0,1|3,0,0]=4 220 B13R2.328 NC1=CC(O)=CC2=CC=CC=C12 DY768431 [0,0,0,0,0,1|3,0,0]=4 221 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=C1 NO17133 [0,0,0,0,0,1|3,0,0]=4 222 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=N1 DY517305 [0,0,0,0,0,1|3,0,0]=4 223 B13R2.328 NC1=CC2=CC=CC=C2C(O)=C1 DY579147 [0,0,0,0,0,1|3,0,0]=4 224 B13R2.328 NC1=NC(Cl)=CC2=CC=CC=C21 DY570501 [0,0,0,0,0,1|3,0,0]=4 225 B13R2.328 NC1=NC2=CC=CC=C2C(Cl)=C1 NO21246 [0,0,0,0,0,1|3,0,0]=4 226 B13R2.328 O=C1C=C(Cl)NC2=CC=CC=C12 DY688323 [0,0,0,0,0,1|3,0,0]=4 227 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 DY33305 [0,0,0,0,0,1|3,0,0]=4 228 B13R2.328 O=C1CC2=CC=CC=C2C(=O)O1 DY568083 [0,0,0,0,0,1|3,0,0]=4 229 B13R2.328 O=C1NC(=O)C2=CC=CC=C2N1 NO10996 [0,0,0,0,0,1|3,0,0]=4 230 B13R2.328 O=C1NC(Cl)=NC2=CC=CC=C12 NO15421 [0,0,0,0,0,1|3,0,0]=4 231 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 NO11507 [0,0,0,0,0,1|3,0,0]=4 232 B13R2.328 OC1=CC(Cl)=NC2=CC=CC=C12 NO21445 [0,0,0,0,0,1|3,0,0]=4 233 B13R2.328 [O-]C1=CC(O)=NC2=CC=CC=C12 DY692121 [0,0,0,0,0,1|3,0,0]=4 234 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br NO11242 [0,0,0,0,0,1|3,0,0]=4 235 B13R2.369 CC1=C(Br)C=C2C=NC=CC2=C1 DY514017 [0,0,0,0,0,1|3,0,0]=4 236 B13R2.369 CC1=C(N)C=C2N=CC=CC2=C1 DY690503 [0,0,0,0,0,1|3,0,0]=4 237 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl NO15838 [0,0,0,0,0,1|3,0,0]=4 238 B13R2.369 ClC1=NC2=CC=CC=C2N=C1Cl DY434068 [0,0,0,0,0,1|3,0,0]=4 239 B13R2.369 FC1=CC2=CC=CC=C2C=C1Br DY764663 [0,0,0,0,0,1|3,0,0]=4 240 B13R2.369 FC1=CC2=CC=CC=C2C=C1F DY764669 [0,0,0,0,0,1|3,0,0]=4 241 B13R2.369 NC1=CC2=CC=CC=C2C=C1Cl DY763148 [0,0,0,0,0,1|3,0,0]=4 242 B13R2.369 NC1=CC2=CC=CC=C2N=C1Br DY688191 [0,0,0,0,0,1|3,0,0]=4 243 B13R2.369 O=C1OC2=CC=CC=C2C=C1O DY581331 [0,0,0,0,0,1|2,0,0]=3 244 B13R2.369 OC1=NC2=CC=CC=C2N=C1F DY783850 [0,0,0,0,0,1|3,0,0]=4 245 B10R1.15 CCC(C)C1=CC=CC=C1 NO11947 [1,0,1,0,0,0|0,0,2]=4 246 B10R1.15 CN(C=O)C1=CC=CC=C1 NO11793 [1,0,1,0,0,0|1,0,1]=4 247 B10R1.15 C\C(=C/Br)C1=CC=NC=C1 DY111870 [1,0,1,0,0,0|2,0,0]=4 248 B10R1.18 BrC(Br)=CC1=CC=CC=C1 NO16193 [1,0,1,0,0,0|2,0,0]=4 249 B10R1.18 CC(C)NC1=CC=CC=C1 NO11787 [1,0,1,0,0,0|1,0,1]=4 250 B10R1.18 O=C(Cl)OC1=CC=CC=C1 NO18823 [1,0,1,0,0,0|2,0,0]=4 251 B10R1.4 CCOC1=C(Br)C=CC=C1 DY20149 [1,0,1,0,0,0|1,0,1]=4 252 B10R1.4 CCOC1=C(C)C=CN=C1 DY711121 [1,0,1,0,0,0|1,0,1]=4 253 B10R1.4 CCOC1=C(F)C=CC=C1 DY452620 [1,0,1,0,0,0|1,0,1]=4 254 B10R1.4 O\N=C\C1=CC=CC=C1O DY581391 [1,0,1,0,0,0|2,0,0]=4 255 B10R1.20 C#CC1=C(OC)C=CC=C1 NO21618 [1,0,1,0,0,0|0,0,2]=4 256 B10R1.20 CCC1=C(C=O)C=CC=C1 DY20141 [1,0,1,0,0,0|1,0,1]=4 257 B10R1.20 CNC1=C(C=O)C=CC=C1 NO17054 [1,0,1,0,0,0|2,0,0]=4 258 B10R1.20 CNC1=C(OC)C=CC=C1 DY790233 [1,0,1,0,0,0|1,0,0]=3 259 B10R1.20 COC1=C(C=O)C=CC=N1 NO20317 [1,0,1,0,0,0|2,0,0]=4 260 B10R1.20 COC1=C(CCl)C=CC=C1 DY20247 [1,0,1,0,0,0|1,0,1]=4 261 B10R1.20 COC1=C(CN)C=CC=C1 NO15681 [1,0,1,0,0,0|1,0,1]=4 262 B10R1.20 COC1=C(NN)C=CC=C1 NO19579 [1,0,1,0,0,0|2,0,0]=4 263 B10R1.20 COC1=C(OC)C=CC=C1 NO12067 [1,0,1,0,0,0|1,0,0]=3 264 B10R1.20 COC1=CC=CN=C1OC NO14783 [1,0,1,0,0,0|2,0,0]=4 265 B10R1.20 [C-]#[N+]C1=C(OC)C=CC=C1 DY745507 [1,0,1,0,0,0|1,0,1]=4 266 B10R1.16 CC1=CC=C(\C=C\C=O)O1 NO17008 [1,0,1,0,0,0|1,0,0]=3 267 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 NO18866 [1,0,1,0,0,0|2,0,0]=4 268 B10R1.61 CC(=O)C1=C(C)C=CC=C1 NO19710 [1,0,1,0,0,0|2,0,0]=4 269 B10R1.61 CC(=O)C1=C(F)C=CC=C1 NO15490 [1,0,1,0,0,0|2,0,0]=4 270 B10R1.61 CC(=O)C1=C(N)C=CC=C1 NO19948 [1,0,1,0,0,0|2,0,0]=4 271 B10R1.61 CC(=O)C1=C(O)C=CC=C1 DY790197 [1,0,1,0,0,0|1,0,0]=3 272 B10R1.61 CC(=O)C1=C(O)C=CC=C1 NO15026 [1,0,1,0,0,0|1,0,0]=3 273 B10R1.61 CC(=O)C1=NC=CC=C1O NO14450 [1,0,1,0,0,0|2,0,0]=4 274 B10R1.61 CC(C)C1=C(Br)C=CC=C1 NO19988 [1,0,1,0,0,0|1,0,1]=4 275 B10R1.61 CN(C)C1=C(Br)C=CC=C1 DY20183 [1,0,1,0,0,0|2,0,0]=4 276 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 DY20288 [1,0,1,0,0,0|2,0,0]=4 277 B10R1.61 CN(C)C1=C(F)C=CC=C1 DY20285 [1,0,1,0,0,0|2,0,0]=4 278 B10R1.61 CN(C)C1=C(O)C=CC=C1 NO14782 [1,0,1,0,0,0|1,0,0]=3 279 B10R1.61 CN(C)C1=CC=CC=C1N NO14204 [1,0,1,0,0,0|2,0,0]=4 280 B10R1.61 NC(=O)C1=C(O)C=CC=C1 NO11941 [1,0,1,0,0,0|2,0,0]=4 281 B10R1.61 O=C(O)C1=CC=CC=C1O DY576081 [1,0,1,0,0,0|2,0,0]=4 282 B10R1.61 O=C([O-])C1=CC=CC=C1O DY560055 [1,0,1,0,0,0|2,0,0]=4 283 B10R1.61 O=C([O-])C1=CC=CC=C1O DY822576 [1,0,1,0,0,0|2,0,0]=4 284 B10R2.7 C1=CC2=C(C=C1)OC=N2 NO10994 [2,0,0,0,0,0|1,0,0]=3 285 B10R2.7 C1=CC2=C(C=C1)OCC2 NO20929 [2,0,0,0,0,0|0,0,2]=4 286 B10R2.7 C1=CC2=C(C=C1)SC=C2 NO16362 [2,0,0,0,0,0|0,1,0]=3 287 B10R2.7 C1=CC2=C(C=C1)SC=N2 NO10992 [2,0,0,0,0,0|1,1,0]=4 288 B10R2.7 C1=CC2=C(C=CN2)C=N1 NO20237 [2,0,0,0,0,0|2,0,0]=4 289 B10R2.7 C1=CC2=C(C=CO2)C=N1 DY545679 [2,0,0,0,0,0|1,0,0]=3 290 B10R2.7 C1=CC2=C(C=CS2)C=N1 DY441330 [2,0,0,0,0,0|1,1,0]=4 291 B10R2.7 C1=CC2=CC=NC=C2N1 NO20238 [2,0,0,0,0,0|2,0,0]=4 292 B10R2.7 C1=CC2=CC=NC=C2S1 NO13198 [2,0,0,0,0,0|1,1,0]=4 293 B10R2.7 C1=CC2=CC=NN2C=C1 DY106678 [2,0,0,0,0,0|2,0,0]=4 294 B10R2.7 C1=CC2=CNN=C2C=C1 DY761306 [2,0,0,0,0,0|2,0,0]=4 295 B10R2.7 C1=CC2=NC=CN2C=C1 NO18927 [2,0,0,0,0,0|2,0,0]=4 296 B10R2.7 C1=CC=C2CC=CC2=C1 DY20914 [2,0,0,0,0,0|1,0,0]=3 297 B10R2.7 C1=CC=C2NC=CC2=C1 NO11496 [2,0,0,0,0,0|1,0,0]=3 298 B10R2.7 C1=CC=C2NN=CC2=C1 NO11488 [2,0,0,0,0,0|2,0,0]=4 299 B10R2.7 C1=CC=C2OC=CC2=C1 NO11169 [2,0,0,0,0,0|0,0,0]=2 300 B10R2.7 C1=CN=C2C=CNC2=C1 NO20236 [2,0,0,0,0,0|2,0,0]=4 301 B10R2.7 C1=CN=C2NC=CC2=C1 NO10447 [2,0,0,0,0,0|2,0,0]=4 302 B10R2.7 C1=CN=C2SC=CC2=C1 NO14590 [2,0,0,0,0,0|1,1,0]=4 303 B10R2.7 [C-]1=CSC2=CC=CC=C12 DY752635 [2,0,0,0,0,0|0,1,1]=4 304 B12R1.20 CC(C(=O)O)C1=CC=C(I)C=C1 DY550107 [0,1,1,0,0,0|1,0,1]=4 305 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 DY461262 [0,1,1,0,0,0|1,0,1]=4 306 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 NO15974 [0,1,1,0,0,0|2,0,0]=4 307 B12R1.34 COC(=O)C(C)c1ccccc1 DY459984 [0,1,1,0,0,0|0,0,2]=4 308 B12R1.124 CC(C(=O)O)C1=C(Cl)C=CC=C1 NO21673 [0,1,1,0,0,0|1,0,1]=4 309 B12R1.124 O=C(O)C(=O)C1=C(Br)C=CC=C1 NO16464 [0,1,1,0,0,0|2,0,0]=4 310 B12R1.225 CC(C(=O)O)C1=CC(Br)=CC=C1 NO14817 [0,1,1,0,0,0|1,0,1]=4 311 B12R1.225 CC1=CC=CC([C@H](C)C(=O)O)=C1 DY586092 [0,1,1,0,0,0|1,0,1]=4 312 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 NO10020 [0,1,1,0,0,0|1,0,1]=4 313 B12R1.478 CC[C@H](C(=O)O)C1=CC=CC=C1 NO20312 [0,1,1,0,0,0|1,0,1]=4 314 B12R1.478 CO[C@@H](C(=O)O)c1ccccc1 DY428059 [0,1,1,0,0,0|1,0,1]=4 315 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 DY560061 [0,1,1,0,0,0|1,0,1]=4 316 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 NO15837 [0,1,1,0,0,0|1,0,1]=4 317 B12R1.49 C\C(C=O)=C/C1=CC=C(Br)C=C1 DY788637 [0,1,1,0,0,0|2,0,0]=4 318 B12R1.112 CCOC1=C(C=O)C=C(F)C=C1 DY448552 [0,1,1,0,0,0|1,0,1]=4 319 B12R1.121 COC1=C(OCC=O)C=CC=C1 DY112452 [0,1,1,0,0,0|2,0,0]=4 320 B12R1.121 COC1=C(OCCN)C=CC=C1 NO21224 [0,1,1,0,0,0|1,0,1]=4 321 B12R1.169 CCOC1=C(CCN)C=CC=C1 DY795099 [0,1,1,0,0,0|0,0,2]=4 322 B12R1.169 CCOC1=C(OCC)C=CC=C1 DY792861 [0,1,1,0,0,0|0,0,2]=4 323 B12R1.283 CCOC1=C(C(C)=O)C=CC=C1 DY791631 [0,1,1,0,0,0|0,0,1]=3 324 B12R1.283 CCOC1=C(C(C)N)C=CC=C1 DY605092 [0,1,1,0,0,0|0,0,2]=4 325 B12R1.1112 CCOC1=C(C=O)C=CC=C1Br DY103354 [0,1,1,0,0,0|1,0,1]=4 326 B12R1.24 COC(=O)C1=C(O)C(Br)=CC=C1 NO17379 [0,1,1,0,0,0|2,0,0]=4 327 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 NO12991 [0,1,1,0,0,0|2,0,0]=4 328 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 NO11656 [0,1,1,0,0,0|2,0,0]=4 329 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 NO20958 [0,1,1,0,0,0|2,0,0]=4 330 B12R1.354 COC(=O)C1=CC(I)=CC=C1O DY584336 [0,1,1,0,0,0|2,0,0]=4 331 B12R1.1703 COC(=O)C1=C(O)C=C(I)C=C1 DY533553 [0,1,1,0,0,0|2,0,0]=4 332 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 NO21027 [0,1,1,0,0,0|2,0,0]=4 333 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 NO11594 [0,1,1,0,0,0|2,0,0]=4 334 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O NO11643 [0,1,1,0,0,0|2,0,0]=4 335 B12R1.1703 C\C(=N/O)C1=C(O)C=C(Br)C=C1 DY746713 [0,1,1,0,0,0|2,0,0]=4 336 B12R1.3441 COC(=O)C1=C(N)C=CC=C1O NO15549 [0,1,1,0,0,0|2,0,0]=4 337 B12R1.110 CC1=C(C)OC(\C=C\C(=O)O)=C1 DY585458 [0,1,1,0,0,0|1,0,0]=3 338 B12R1.110 CC1=C(C)OC(\C=C\C(=O)O)=C1 DY759974 [0,1,1,0,0,0|1,0,0]=3 339 B12R2.1 BrCC1=CSC2=C1C=CC=C2 NO17544 [1,1,0,0,0,0|0,1,0]=3 340 B12R2.1 CCC1=CNC2=NC=CC=C12 DY674985 [1,1,0,0,0,0|2,0,0]=4 341 B12R2.1 CCC1=NNC2=CC=CC=C21 DY762674 [1,1,0,0,0,0|2,0,0]=4 342 B12R2.1 CON1C=CC2=CC=CC=C21 DY559761 [1,1,0,0,0,0|2,0,0]=4 343 B12R2.1 CSC1=NNC2=CC=CC=C21 DY503733 [1,1,0,0,0,0|2,0,0]=4 344 B12R2.1 N#CC1=CNC2=CC=CC=C12 NO21455 [1,1,0,0,0,0|1,0,1]=4 345 B12R2.1 N#CC1=COC2=C1C=NC=C2 DY507101 [1,1,0,0,0,0|1,0,1]=4 346 B12R2.1 NCC1=CN=C2C=CC=CN12 NO18027 [1,1,0,0,0,0|2,0,0]=4 347 B12R2.1 NCC1=CNC2=CC=CC=C12 DY515577 [1,1,0,0,0,0|1,0,0]=3 348 B12R2.1 NCC1=CNC2=CC=CC=C12 DY728299 [1,1,0,0,0,0|1,0,0]=3 349 B12R2.1 NCC1=CNC2=CC=CC=C12 NO20093 [1,1,0,0,0,0|1,0,0]=3 350 B12R2.1 NCC1=NNC2=CC=CC=C21 NO11089 [1,1,0,0,0,0|2,0,0]=4 351 B12R2.1 O=CC1=CNC2=CC=CC=C12 NO21525 [1,1,0,0,0,0|1,0,1]=4 352 B12R2.1 O=CC1=COC2=NC=CC=C12 DY430546 [1,1,0,0,0,0|1,0,1]=4 353 B12R2.1 O=CC1=CSC2=C1C=CC=C2 NO21482 [1,1,0,0,0,0|0,1,1]=4 354 B12R2.1 OCC1=CNC2=C1C=CC=C2 DY20402 [1,1,0,0,0,0|1,0,0]=3 355 B12R2.132 CC1=CC2=C(C=C1)N=CN2C NO17127 [1,1,0,0,0,0|2,0,0]=4 356 B12R2.132 CC1=CC2=C(C=C1)ON=C2N NO16622 [1,1,0,0,0,0|2,0,0]=4 357 B12R2.132 CC1=CC=C2NC=C(I)C2=C1 DY727435 [1,1,0,0,0,0|2,0,0]=4 358 B12R2.132 CC1=CNC2=CC=C(N)C=C12 DY728221 [1,1,0,0,0,0|1,0,0]=3 359 B12R2.132 CC1=CNC2=CC=C(O)C=C12 NO14814 [1,1,0,0,0,0|1,0,0]=3 360 B12R2.132 CC1=CNC2=NC=C(Cl)C=C12 DY103571 [1,1,0,0,0,0|2,0,0]=4 361 B12R2.132 CC1=COC2=C1C=C(O)C=C2 DY459204 [1,1,0,0,0,0|0,0,0]=2 362 B12R2.132 CC1=CSC2=CC=C(Cl)N=C12 DY677802 [1,1,0,0,0,0|1,1,0]=4 363 B12R2.132 CC1=NNC2=CC=C(Br)C=C21 NO18362 [1,1,0,0,0,0|2,0,0]=4 364 B12R2.132 CC1=NNC2=CC=C(I)C=C21 DY441185 [1,1,0,0,0,0|2,0,0]=4 365 B12R2.132 CC1=NNC2=CC=C(N)C=C21 NO22354 [1,1,0,0,0,0|2,0,0]=4 366 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 NO16745 [1,1,0,0,0,0|1,0,0]=3 367 B12R2.132 CC1=NOC2=C1C=C(O)C=C2 DY751759 [1,1,0,0,0,0|1,0,0]=3 368 B12R2.132 CN1C=NC2=C1C=C(F)C=C2 DY750061 [1,1,0,0,0,0|2,0,0]=4 369 B12R2.132 ClC1=CC=C2NC=C(Br)C2=C1 DY20448 [1,1,0,0,0,0|2,0,0]=4 370 B12R2.132 NC1=CC2=C(C=C1)SC=C2Br DY583473 [1,1,0,0,0,0|1,1,0]=4 371 B12R2.132 NC1=CNC2=CC=C(Br)C=C12 DY20498 [1,1,0,0,0,0|2,0,0]=4 372 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 NO18317 [1,1,0,0,0,0|2,0,0]=4 373 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 NO18239 [1,1,0,0,0,0|1,0,1]=4 374 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 NO15251 [1,1,0,0,0,0|2,0,0]=4 375 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 NO16834 [1,1,0,0,0,0|2,0,0]=4 376 B12R2.196 BrC1=C2NC=C(I)C2=CC=C1 DY587182 [1,1,0,0,0,0|2,0,0]=4 377 B12R2.196 CC1=CNC2=[N+]([O-])C=CC=C12 DY567351 [1,1,0,0,0,0|2,0,0]=4 378 B12R2.196 CC1=CSC2=C1C=CC=C2Br DY441871 [1,1,0,0,0,0|0,1,0]=3 379 B12R2.196 CN1C=CC2=C1C=CC=C2N DY575055 [1,1,0,0,0,0|2,0,0]=4 380 B12R2.196 CN1C=CC2=C1C=CC=C2O NO13327 [1,1,0,0,0,0|2,0,0]=4 381 B12R2.196 CN1C=NC2=C1C=CC=C2Br NO17911 [1,1,0,0,0,0|2,0,0]=4 382 B12R2.196 CN1C=NC2=C1C=CC=C2N NO22542 [1,1,0,0,0,0|2,0,0]=4 383 B12R2.203 CC1=CNC2=C1C(F)=NC=C2 DY739079 [1,1,0,0,0,0|2,0,0]=4 384 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 NO12569 [1,1,0,0,0,0|1,0,0]=3 385 B12R2.203 CC1=CNC2=CC=CC(F)=C12 DY727447 [1,1,0,0,0,0|1,0,0]=3 386 B12R2.203 CC1=COC2=C1C(Cl)=NC=N2 NO18241 [1,1,0,0,0,0|2,0,0]=4 387 B12R2.203 CC1=NNC2=CC=CC(Br)=C21 NO16636 [1,1,0,0,0,0|2,0,0]=4 388 B12R2.203 ClC1=C2C(Br)=COC2=NC=C1 DY714133 [1,1,0,0,0,0|2,0,0]=4 389 B12R2.203 ClC1=NC=CC2=C1C(Br)=CO2 NO15815 [1,1,0,0,0,0|2,0,0]=4 390 B12R2.612 CC1=C2C=CC(Br)=CC2=NN1 NO10638 [1,1,0,0,0,0|2,0,0]=4 391 B12R2.612 CC1=CNC2=CC(O)=CC=C12 DY507137 [1,1,0,0,0,0|1,0,0]=3 392 B12R2.612 CC1=NNC2=CC(Br)=CC=C21 NO10639 [1,1,0,0,0,0|2,0,0]=4 393 B12R2.612 CC1=NNC2=CC(N)=CC=C21 DY441348 [1,1,0,0,0,0|2,0,0]=4 394 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 NO12249 [1,1,0,0,0,0|1,0,0]=3 395 B12R2.612 CN1C=CC2=CC(Br)=CC=C21 NO10246 [1,1,0,0,0,0|2,0,0]=4 396 B12R2.612 CN1C=NC2=C1C=CC(F)=C2 DY750529 [1,1,0,0,0,0|2,0,0]=4 397 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 NO15249 [1,1,0,0,0,0|2,0,0]=4 398 B12R2.612 NC1=NOC2=C1C=CC(Br)=C2 NO10654 [1,1,0,0,0,0|2,0,0]=4 399 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 NO15082 [1,1,0,0,0,0|1,0,1]=4 400 B12R2.612 O=C1COC2=C1C=CC(O)=C2 NO20793 [1,1,0,0,0,0|1,0,1]=4 401 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 NO16833 [1,1,0,0,0,0|2,0,0]=4 402 B12R2.612 OC1=CNC2=CC(Br)=CC=C12 DY726427 [1,1,0,0,0,0|2,0,0]=4 403 B12R2.32 BrCC1=CN2C=CC=CC2=N1 DY760202 [1,1,0,0,0,0|2,0,0]=4 404 B12R2.32 BrCC1=NC2=C(C=CC=C2)O1 NO12836 [1,1,0,0,0,0|1,0,0]=3 405 B12R2.32 BrCC1=NC2=C(C=CC=C2)S1 NO20692 [1,1,0,0,0,0|1,1,0]=4 406 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 NO18815 [1,1,0,0,0,0|2,0,0]=4 407 B12R2.32 CCC1=NC2=C(C=CC=C2)O1 DY566925 [1,1,0,0,0,0|1,0,0]=3 408 B12R2.32 CCC1=NC2=C(C=CC=C2)S1 DY752011 [1,1,0,0,0,0|1,1,0]=4 409 B12R2.32 CSC1=NC2=NC=CC=C2O1 NO17165 [1,1,0,0,0,0|2,0,0]=4 410 B12R2.32 ClCC1=NC2=C(C=CC=C2)N1 NO20901 [1,1,0,0,0,0|2,0,0]=4 411 B12R2.32 ClCC1=NC2=C(C=CC=C2)S1 NO20895 [1,1,0,0,0,0|1,1,0]=4 412 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 NO21513 [1,1,0,0,0,0|0,0,1]=3 413 B12R2.32 N#CC1=CC2=C(C=CC=C2)S1 NO14975 [1,1,0,0,0,0|0,1,1]=4 414 B12R2.32 N#CC1=CC2=CC=CC=C2N1 NO17089 [1,1,0,0,0,0|1,0,1]=4 415 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 DY111185 [1,1,0,0,0,0|0,0,0]=2 416 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 DY425570 [1,1,0,0,0,0|2,0,0]=4 417 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 NO14446 [1,1,0,0,0,0|2,0,0]=4 418 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 NO20888 [1,1,0,0,0,0|2,0,0]=4 419 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 NO10964 [1,1,0,0,0,0|0,1,1]=4 420 B12R2.32 O=CC1=CC2=C(C=CN=C2)O1 DY585497 [1,1,0,0,0,0|1,0,1]=4 421 B12R2.32 O=CC1=CC2=CC=CC=C2N1 NO18099 [1,1,0,0,0,0|1,0,1]=4 422 B12R2.32 O=CC1=CC2=NC=CC=C2O1 DY103691 [1,1,0,0,0,0|1,0,1]=4 423 B12R2.32 OCC1=CC2=CC=CC=C2C1 DY799617 [1,1,0,0,0,0|1,0,0]=3 424 B12R2.32 OCC1=CC2=CC=CC=C2N1 NO20715 [1,1,0,0,0,0|1,0,0]=3 425 B12R2.32 ONC1=NC2=C(C=CC=C2)O1 DY534255 [1,1,0,0,0,0|2,0,0]=4 426 B12R2.95 CC1(C)OC2=C(C=CC=C2)O1 NO17049 [1,1,0,0,0,0|1,0,1]=4 427 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 NO14478 [1,1,0,0,0,0|1,0,0]=3 428 B12R2.202 CC1=CC2=C(C=CC=C2N)N1 DY731371 [1,1,0,0,0,0|1,0,0]=3 429 B12R2.202 CC1=CC2=C(F)C=CC=C2N1 DY727237 [1,1,0,0,0,0|1,0,0]=3 430 B12R2.202 CC1=CC2=C(S1)C(Br)=CC=C2 DY752413 [1,1,0,0,0,0|0,1,0]=3 431 B12R2.202 CC1=CC2=CC=CC(Br)=C2N1 DY547335 [1,1,0,0,0,0|1,0,0]=3 432 B12R2.202 CC1=CC2=CC=CC(F)=C2N1 DY727231 [1,1,0,0,0,0|1,0,0]=3 433 B12R2.202 CC1=CC2=CC=CC(O)=C2N1 DY728455 [1,1,0,0,0,0|1,0,0]=3 434 B12R2.202 CC1=CC2=NC=CC(Cl)=C2S1 DY101941 [1,1,0,0,0,0|1,1,0]=4 435 B12R2.202 CC1=CC=CC2=C1NC(=O)O2 DY753109 [1,1,0,0,0,0|2,0,0]=4 436 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 NO12224 [1,1,0,0,0,0|2,0,0]=4 437 B12R2.202 CC1=NC2=C(N)C=CC=C2O1 DY752941 [1,1,0,0,0,0|1,0,0]=3 438 B12R2.202 CC1=NC2=C(O1)C(Br)=CC=C2 NO12799 [1,1,0,0,0,0|1,0,0]=3 439 B12R2.202 CC1=NC2=C(S1)C(Br)=CC=C2 NO17820 [1,1,0,0,0,0|1,1,0]=4 440 B12R2.202 ClC1=C2OC(I)=CC2=NC=C1 DY104018 [1,1,0,0,0,0|2,0,0]=4 441 B12R2.202 NC1=NC2=C(O1)C(F)=CC=C2 DY515583 [1,1,0,0,0,0|2,0,0]=4 442 B12R2.202 NC1=NC=CC2=C1C=C(I)O2 DY540681 [1,1,0,0,0,0|2,0,0]=4 443 B12R2.202 O=C1NC2=C(C=CC=C2Br)O1 DY753073 [1,1,0,0,0,0|2,0,0]=4 444 B12R2.202 O=C1NC2=C(O1)C(Br)=CC=C2 NO14681 [1,1,0,0,0,0|2,0,0]=4 445 B12R2.606 BrC1=CN=C2C=C(I)OC2=C1 DY678960 [1,1,0,0,0,0|2,0,0]=4 446 B12R2.606 CC1=CC2=C(C=C(Br)C=C2)S1 DY579369 [1,1,0,0,0,0|0,1,0]=3 447 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 NO11036 [1,1,0,0,0,0|1,0,0]=3 448 B12R2.606 CC1=CC2=C(C=C1)SC(Br)=C2 DY790383 [1,1,0,0,0,0|1,1,0]=4 449 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 DY441288 [1,1,0,0,0,0|0,0,0]=2 450 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 DY603069 [1,1,0,0,0,0|0,0,0]=2 451 B12R2.606 CC1=CC2=C(C=N1)C=C(C)N2 DY670842 [1,1,0,0,0,0|2,0,0]=4 452 B12R2.606 CC1=CC2=CC(Br)=CN=C2N1 DY425648 [1,1,0,0,0,0|2,0,0]=4 453 B12R2.606 CC1=CC2=CC(F)=CC=C2N1 NO11005 [1,1,0,0,0,0|1,0,0]=3 454 B12R2.606 CC1=CC2=CC(F)=CN=C2N1 DY458705 [1,1,0,0,0,0|2,0,0]=4 455 B12R2.606 CC1=CC2=CC(O)=CC=C2N1 NO21722 [1,1,0,0,0,0|1,0,0]=3 456 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 NO12813 [1,1,0,0,0,0|1,0,0]=3 457 B12R2.606 CC1=CC2=CC=C(N)C=C2N1 DY502635 [1,1,0,0,0,0|1,0,0]=3 458 B12R2.606 CC1=CC2=NC=C(Br)C=C2N1 DY510152 [1,1,0,0,0,0|2,0,0]=4 459 B12R2.606 CC1=CC=C2C=C(C)NC2=C1 NO15359 [1,1,0,0,0,0|1,0,0]=3 460 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 NO10011 [1,1,0,0,0,0|1,0,0]=3 461 B12R2.606 CC1=CC=C2NC(C)=CC2=N1 DY670800 [1,1,0,0,0,0|2,0,0]=4 462 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)O1 NO10632 [1,1,0,0,0,0|1,0,0]=3 463 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)S1 NO10630 [1,1,0,0,0,0|1,1,0]=4 464 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)S1 DY553911 [1,1,0,0,0,0|1,1,0]=4 465 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 DY560895 [1,1,0,0,0,0|1,0,0]=3 466 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)N1 NO10270 [1,1,0,0,0,0|2,0,0]=4 467 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 DY20465 [1,1,0,0,0,0|1,0,0]=3 468 B12R2.606 CC1=NC2=C(C=CC(N)=C2)N1 NO12509 [1,1,0,0,0,0|2,0,0]=4 469 B12R2.606 CC1=NC2=C(C=CC(N)=C2)N1 NO21670 [1,1,0,0,0,0|2,0,0]=4 470 B12R2.606 CC1=NC2=C(C=CC(N)=C2)O1 DY752923 [1,1,0,0,0,0|1,0,0]=3 471 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 NO16740 [1,1,0,0,0,0|1,0,0]=3 472 B12R2.606 CC1=NC2=NC=C(Br)C=C2O1 NO13431 [1,1,0,0,0,0|2,0,0]=4 473 B12R2.606 CN1C=C2C=C(Cl)C=CC2=N1 DY559443 [1,1,0,0,0,0|2,0,0]=4 474 B12R2.606 Cc1nc2cc(Br)ccc2s1 NO10712 [1,1,0,0,0,0|1,1,0]=4 475 B12R2.606 ClC1=NC2=C(C=CC(Br)=C2)O1 NO13138 [1,1,0,0,0,0|2,0,0]=4 476 B12R2.606 FC1=CC2=C(C=C1)N=C(Cl)O2 NO15195 [1,1,0,0,0,0|2,0,0]=4 477 B12R2.606 NC1=CC2=C(C=C(Br)C=C2)S1 DY752641 [1,1,0,0,0,0|1,1,0]=4 478 B12R2.606 NC1=CC2=C(C=C1)OC(Cl)=N2 DY752851 [1,1,0,0,0,0|2,0,0]=4 479 B12R2.606 NC1=NC2=C(C=C(Br)C=C2)O1 DY443172 [1,1,0,0,0,0|2,0,0]=4 480 B12R2.606 NC1=NC2=C(C=C(F)C=C2)O1 DY510765 [1,1,0,0,0,0|2,0,0]=4 481 B12R2.606 Nc1nc2cc(Cl)ccc2o1 DY563103 [1,1,0,0,0,0|2,0,0]=4 482 B12R2.606 O=C1CC2=C(C=CC(O)=C2)O1 DY545547 [1,1,0,0,0,0|1,0,1]=4 483 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 NO13902 [1,1,0,0,0,0|2,0,0]=4 484 B12R2.606 O=c1oc2cc(O)ccc2s1 DY556851 [1,1,0,0,0,0|2,0,0]=4 485 B12R2.606 S=C1NC2=C(C=C(Cl)C=C2)O1 DY542775 [1,1,0,0,0,0|2,0,0]=4 486 B12R2.606 S=C1NC2=C(C=CC(Cl)=C2)O1 NO10329 [1,1,0,0,0,0|2,0,0]=4 487 B12R2.606 SC1=NC2=C(C=CC(Br)=C2)O1 NO10298 [1,1,0,0,0,0|2,0,0]=4 488 B14R2.92 CC1=C(CN)C=CC2=CC=CC=C21 DY765377 [0,1,0,0,0,1|1,0,0]=3 489 B14R2.92 ClCC1=C(Br)C2=CC=CC=C2C=C1 DY764117 [0,1,0,0,0,1|2,0,0]=4 490 B14R2.92 FC1=C(CCl)C=CC2=CC=CC=C21 DY764699 [0,1,0,0,0,1|2,0,0]=4 491 B14R2.92 NCC1=C(O)C2=CC=CC=C2C=C1 DY765593 [0,1,0,0,0,1|2,0,0]=4 492 B14R2.92 OCC1=C(I)C2=CC=CC=C2C=C1 DY767375 [0,1,0,0,0,1|2,0,0]=4 493 B14R2.203 COC1=C(N)C=NC2=CC=CC=C21 DY689499 [0,1,0,0,0,1|2,0,0]=4 494 B14R2.203 NC1=C(CBr)C2=CC=CC=C2C=C1 DY763295 [0,1,0,0,0,1|2,0,0]=4 495 B14R2.203 NCC1=C(I)C=CC2=CC=CC=C21 DY764855 [0,1,0,0,0,1|2,0,0]=4 496 B14R2.4513 NC1=COC2=CC=C(Cl)C=C2C1=O DY674329 [0,1,0,0,0,1|2,0,0]=4 497 B14R2.7724 CC1=CC(C)=C(N)C2=CC=CC=C12 DY768763 [0,1,0,0,0,1|2,0,0]=4 498 B14R2.7724 CC1=NC(=O)C2=CC=CC=C2N1C DY782548 [0,1,0,0,0,1|2,0,0]=4 499 B14R2.7724 CN1C(=O)OC(=O)C2=CC=CC=C21 DY503283 [0,1,0,0,0,1|2,0,0]=4 500 B14R2.8188 CC1=C(Br)C(=O)C2=CC=CC=C2O1 DY755131 [0,1,0,0,0,1|2,0,0]=4 501 B14R2.8188 CC1=C(O)C2=CC=CC=C2OC1=O DY676664 [0,1,0,0,0,1|1,0,0]=3 502 B14R2.8188 NC1=C(Cl)OC2=CC=CC=C2C1=O DY755119 [0,1,0,0,0,1|2,0,0]=4 503 B14R2.29369 CN1C(=O)COC2=C1C=CC(Br)=C2 DY586017 [0,1,0,0,0,1|2,0,0]=4 504 B14R2.1019 CCC1=NC2=C(C=CC=C2)C(=O)O1 DY672853 [0,1,0,0,0,1|2,0,0]=4 505 B14R2.1019 COC1=CC2=CC=CC=C2C(=O)O1 DY771471 [0,1,0,0,0,1|2,0,0]=4 506 B14R2.1019 COC1=CC2=CC=CC=C2C(Br)=C1 DY557583 [0,1,0,0,0,1|2,0,0]=4 507 B14R2.1019 CSC1=CC(=O)C2=CC=CC=C2S1 DY568629 [0,1,0,0,0,1|1,1,0]=4 508 B14R2.1019 ClC1=CC(CBr)=CC2=CC=CC=C12 DY768606 [0,1,0,0,0,1|2,0,0]=4 509 B14R2.1019 ClCC1=CC2=CC=CC=C2C(I)=C1 DY764831 [0,1,0,0,0,1|2,0,0]=4 510 B14R2.1019 ClCC1=NC2=CC=CC=C2C(Cl)=C1 DY689264 [0,1,0,0,0,1|2,0,0]=4 511 B14R2.1019 ClCC1=NC2=CC=CC=C2C(Cl)=N1 DY782596 [0,1,0,0,0,1|2,0,0]=4 512 B14R2.1019 NC1=CC(CO)=CC2=CC=CC=C12 DY765605 [0,1,0,0,0,1|2,0,0]=4 513 B14R2.1019 O=C1CC(CO)OC2=CC=CC=C12 DY771225 [0,1,0,0,0,1|1,0,1]=4 514 B14R2.1019 O=C1NC(CO)=NC2=CC=CC=C12 DY607575 [0,1,0,0,0,1|2,0,0]=4 515 B14R2.1019 OCC1=CC(O)=C2C=CC=CC2=C1 DY765629 [0,1,0,0,0,1|2,0,0]=4 516 B14R2.1146 COC1=NC(N)=CC2=CC=CC=C21 DY572745 [0,1,0,0,0,1|2,0,0]=4 517 B14R2.1146 NCC1=CC(=O)NC2=CC=CC=C12 DY689108 [0,1,0,0,0,1|2,0,0]=4 518 B14R2.1146 O=C1C=C(CBr)C2=CC=CC=C2N1 NO22686 [0,1,0,0,0,1|2,0,0]=4 519 B14R2.8045 CC1=CC(=O)NC2=C(Cl)C=CC=C12 DY691090 [0,1,0,0,0,1|2,0,0]=4 520 B14R2.8045 CC1=CC(C)=C2N=CC=C(N)C2=C1 DY604809 [0,1,0,0,0,1|2,0,0]=4 521 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(Cl)=C1 DY534759 [0,1,0,0,0,1|2,0,0]=4 522 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(Cl)=N1 DY779794 [0,1,0,0,0,1|2,0,0]=4 523 B14R2.8045 CC1=NC2=C(F)C=CC=C2C(O)=C1 DY558609 [0,1,0,0,0,1|2,0,0]=4 524 B14R2.8045 CC1=NC2=C(O)C=CC=C2C(Cl)=C1 DY457900 [0,1,0,0,0,1|2,0,0]=4 525 B14R2.8235 CC1=CC(=O)NC2=CC=C(Cl)C=C12 NO13605 [0,1,0,0,0,1|2,0,0]=4 526 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(Br)C=C12 NO13245 [0,1,0,0,0,1|2,0,0]=4 527 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(Cl)C=C12 DY607047 [0,1,0,0,0,1|2,0,0]=4 528 B14R2.8235 CC1=CC=C2C=C(C)C=C(C)C2=C1 DY763829 [0,1,0,0,0,1|1,0,0]=3 529 B14R2.8235 CC1=CC=C2N=C(C)C=C(Br)C2=C1 DY689120 [0,1,0,0,0,1|2,0,0]=4 530 B14R2.8235 CC1=CC=C2N=C(Cl)C=C(C)C2=C1 DY552711 [0,1,0,0,0,1|2,0,0]=4 531 B14R2.8235 CC1=NC(=O)C2=CC(Cl)=CC=C2N1 NO10497 [0,1,0,0,0,1|2,0,0]=4 532 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(=O)N1 NO10631 [0,1,0,0,0,1|2,0,0]=4 533 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(Cl)=N1 NO10643 [0,1,0,0,0,1|2,0,0]=4 534 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(Cl)=N1 NO22504 [0,1,0,0,0,1|2,0,0]=4 535 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=C1 DY534591 [0,1,0,0,0,1|2,0,0]=4 536 B14R2.8235 O=C1C=C(O)C2=CC(Br)=CC=C2O1 DY679068 [0,1,0,0,0,1|2,0,0]=4 537 B14R2.28480 CC1=C2C(=O)CC(C)OC2=CC=C1 DY770847 [0,1,0,0,0,1|1,0,1]=4 538 B14R2.28480 CC1=CC(C)=C2C(O)=CC=NC2=C1 DY689577 [0,1,0,0,0,1|2,0,0]=4 539 B14R2.28480 CC1=NC2=CC=CC(F)=C2C(Cl)=N1 DY779824 [0,1,0,0,0,1|2,0,0]=4 540 B14R2.28480 O=C1C=C(O)C2=C(Cl)C=CC=C2O1 DY677808 [0,1,0,0,0,1|2,0,0]=4 541 B14R2.29365 CC1=CC(=O)OC2=CC(N)=CC=C12 NO11356 [0,1,0,0,0,1|1,0,0]=3 542 B14R2.29365 CC1=CC(=O)OC2=CC(S)=CC=C12 DY443166 [0,1,0,0,0,1|1,0,0]=3 543 B14R2.29365 CC1=NC2=CC(Cl)=CC=C2C(Cl)=N1 NO11927 [0,1,0,0,0,1|2,0,0]=4 544 B14R2.1128 CC1=CC2=CC=CC=C2N=C1CN DY586442 [0,1,0,0,0,1|1,0,0]=3 545 B14R2.1128 CC1=NC2=CC=CC=C2N=C1NN DY783862 [0,1,0,0,0,1|2,0,0]=4 546 B14R2.1128 COC1=CC2=CC=CC=C2N=C1Cl DY688227 [0,1,0,0,0,1|2,0,0]=4 547 B14R2.1128 COC1=NC2=CC=CC=C2N=C1Cl NO21502 [0,1,0,0,0,1|2,0,0]=4 548 B14R2.1128 NCC1=CC2=CC=CC=C2N=C1Cl DY687181 [0,1,0,0,0,1|2,0,0]=4 549 B14R2.1128 NCC1=NC2=CC=CC=C2N=C1O DY783982 [0,1,0,0,0,1|2,0,0]=4 550 B14R2.1128 O=C1OC2=C(C=CC=C2)N\C1=N/O DY772893 [0,1,0,0,0,1|2,0,0]=4 551 B14R2.1128 OCC1=CC2=CC=CC=C2C=C1F DY765647 [0,1,0,0,0,1|2,0,0]=4 552 B14R2.8239 CC1=CC2=CC(Br)=CC=C2N=C1N DY690075 [0,1,0,0,0,1|2,0,0]=4 553 B14R2.8239 CC1=CC=C2N=C(C)C(=O)NC2=C1 DY783820 [0,1,0,0,0,1|2,0,0]=4 554 B14R2.8239 CC1=CC=C2N=C(C)C(Cl)=NC2=C1 DY783574 [0,1,0,0,0,1|2,0,0]=4 555 B14R2.8239 CC1=NC2=CC=C(F)C=C2N=C1Cl DY783556 [0,1,0,0,0,1|2,0,0]=4 556 B14R2.8239 CC1OC2=C(C=CC(Cl)=C2)NC1=O DY680613 [0,1,0,0,0,1|1,0,1]=4 557 B14R2.28472 CC1=NC2=CC=CC(Cl)=C2N=C1C DY784144 [0,1,0,0,0,1|1,0,0]=3 558 B14R2.28472 C[C@@H]1OC2=C(C=CC=C2F)NC1=O DY625513 [0,1,0,0,0,1|1,0,1]=4 559 B14R2.44 CC1=C(CC#N)NC2=CC=CC=C21 DY728077 [0,2,0,0,0,0|1,0,0]=3 560 B14R2.44 CCCC1=C(C)C2=CC=CC=C2N1 DY731089 [0,2,0,0,0,0|1,0,0]=3 561 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 DY41799 [0,2,0,0,0,0|0,0,1]=3 562 B14R2.1060 CC1=C(C=O)OC2=C1C=C(F)C=C2 DY561225 [0,2,0,0,0,0|0,0,1]=3 563 B14R2.1060 CC1=C(CO)NC2=CC=C(F)C=C21 DY728593 [0,2,0,0,0,0|1,0,0]=3 564 B14R2.1095 CC1=CC2=C(C=C1)N(C)C(CO)=N2 DY614610 [0,2,0,0,0,0|2,0,0]=4 565 B14R2.1095 CN1C(CO)=CC2=CC(N)=CC=C21 DY728569 [0,2,0,0,0,0|2,0,0]=4 566 B14R2.1095 CN1C(CO)=NC2=C1C=CC(N)=C2 DY750481 [0,2,0,0,0,0|2,0,0]=4 567 B14R2.1129 CCC1=C(C#N)C2=C(C=CC=C2)O1 DY751327 [0,2,0,0,0,0|0,0,1]=3 568 B14R2.1129 CCN1C(CO)=NC2=C1C=CC=C2 DY540189 [0,2,0,0,0,0|2,0,0]=4 569 B14R2.1199 CN1C(CO)=NC2=C1C(Cl)=CC=C2 DY33299 [0,2,0,0,0,0|2,0,0]=4 570 B14R2.517 CNCC1=C(C)N=C2C=CC=CN21 DY609967 [0,2,0,0,0,0|2,0,0]=4 571 B14R2.517 CO\C=C1\C(=O)OC2=CC=CC=C21 DY751285 [0,2,0,0,0,0|1,0,0]=3 572 B14R2.642 CC1=C(C(=O)O)C2=C(C=CC=C2)S1 DY531615 [0,2,0,0,0,0|0,1,1]=4 573 B14R2.4220 CC1=CC=CN2C1=NC(C)=C2CO DY668927 [0,2,0,0,0,0|2,0,0]=4 574 B14R2.19008 CC1=C(C=O)C2=CC(Cl)=CC=C2N1 DY728707 [0,2,0,0,0,0|1,0,1]=4 575 B14R2.19008 CC1=C(C=O)C2=CC(O)=CC=C2N1 DY731269 [0,2,0,0,0,0|1,0,1]=4 576 B14R2.19008 CCC1=C(C)NC2=CC=C(Cl)C=C21 DY727219 [0,2,0,0,0,0|1,0,0]=3 577 B14R2.19008 CCC1=C(C)NC2=CC=C(N)C=C21 DY728215 [0,2,0,0,0,0|1,0,0]=3 578 B14R2.19008 CC[N+]1=C(C)SC2=C1C=C(Cl)C=C2 DY564501 [0,2,0,0,0,0|1,1,0]=4 579 B14R2.4507 CC1=NC2=CC=C(Br)C=C2C1(C)C DY559419 [0,2,0,0,0,0|1,0,1]=4 580 B14R2.9184 CC1=NC2=C(C=C(Br)C=C2F)N1C DY750757 [0,2,0,0,0,0|2,0,0]=4 581 B14R2.9184 CC1=NC2=C(C=C(F)C=C2Br)N1C DY750745 [0,2,0,0,0,0|2,0,0]=4 582 B14R2.11645 CC1=C(C)C2=CC=CC(C=O)=C2N1 DY601495 [0,2,0,0,0,0|1,0,0]=3 583 B14R2.27750 CC1=CC2=C(C(=O)C(=O)O2)C(C)=C1 DY751141 [0,2,0,0,0,0|2,0,0]=4 584 B14R2.1815 CC1=NC2=C(C=CC(C#N)=C2)N1C DY606279 [0,2,0,0,0,0|2,0,0]=4 585 B14R2.1815 CC1=NC2=C(C=CC(C=O)=C2)N1C DY750271 [0,2,0,0,0,0|2,0,0]=4 586 B14R2.1815 CNC1=CC2=NN(C)C(C)=C2C=C1 DY520593 [0,2,0,0,0,0|2,0,0]=4 587 B12R2.24 CC1=CC2=CC=CC=C2N=C1 NO11336 [0,0,1,1,0,0|2,0,0]=4 588 B12R2.24 CC1=NC2=CC=CC=C2C=C1 NO11335 [0,0,1,1,0,0|1,0,1]=4 589 B12R2.24 CC1=NC2=CC=CC=C2N=C1 DY569061 [0,0,1,1,0,0|2,0,0]=4 590 B12R2.24 O=C1C=CC2=CC=CC=C2O1 DY507548 [0,0,1,1,0,0|1,0,1]=4 591 B12R2.315 COC1=CC=CC2=C1OC=C2 NO21625 [0,0,1,1,0,0|1,0,1]=4 592 B12R2.315 O=CC1=CC=CC2=C1OC=N2 DY752899 [0,0,1,1,0,0|2,0,0]=4 593 B12R2.1081 CC1=CC=NC2=CC=CC=C12 NO11332 [0,0,1,1,0,0|1,0,1]=4 594 B12R2.1081 O=C1CCOC2=CC=CC=C12 NO22800 [0,0,1,1,0,0|1,0,1]=4 595 B12R2.82 CC1=CC=C2C=CNC2=C1C DY727339 [0,0,1,1,0,0|2,0,0]=4 596 B14R3.52 C1=CC2=CC=C3CCC3=C2C=C1 DY756199 [0,0,0,1,0,1|1,0,0]=3 597 B14R3.2534 C1=CC=C2N=C3CCC3=NC2=C1 DY783784 [0,0,0,1,0,1|1,0,0]=3 598 B14R3.49 C1=CC2=C(C=C1)C3=C(CCC3)N2 NO13524 [0,1,0,1,0,0|1,0,0]=3 599 B14R3.49 C1=CC2=C(C=C1)N3CCNC3=N2 NO20706 [0,1,0,1,0,0|2,0,0]=4 600 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 DY553521 [0,0,1,0,0,1|2,0,0]=4 601 B14R2.52 O=C1COC2=C(C=CC=C2)C(=O)N1 DY681822 [0,0,0,0,0,2|2,0,0]=4 602 B14R2.287 CC1=NCC(=O)NC2=C1C=CC=C2 DY116462 [0,0,0,0,0,2|2,0,0]=4 603 B14R2.287 CC1=NNC(=O)C2=C(C=CC=C2)O1 DY116792 [0,0,0,0,0,2|1,0,0]=3