0 B12R2.606 BrC1=CC2=C(NC(=N2)N)C=C1 ACS017311 [1,0,0,0,0,0|1,1,1]=4 1 B12R2.606 BrC1=CC=C2CC(NC2=C1)=O ACS011028 [1,0,0,0,0,0|1,1,0]=3 2 B12R2.606 BrC=1C=C2C(=NC1)NC(N2)=O ACS020922 [1,0,0,0,0,0|1,1,0]=3 3 B12R2.606 BrC=1C=C2CC(CC2=CC1)=O ACS020906 [1,0,0,0,0,0|2,1,0]=4 4 B12R2.606 BrC=1C=CC2=C(NC(O2)=O)C1 ACS020350 [1,0,0,0,0,0|1,1,0]=3 5 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)N ACS019236 [1,0,0,0,0,0|2,0,1]=4 6 B12R2.606 ClC=1OC2=C(N1)C=CC(=C2)F ACF023639 [1,0,0,0,0,0|2,0,1]=4 7 B12R2.606 FC1=CC2=C(N=C(O2)N)C=C1 ACF022696 [1,0,0,0,0,0|2,0,1]=4 8 B12R2.606 FC1=CC2=C(N=C(S2)N)C=C1 ACF022689 [1,0,0,0,0,0|2,0,1]=4 9 B12R2.606 FC1=CC=C2C(=N1)NC(C2)=O ACF021926 [1,0,0,0,0,0|2,0,0]=3 10 B12R2.606 FC1=CC=C2C=C(NC2=C1)C ACF016928 [1,0,0,0,0,0|2,0,0]=3 11 B12R2.606 FC1=CC=C2CC(NC2=C1)=O ACF010212 [1,0,0,0,0,0|1,0,0]=2 12 B12R2.606 FC=1C=C2C(=NC1)NC(=C2)C ACF021966 [1,0,0,0,0,0|3,0,0]=4 13 B12R2.606 FC=1C=C2C(=NC1)NC(C2)=O ACF021143 [1,0,0,0,0,0|2,0,0]=3 14 B12R2.606 FC=1C=C2C=C(NC2=CC1)C ACF010282 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.606 FC=1C=C2CC(NC2=CC1)=O ACF010211 [1,0,0,0,0,0|1,0,0]=2 16 B12R2.606 FC=1C=CC2=C(N=C(O2)N)C1 ACF022695 [1,0,0,0,0,0|2,0,1]=4 17 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)O ACS020380 [1,0,0,0,0,0|2,0,1]=4 18 B12R2.606 NC=1SC2=C(N1)C=C(C=C2)F ACF017153 [1,0,0,0,0,0|2,0,1]=4 19 B12R2.612 BrC1=CC2=C(N(C=N2)C)C=C1 ACS018828 [1,0,0,0,0,0|1,1,1]=4 20 B12R2.612 BrC1=CNC2=NC(=CC=C21)F ACF021938 [1,0,0,0,0,0|3,0,0]=4 21 B12R2.612 BrC1=NNC2=CC(=CC=C12)F ACF018391 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.612 ClC1=CNC2=NC(=CC=C21)F ACF021978 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.612 FC1=CC=C2C(=N1)NC=C2I ACF021939 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.612 FC1=CC=C2C(=N1)NC=C2N ACF021977 [1,0,0,0,0,0|3,0,0]=4 25 B12R2.612 FC1=CC=C2C(=NNC2=C1)C ACF017514 [1,0,0,0,0,0|3,0,0]=4 26 B12R2.612 FC1=CC=C2C(=NNC2=C1)I ACF018392 [1,0,0,0,0,0|3,0,0]=4 27 B12R2.612 FC1=CC=C2C(=NNC2=C1)N ACF022365 [1,0,0,0,0,0|3,0,0]=4 28 B14R2.4217 FC1=CC=C2C(=C(NC2=C1)C)C=O ACF022089 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.20 ClC1=CC=C(C=C1)C(C(=O)O)O ACS012941 [0,0,1,0,0,0|2,1,0]=4 30 B12R1.20 FC1=CC=C([C@@H](N)C(=O)O)C=C1 ACF010859 [0,0,1,0,0,0|3,0,0]=4 31 B12R1.20 OC(C(=O)O)C1=CC=C(C=C1)C ACS015778 [0,0,1,0,0,0|3,0,0]=4 32 B12R1.50 FC=1C=C(C=CC1)CC(=O)OC ACF016984 [0,0,1,0,0,0|3,0,0]=4 33 B14R2.29365 ClC=1C=C2C(C(=O)OC(N2)=O)=CC1 ACS011512 [0,0,0,0,0,1|1,1,1]=4 34 B14R2.29369 ClC=1C=C2NCC(N(C2=CC1)C)=O ACS020744 [0,0,0,0,0,1|1,1,0]=3 35 B11R1.20 C(C)(=O)OC1=CC=C(C=C1)F ACF010438 [1,0,1,0,0,0|2,0,0]=4 36 B11R1.20 CC(=O)Nc1ccc(cc1)F ACF014024 [1,0,1,0,0,0|1,0,0]=3 37 B11R1.20 Cc1ccc(cc1)NC(=O)C ACS014026 [1,0,1,0,0,0|2,0,0]=4 38 B11R1.20 FC1=CC=C(C=C1)CC(=O)O ACF012967 [1,0,1,0,0,0|2,0,0]=4 39 B11R1.20 FC1=CC=C(C=C1)CC(N)=N ACF022183 [1,0,1,0,0,0|2,0,0]=4 40 B11R1.20 c1cc(ccc1OC(=O)Cl)F ACF015513 [1,0,1,0,0,0|2,0,0]=4 41 B11R1.22 FC1=CC=C(C=C1)C(C=O)=O ACF014315 [1,0,1,0,0,0|1,0,1]=4 42 B11R1.22 NCC(O)C1=CC=C(C=C1)F ACF024466 [1,0,1,0,0,0|1,0,1]=4 43 B11R1.36 OC(C(=O)O)C1=CC=CC=C1 ACS012974 [1,0,1,0,0,0|2,0,0]=4 44 B11R1.40 C1(=CC=CC=C1)OC(NC)=O ACS017176 [1,0,1,0,0,0|2,0,0]=4 45 B11R1.157 BrC=1C=C(C=CC1)CC(=O)O ACS010617 [1,0,1,0,0,0|1,1,0]=4 46 B11R1.157 CC(=O)Nc1cccc(c1)F ACF014023 [1,0,1,0,0,0|1,0,0]=3 47 B11R1.157 CC(=O)Nc1cccc(c1)N ACS014015 [1,0,1,0,0,0|2,0,0]=4 48 B11R1.157 ClC=1C=C(C=CC1)CC(=O)O ACS012939 [1,0,1,0,0,0|1,1,0]=4 49 B11R1.157 FC1=CC=CC(=N1)CC(=O)O ACF023166 [1,0,1,0,0,0|2,0,0]=4 50 B11R1.157 FC=1C=C(C=CC1)CC(=O)O ACF012966 [1,0,1,0,0,0|1,0,0]=3 51 B11R1.157 FC=1C=C(C=CC1)CC(N)=N ACF022181 [1,0,1,0,0,0|2,0,0]=4 52 B11R1.157 FC=1C=C(C=CC1)OC(C)=O ACF012682 [1,0,1,0,0,0|2,0,0]=4 53 B11R1.157 FC=1C=C(C=NC1)CC(=O)O ACF023333 [1,0,1,0,0,0|2,0,0]=4 54 B11R1.157 IC=1C=C(C=CC1)CC(=O)O ACS012979 [1,0,1,0,0,0|1,1,0]=4 55 B11R1.157 NC=1C=C(C=CC1)CC(=O)O ACS012903 [1,0,1,0,0,0|2,0,0]=4 56 B11R1.166 BrC1=C(C(=O)O)C=CC(=C1)F ACF013085 [1,0,1,0,0,0|2,0,0]=4 57 B11R1.166 ClC1=C(C(=O)O)C=CC(=C1)F ACF012449 [1,0,1,0,0,0|2,0,0]=4 58 B11R1.166 FC1=C(C(=O)O)C=CC(=C1)F ACF012437 [1,0,1,0,0,0|2,0,0]=4 59 B11R1.166 FC1=CC(=C(C(=O)O)C=C1)C ACF010107 [1,0,1,0,0,0|2,0,0]=4 60 B11R1.166 FC1=CC(=C(C(=O)O)C=C1)I ACF013192 [1,0,1,0,0,0|2,0,0]=4 61 B11R1.166 FC1=CC(=C(C(=O)O)C=C1)O ACF013190 [1,0,1,0,0,0|2,0,0]=4 62 B11R1.166 FC=1C=CC(=C(N)C1)[N+](=O)[O-] ACF010654 [1,0,1,0,0,0|0,0,2]=4 63 B11R1.166 NC1=C(C(=O)O)C=CC(=C1)Br ACS013043 [1,0,1,0,0,0|1,1,0]=4 64 B11R1.166 NC1=C(C(=O)O)C=CC(=C1)C ACS013058 [1,0,1,0,0,0|2,0,0]=4 65 B11R1.166 NC1=C(C(=O)O)C=CC(=C1)Cl ACS011418 [1,0,1,0,0,0|1,1,0]=4 66 B11R1.166 NC1=C(C(=O)O)C=CC(=C1)F ACF012442 [1,0,1,0,0,0|1,0,0]=3 67 B11R1.166 NC1=C(C=CC(=C1)F)C(C)=O ACF017317 [1,0,1,0,0,0|2,0,0]=4 68 B11R1.166 NC1=C(C=NC(=C1)F)C(=O)O ACF021152 [1,0,1,0,0,0|2,0,0]=4 69 B11R2.10 C1C(CC2=CC=CC=C12)=O ACS015485 [2,0,0,0,0,0|2,0,0]=4 70 B11R2.10 CC=1NC2=CC=CC=C2C1 ACS011044 [2,0,0,0,0,0|2,0,0]=4 71 B11R2.10 ClC=1NC2=C(N1)C=CC=C2 ACS011055 [2,0,0,0,0,0|1,0,1]=4 72 B11R2.10 N1C(NC2=NC=CC=C21)=O ACS024033 [2,0,0,0,0,0|1,0,0]=3 73 B11R2.10 NC=1NC2=C(N1)C=CC=C2 ACS011188 [2,0,0,0,0,0|1,0,1]=4 74 B11R2.10 O1C(CC2=C1C=CC=C2)=O ACS012026 [2,0,0,0,0,0|2,0,0]=4 75 B11R2.10 SC=1NC2=C(N1)C=CC=C2 ACS011577 [2,0,0,0,0,0|0,1,1]=4 76 B11R2.36 BrC1=CC=C2C=CNC2=C1 ACS010202 [2,0,0,0,0,0|1,1,0]=4 77 B11R2.36 BrC=1C=C2C=CNC2=CC1 ACS015438 [2,0,0,0,0,0|1,1,0]=4 78 B11R2.36 ClC=1C=CC2=C(NC=N2)C1 ACS020514 [2,0,0,0,0,0|0,1,1]=4 79 B11R2.36 FC1=CC=C2C(=N1)NC=C2 ACF023151 [2,0,0,0,0,0|2,0,0]=4 80 B11R2.36 FC1=CC=C2C=CNC2=C1 ACF012557 [2,0,0,0,0,0|1,0,0]=3 81 B11R2.36 FC1=CC=C2C=NNC2=C1 ACF021083 [2,0,0,0,0,0|2,0,0]=4 82 B11R2.36 FC1=CC=C2CCNC2=C1 ACF020295 [2,0,0,0,0,0|1,0,1]=4 83 B11R2.36 FC=1C=C2C(=NC1)C=CN2 ACF023323 [2,0,0,0,0,0|2,0,0]=4 84 B11R2.36 FC=1C=C2C(=NC1)NC=C2 ACF012301 [2,0,0,0,0,0|2,0,0]=4 85 B11R2.36 FC=1C=C2C(=NC1)NC=N2 ACF022039 [2,0,0,0,0,0|1,0,1]=4 86 B11R2.36 FC=1C=C2C=CNC2=CC1 ACF016925 [2,0,0,0,0,0|1,0,0]=3 87 B11R2.36 FC=1C=C2C=NNC2=CC1 ACF021081 [2,0,0,0,0,0|2,0,0]=4 88 B11R2.36 FC=1C=CC2=C(C=CO2)C1 ACF017476 [2,0,0,0,0,0|2,0,0]=4 89 B11R2.36 FC=1C=CC2=C(SC=C2)C1 ACF020488 [2,0,0,0,0,0|2,0,0]=4 90 B11R2.36 N1C=NC2=C1C=CC(=C2)N ACS023898 [2,0,0,0,0,0|1,0,1]=4 91 B11R2.36 NC1=CC2=C(N=CN2)C=C1 ACS015407 [2,0,0,0,0,0|1,0,1]=4 92 B11R2.36 OC=1C=C2C=CNC2=CC1 ACS011023 [2,0,0,0,0,0|2,0,0]=4 93 B13R2.359 FC1(C(NC2=CC=CC=C12)=O)F ACF022154 [1,1,0,0,0,0|2,0,0]=4 94 B13R2.3028 ClC=1C=C2C(C(NC2=CC1)=O)=O ACS011581 [1,1,0,0,0,0|1,0,1]=4 95 B13R2.3028 FC=1C=C2C(C(NC2=CC1)=O)=O ACF010210 [1,1,0,0,0,0|1,0,1]=4 96 B13R2.4825 FC=1C=CC=C2C(C(NC12)=O)=O ACF015474 [1,1,0,0,0,0|1,0,1]=4 97 B13R2.4825 FC=1C=CC=C2C(C(NC12)=O)C ACF022638 [1,1,0,0,0,0|2,0,0]=4 98 B13R2.2121 COC1=CC=C2CC(NC2=C1)=O ACS011132 [1,1,0,0,0,0|2,0,0]=4 99 B13R2.3050 ClC1=C2C(=NC=C1F)NC(C2)=O ACF021161 [1,1,0,0,0,0|2,0,0]=4 100 B13R2.13083 Cc1cc2c(cc1N)[nH]c(=O)[nH]2 ACS011053 [1,1,0,0,0,0|1,0,0]=3 101 B13R2.13083 ClC1=C(C=C2CC(NC2=C1)=O)F ACF021091 [1,1,0,0,0,0|1,0,0]=3 102 B13R2.13083 ClC1=CC2=C(NC(N2)=S)C=C1I ACS020620 [1,1,0,0,0,0|0,2,0]=4 103 B13R2.13083 ClC=1C=C2CC(NC2=CC1Cl)=O ACS016921 [1,1,0,0,0,0|1,1,0]=4 104 B13R2.13083 FC=1C=C2CC(NC2=CC1F)=O ACF010207 [1,1,0,0,0,0|1,0,0]=3 105 B13R2.13083 NC1=CC2=C(NC(N2)=O)C=C1Cl ACS020838 [1,1,0,0,0,0|0,1,0]=3 106 B15R2.45549 NC1=CC2=C(N(C(N2C)=O)C)C=C1Br ACS020792 [0,2,0,0,0,0|1,1,0]=4 107 B15R2.6574 ClC1=CC=C2\C(\C(NC2=C1Cl)=O)=N\O ACS019902 [0,2,0,0,0,0|1,1,0]=4 108 B13R2.155 BrC1=CC2=C(OCC(N2)=O)C=C1 ACS018953 [0,0,1,1,0,0|1,1,0]=4 109 B13R2.155 ClC1=CC2=C(OCC(N2)=O)C=C1 ACS018933 [0,0,1,1,0,0|1,1,0]=4 110 B13R2.155 OC1=CC2=C(OCC(N2)=O)C=C1 ACS017342 [0,0,1,1,0,0|2,0,0]=4 111 B13R2.155 c1cc2c(cc1N)NC(=O)CO2 ACS015409 [0,0,1,1,0,0|2,0,0]=4 112 B13R2.5179 OC1=CC=CC2=C1OCC(N2)=O ACS017347 [0,0,1,1,0,0|2,0,0]=4 113 B13R2.611 FC1=C2C=CNC2=C(C=C1)CO ACF022142 [0,0,1,1,0,0|2,0,0]=4 114 B13R2.2136 FC=1C=C2C(=CNC2=CC1)C=O ACF022069 [0,0,1,1,0,0|2,0,0]=4 115 B11R1.23 ClC=1C=C(C(=O)NN)C=CC1 ACS014064 [0,0,1,0,1,0|1,1,0]=4 116 B11R1.23 ClC=1C=C(C(=O)OO)C=CC1 ACS011392 [0,0,1,0,1,0|1,1,0]=4 117 B11R1.23 FC=1C=C(C(=O)OC)C=CC1 ACF012847 [0,0,1,0,1,0|2,0,0]=4 118 B11R1.23 FC=1C=C(C=CC1)C(CC)=O ACF014611 [0,0,1,0,1,0|2,0,0]=4 119 B13R2.369 CC1OC2=C(NC1=O)C=CC=C2 ACS023948 [1,0,0,0,0,1|2,0,0]=4 120 B13R2.3683 BrC=1C=C2C=CC(NC2=CC1)=O ACS017355 [1,0,0,0,0,1|1,1,0]=4 121 B13R2.3683 BrC=1C=C2C=NC(NC2=CC1)=O ACS023890 [1,0,0,0,0,1|0,1,1]=4 122 B13R2.3683 BrC=1C=C2CCC(NC2=CC1)=O ACS023892 [1,0,0,0,0,1|1,1,0]=4 123 B13R2.3683 BrC=1C=CC2=C(OCC(N2)=O)C1 ACS018796 [1,0,0,0,0,1|1,1,0]=4 124 B13R2.3683 FC=1C=C2CCC(NC2=CC1)=O ACF017388 [1,0,0,0,0,1|1,0,0]=3 125 B13R2.3683 FC=1C=CC2=C(OCC(N2)=O)C1 ACF019142 [1,0,0,0,0,1|1,0,0]=3 126 B13R2.3683 NC=1C=C2C=CC(NC2=CC1)=O ACS019131 [1,0,0,0,0,1|2,0,0]=4 127 B13R2.3683 NC=1C=C2N=CC(NC2=CC1)=O ACS020816 [1,0,0,0,0,1|1,0,1]=4 128 B13R2.3683 OC=1C=CC2=C(OCC(N2)=O)C1 ACS019136 [1,0,0,0,0,1|2,0,0]=4