0 B12R2.612 BrC1=CC=C2C(=C1)NN=C2I 33041 [0,0,0,0,0,0|1,1,0]=2 1 B12R2.612 BrC1=CC=C2C(Br)=CNC2=C1 8325 [0,0,0,0,0,0|2,1,0]=3 2 B12R2.612 BrC1=CN=C2C(I)=CNC2=C1 26775 [0,0,0,0,0,0|3,1,0]=4 3 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 8850 [0,0,0,0,0,0|3,0,1]=4 4 B12R2.612 CC1=CC=C2C(N)=NNC2=N1 16061 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 32472 [0,0,0,0,0,0|3,1,0]=4 6 B12R2.612 CC1=CSC2=C1C=CC(Br)=C2 32447 [0,0,0,0,0,0|3,1,0]=4 7 B12R2.612 CC1=CSC2=C1C=CC(Cl)=C2 33021 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.612 CC1=NNC2=C1C=NC(Br)=C2 32592 [0,0,0,0,0,0|2,1,0]=3 9 B12R2.612 CC1=NNC2=C1C=NC(Cl)=C2 32593 [0,0,0,0,0,0|2,0,0]=2 10 B12R2.612 CC1=NNC2=CC(Br)=CC=C21 28047 [0,0,0,0,0,0|1,1,0]=2 11 B12R2.612 CC1=NNC2=CC(Cl)=CC=C21 32530 [0,0,0,0,0,0|1,0,0]=1 12 B12R2.612 CC1=NNC2=CC(F)=CC=C21 20302 [0,0,0,0,0,0|1,1,0]=2 13 B12R2.612 CC1=NNC2=CC(I)=CC=C21 32529 [0,0,0,0,0,0|1,1,0]=2 14 B12R2.612 CC1=NNC2=CC(N)=CC=C21 15631 [0,0,0,0,0,0|2,0,0]=2 15 B12R2.612 CC1=NNC2=CC(O)=CC=C21 18073 [0,0,0,0,0,0|2,0,0]=2 16 B12R2.612 CC1=NNC2=NC(Br)=CC=C12 32579 [0,0,0,0,0,0|2,1,0]=3 17 B12R2.612 CC1=NNC2=NC(Cl)=CC=C12 32577 [0,0,0,0,0,0|2,0,0]=2 18 B12R2.612 CC1=NNC2=NC(F)=CC=C12 32576 [0,0,0,0,0,0|2,1,0]=3 19 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 24259 [0,0,0,0,0,0|2,1,0]=3 20 B12R2.612 CC1=NOC2=C1C=CC(Cl)=C2 26079 [0,0,0,0,0,0|2,0,0]=2 21 B12R2.612 CN1C=CC2=CC(Cl)=CC=C21 16045 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.612 CN1N=CC2=CC(N)=CC=C21 20587 [0,0,0,0,0,0|4,0,0]=4 23 B12R2.612 CN1N=NC2=C1C=CC(Br)=C2 27933 [0,0,0,0,0,0|2,1,1]=4 24 B12R2.612 ClC1=CC2=C(C=N1)C(I)=NN2 34657 [0,0,0,0,0,0|2,0,0]=2 25 B12R2.612 ClC1=CC=C2C(=C1)NN=C2Br 33049 [0,0,0,0,0,0|1,0,0]=1 26 B12R2.612 ClC1=CC=C2C(=C1)NN=C2I 33050 [0,0,0,0,0,0|1,0,0]=1 27 B12R2.612 ClC1=CC=C2C(Br)=NNC2=N1 33054 [0,0,0,0,0,0|2,0,0]=2 28 B12R2.612 ClC1=NNC2=CC(Br)=CC=C21 20688 [0,0,0,0,0,0|1,1,0]=2 29 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 27620 [0,0,0,0,0,0|2,1,0]=3 30 B12R2.612 Cn1ncc2cc(Br)ccc21 16382 [0,0,0,0,0,0|3,1,0]=4 31 B12R2.612 FC1=CC=C2C(=C1)NN=C2Br 33034 [0,0,0,0,0,0|1,1,0]=2 32 B12R2.612 FC1=CC=C2C(=C1)NN=C2I 33035 [0,0,0,0,0,0|1,1,0]=2 33 B12R2.612 NC1=CC=C2C(=C1)NN=C2Br 23041 [0,0,0,0,0,0|2,0,0]=2 34 B12R2.612 NC1=CC=C2C(=C1)NN=C2Cl 23042 [0,0,0,0,0,0|2,0,0]=2 35 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 14476 [0,0,0,0,0,0|3,0,1]=4 36 B12R2.612 NC1=CC=C2C(=O)NCC2=C1 25145 [0,0,0,0,0,0|2,0,2]=4 37 B12R2.612 NC1=CC=C2C(=O)OCC2=C1 25214 [0,0,0,0,0,0|3,0,1]=4 38 B12R2.612 NC1=NNC2=C1C=NC(Cl)=C2 32991 [0,0,0,0,0,0|2,0,0]=2 39 B12R2.612 NC1=NNC2=CC(Br)=CC=C21 17937 [0,0,0,0,0,0|1,1,0]=2 40 B12R2.612 NC1=NNC2=CC(Br)=CN=C21 26738 [0,0,0,0,0,0|2,1,0]=3 41 B12R2.612 NC1=NNC2=CC(Cl)=CC=C21 32564 [0,0,0,0,0,0|1,0,0]=1 42 B12R2.612 NC1=NNC2=NC(Cl)=CC=C12 32584 [0,0,0,0,0,0|2,0,0]=2 43 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 8853 [0,0,0,0,0,0|2,1,1]=4 44 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 2250 [0,0,0,0,0,0|2,0,1]=3 45 B12R2.612 O=C1CCC2=CC(F)=CC=C12 2388 [0,0,0,0,0,0|2,1,1]=4 46 B12R2.612 O=C1CCC2=CC(I)=CC=C12 17862 [0,0,0,0,0,0|2,1,1]=4 47 B12R2.612 O=C1CCC2=CC(O)=CC=C12 8857 [0,0,0,0,0,0|3,0,1]=4 48 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 17998 [0,0,0,0,0,0|2,1,1]=4 49 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 17996 [0,0,0,0,0,0|2,0,1]=3 50 B12R2.612 O=C1COC2=C1C=CC(I)=C2 22336 [0,0,0,0,0,0|2,1,1]=4 51 B12R2.612 O=C1COC2=C1C=CC(O)=C2 28015 [0,0,0,0,0,0|3,0,1]=4 52 B12R2.612 O=C1NCC2=CC(Br)=CC=C12 35478 [0,0,0,0,0,0|1,1,2]=4 53 B12R2.612 O=C1NCC2=CC(F)=CC=C12 31701 [0,0,0,0,0,0|1,1,2]=4 54 B12R2.612 O=C1NCc2cc(O)ccc21 31625 [0,0,0,0,0,0|2,0,2]=4 55 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 20699 [0,0,0,0,0,0|2,1,1]=4 56 B12R2.612 OC1=NOC2=C1C=CC(Cl)=C2 11268 [0,0,0,0,0,0|1,0,0]=1 57 B11R2.1 BrC1=CNC2=CC=CC=C12 11087 [1,0,0,0,0,0|2,0,0]=3 58 B11R2.1 BrC1=CNC2=CN=CC=C12 15871 [1,0,0,0,0,0|3,0,0]=4 59 B11R2.1 BrC1=CNC2=NC=CC=C12 14707 [1,0,0,0,0,0|3,0,0]=4 60 B11R2.1 BrC1=COC2=C1C=CC=C2 28021 [1,0,0,0,0,0|3,0,0]=4 61 B11R2.1 BrC1=CSC2=C1C=CC=C2 13106 [1,0,0,0,0,0|3,0,0]=4 62 B11R2.1 BrC1=NN=C2C=CC=CN12 33798 [1,0,0,0,0,0|2,0,1]=4 63 B11R2.1 BrC1=NNC2=C1C=NC=C2 14717 [1,0,0,0,0,0|2,0,0]=3 64 B11R2.1 BrC1=NNC2=CC=CC=C21 11861 [1,0,0,0,0,0|1,0,0]=2 65 B11R2.1 BrC1=NNC2=CC=CN=C21 14719 [1,0,0,0,0,0|2,0,0]=3 66 B11R2.1 BrC1=NNC2=CN=CC=C21 32999 [1,0,0,0,0,0|2,0,0]=3 67 B11R2.1 BrC1=NNC2=NC=CC=C12 32566 [1,0,0,0,0,0|2,0,0]=3 68 B11R2.1 BrC1=NNC2=NC=CN=C12 33011 [1,0,0,0,0,0|3,0,0]=4 69 B11R2.1 CC1=CCC2=CC=CC=C12 15081 [1,0,0,0,0,0|3,0,0]=4 70 B11R2.1 CC1=CNC2=C1C=NC=C2 34831 [1,0,0,0,0,0|3,0,0]=4 71 B11R2.1 CC1=CNC2=CC=CC=C12 7505 [1,0,0,0,0,0|2,0,0]=3 72 B11R2.1 CC1=CNC2=NC=CC=C12 19349 [1,0,0,0,0,0|3,0,0]=4 73 B11R2.1 CC1=CSC2=C1C=CC=C2 13547 [1,0,0,0,0,0|3,0,0]=4 74 B11R2.1 CC1=NNC2=C1C=NC=C2 32587 [1,0,0,0,0,0|2,0,0]=3 75 B11R2.1 CC1=NNC2=CC=CC=C21 7820 [1,0,0,0,0,0|1,0,0]=2 76 B11R2.1 CC1=NNC2=CC=CN=C21 33375 [1,0,0,0,0,0|2,0,0]=3 77 B11R2.1 CC1=NNC2=CN=CC=C21 33379 [1,0,0,0,0,0|2,0,0]=3 78 B11R2.1 CC1=NNC2=NC=CC=C12 32568 [1,0,0,0,0,0|2,0,0]=3 79 B11R2.1 CC1=NNC2=NC=CN=C12 33392 [1,0,0,0,0,0|3,0,0]=4 80 B11R2.1 CC1CNC2=CC=CC=C21 15858 [1,0,0,0,0,0|2,0,1]=4 81 B11R2.1 CN1N=NC2=C1C=CC=C2 28190 [1,0,0,0,0,0|2,0,1]=4 82 B11R2.1 ClC1=CNC2=CC=CC=C12 25672 [1,0,0,0,0,0|2,0,0]=3 83 B11R2.1 ClC1=CNC2=NC=CC=C12 14740 [1,0,0,0,0,0|3,0,0]=4 84 B11R2.1 ClC1=NOC2=C1C=CC=C2 8716 [1,0,0,0,0,0|2,0,0]=3 85 B11R2.1 ClC1=NSC2=C1C=CC=C2 22324 [1,0,0,0,0,0|2,0,0]=3 86 B11R2.1 IC1=CNC2=NC=CC=C12 16589 [1,0,0,0,0,0|3,0,0]=4 87 B11R2.1 IC1=NNC2=CC=CC=C21 11868 [1,0,0,0,0,0|1,0,0]=2 88 B11R2.1 IC1=NNC2=CC=CN=C21 33374 [1,0,0,0,0,0|2,0,0]=3 89 B11R2.1 IC1=NNC2=CN=CC=C21 33378 [1,0,0,0,0,0|2,0,0]=3 90 B11R2.1 IC1=NNC2=NC=CC=C12 32567 [1,0,0,0,0,0|2,0,0]=3 91 B11R2.1 NC1=NCc2ccccc21 31698 [1,0,0,0,0,0|2,0,0]=3 92 B11R2.1 NC1=NNC2=C1C=NC=C2 32586 [1,0,0,0,0,0|2,0,0]=3 93 B11R2.1 NC1=NNC2=CC=CC=C21 11848 [1,0,0,0,0,0|1,0,0]=2 94 B11R2.1 NC1=NNC2=CN=CC=C21 33377 [1,0,0,0,0,0|2,0,0]=3 95 B11R2.1 NC1=NNC2=NC=CC=C12 18838 [1,0,0,0,0,0|2,0,0]=3 96 B11R2.1 NC1=NNC2=NC=CN=C12 33391 [1,0,0,0,0,0|3,0,0]=4 97 B11R2.1 NC1=NOC2=C1C=CC=C2 14511 [1,0,0,0,0,0|2,0,0]=3 98 B11R2.1 NN1N=NC2=C1C=CC=C2 19954 [1,0,0,0,0,0|2,0,1]=4 99 B11R2.1 O=C1CCC2=CC=CC=C12 5339 [1,0,0,0,0,0|2,0,1]=4 100 B11R2.1 O=C1COC2=C1C=CC=C2 7023 [1,0,0,0,0,0|2,0,1]=4 101 B11R2.1 O=C1CSC2=C1C=CC=C2 23797 [1,0,0,0,0,0|2,0,1]=4 102 B11R2.1 O=C1NCC2=CC=CC=C12 25108 [1,0,0,0,0,0|1,0,2]=4 103 B11R2.1 O=C1NNC2=CC=CC=C12 28083 [1,0,0,0,0,0|0,0,2]=3 104 B11R2.1 O=C1NSC2=C1C=CC=C2 15685 [1,0,0,0,0,0|1,0,2]=4 105 B11R2.1 O=C1OCC2=CC=CC=C12 22169 [1,0,0,0,0,0|2,0,1]=4 106 B11R2.1 O=C1SSC2=C1C=CC=C2 32197 [1,0,0,0,0,0|2,0,1]=4 107 B11R2.1 OC1=CNC2=CC=CC=C12 7264 [1,0,0,0,0,0|1,0,0]=2 108 B11R2.1 OC1=NOC2=C1C=CC=C2 27626 [1,0,0,0,0,0|1,0,0]=2 109 B11R2.1 ON1N=NC2=C1C=CC=C2 12739 [1,0,0,0,0,0|1,0,1]=3 110 B11R2.1 ON1N=NC2=C1C=CC=C2 35769 [1,0,0,0,0,0|1,0,1]=3 111 B11R2.1 ON1N=NC2=C1C=CC=C2 9767 [1,0,0,0,0,0|1,0,1]=3 112 B11R2.1 On1nnc2cccnc21 12723 [1,0,0,0,0,0|2,0,1]=4 113 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 28003 [1,0,0,0,0,0|2,1,0]=4 114 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 27849 [1,0,0,0,0,0|2,1,0]=4 115 B11R2.36 BrC1=CC2=C(C=NN2)C=N1 28066 [1,0,0,0,0,0|1,1,0]=3 116 B11R2.36 BrC1=CC2=CN=CN2C=C1 35196 [1,0,0,0,0,0|2,1,0]=4 117 B11R2.36 BrC1=CC=C2C=CNC2=C1 1662 [1,0,0,0,0,0|1,1,0]=3 118 B11R2.36 BrC1=CC=C2C=CNC2=N1 18671 [1,0,0,0,0,0|2,1,0]=4 119 B11R2.36 BrC1=CC=C2C=NNC2=C1 34367 [1,0,0,0,0,0|0,1,0]=2 120 B11R2.36 BrC1=CC=C2C=NNC2=N1 32575 [1,0,0,0,0,0|1,1,0]=3 121 B11R2.36 BrC1=CC=C2CCNC2=C1 22223 [1,0,0,0,0,0|1,1,1]=4 122 B11R2.36 BrC1=CC=C2CCNC2=C1 8320 [1,0,0,0,0,0|1,1,1]=4 123 B11R2.36 BrC1=CC=C2NN=CC2=C1 15628 [1,0,0,0,0,0|2,1,0]=4 124 B11R2.36 BrC1=CN=C2C=CNC2=C1 17426 [1,0,0,0,0,0|2,1,0]=4 125 B11R2.36 BrC1=CN=C2C=NNC2=C1 32997 [1,0,0,0,0,0|1,1,0]=3 126 B11R2.36 CC1=CC2=C(C=C1)N=CN2 7666 [1,0,0,0,0,0|3,0,0]=4 127 B11R2.36 CC1=CC2=C(C=CS2)C=C1 15767 [1,0,0,0,0,0|3,0,0]=4 128 B11R2.36 CC1=CC=C2C=CNC2=C1 7240 [1,0,0,0,0,0|2,0,0]=3 129 B11R2.36 CC1=CC=C2C=NNC2=N1 33056 [1,0,0,0,0,0|2,0,0]=3 130 B11R2.36 CC1=CC=C2NN=CC2=C1 7832 [1,0,0,0,0,0|3,0,0]=4 131 B11R2.36 ClC1=CC2=C(C=C1)N=CN2 7649 [1,0,0,0,0,0|2,0,0]=3 132 B11R2.36 ClC1=CC2=C(C=C1)N=CS2 31808 [1,0,0,0,0,0|3,0,0]=4 133 B11R2.36 ClC1=CC2=C(C=C1)OC=C2 28012 [1,0,0,0,0,0|3,0,0]=4 134 B11R2.36 ClC1=CC2=C(C=C1)OC=N2 8712 [1,0,0,0,0,0|2,0,1]=4 135 B11R2.36 ClC1=CC2=C(C=C1)OCO2 3620 [1,0,0,0,0,0|3,0,0]=4 136 B11R2.36 ClC1=CC2=C(C=C1)SC=N2 21704 [1,0,0,0,0,0|2,0,1]=4 137 B11R2.36 ClC1=CC2=C(C=CO2)C=C1 32456 [1,0,0,0,0,0|2,0,0]=3 138 B11R2.36 ClC1=CC2=C(C=CS2)C=C1 32442 [1,0,0,0,0,0|2,0,0]=3 139 B11R2.36 ClC1=CC2=C(C=NN2)C=N1 26267 [1,0,0,0,0,0|1,0,0]=2 140 B11R2.36 ClC1=CC=C2C=CNC2=C1 1669 [1,0,0,0,0,0|1,0,0]=2 141 B11R2.36 ClC1=CC=C2C=CNC2=N1 18673 [1,0,0,0,0,0|2,0,0]=3 142 B11R2.36 ClC1=CC=C2C=CSC2=N1 32502 [1,0,0,0,0,0|3,0,0]=4 143 B11R2.36 ClC1=CC=C2C=NNC2=C1 20592 [1,0,0,0,0,0|0,0,0]=1 144 B11R2.36 ClC1=CC=C2C=NNC2=N1 28073 [1,0,0,0,0,0|1,0,0]=2 145 B11R2.36 ClC1=CC=C2CNCC2=C1 18083 [1,0,0,0,0,0|1,0,2]=4 146 B11R2.36 ClC1=CC=C2CNCC2=C1 18084 [1,0,0,0,0,0|1,0,2]=4 147 B11R2.36 ClC1=CC=C2N=CNC2=N1 22839 [1,0,0,0,0,0|3,0,0]=4 148 B11R2.36 ClC1=CC=C2NC=CC2=C1 1668 [1,0,0,0,0,0|3,0,0]=4 149 B11R2.36 ClC1=CC=C2NCCC2=C1 2112 [1,0,0,0,0,0|3,0,0]=4 150 B11R2.36 ClC1=CN2C=NC=C2N=C1 20933 [1,0,0,0,0,0|3,0,0]=4 151 B11R2.36 ClC1=CN=C2C=CNC2=C1 15705 [1,0,0,0,0,0|2,0,0]=3 152 B11R2.36 ClC1=CN=C2C=CNC2=N1 20388 [1,0,0,0,0,0|3,0,0]=4 153 B11R2.36 ClC1=CN=C2C=NNC2=C1 32996 [1,0,0,0,0,0|1,0,0]=2 154 B11R2.36 ClC1=CN=C2C=NNC2=N1 33393 [1,0,0,0,0,0|2,0,0]=3 155 B11R2.36 ClC1=CN=C2NN=CC2=C1 32570 [1,0,0,0,0,0|3,0,0]=4 156 B11R2.36 ClC1=NC2=C(C=CN2)C=N1 17588 [1,0,0,0,0,0|3,0,0]=4 157 B11R2.36 ClC1=NC=C2C=CNC2=C1 23086 [1,0,0,0,0,0|2,0,0]=3 158 B11R2.36 ClC1=NC=C2C=NNC2=N1 23953 [1,0,0,0,0,0|2,0,0]=3 159 B11R2.36 ClC1=NC=C2NN=CC2=C1 28065 [1,0,0,0,0,0|3,0,0]=4 160 B11R2.36 FC1=CC2=C(C=C1)N=CN2 6519 [1,0,0,0,0,0|2,1,0]=4 161 B11R2.36 FC1=CC2=C(C=CS2)C=C1 34529 [1,0,0,0,0,0|2,1,0]=4 162 B11R2.36 FC1=CC=C2C=CNC2=C1 1682 [1,0,0,0,0,0|1,1,0]=3 163 B11R2.36 FC1=CC=C2C=CNC2=N1 25372 [1,0,0,0,0,0|2,1,0]=4 164 B11R2.36 FC1=CC=C2C=NNC2=C1 12467 [1,0,0,0,0,0|0,1,0]=2 165 B11R2.36 FC1=CC=C2CCNC2=C1 34355 [1,0,0,0,0,0|1,1,1]=4 166 B11R2.36 IC1=CC=C2C=NNC2=C1 18081 [1,0,0,0,0,0|0,1,0]=2 167 B11R2.36 IC1=CC=C2NN=CC2=C1 20575 [1,0,0,0,0,0|2,1,0]=4 168 B11R2.36 IC1=CN=C2C=CNC2=C1 26835 [1,0,0,0,0,0|2,1,0]=4 169 B11R2.36 NC1=CC2=C(C=C1)C=NO2 24258 [1,0,0,0,0,0|2,0,0]=3 170 B11R2.36 NC1=CC2=C(C=C1)N=CN2 20258 [1,0,0,0,0,0|3,0,0]=4 171 B11R2.36 NC1=CC2=C(C=CS2)C=C1 34225 [1,0,0,0,0,0|3,0,0]=4 172 B11R2.36 NC1=CC=C2C=CNC2=C1 7311 [1,0,0,0,0,0|2,0,0]=3 173 B11R2.36 NC1=CC=C2C=NNC2=C1 20593 [1,0,0,0,0,0|1,0,0]=2 174 B11R2.36 NC1=CC=C2NN=CC2=C1 8628 [1,0,0,0,0,0|3,0,0]=4 175 B11R2.36 NC1=CN=C2C=CNC2=C1 26834 [1,0,0,0,0,0|3,0,0]=4 176 B11R2.36 OC1=CC2=C(C=CO2)C=C1 28025 [1,0,0,0,0,0|3,0,0]=4 177 B11R2.36 OC1=CC2=C(C=CS2)C=C1 33018 [1,0,0,0,0,0|3,0,0]=4 178 B11R2.36 OC1=CC=C2C=CNC2=C1 7261 [1,0,0,0,0,0|2,0,0]=3 179 B11R2.36 OC1=CC=C2C=NNC2=C1 15662 [1,0,0,0,0,0|1,0,0]=2 180 B11R2.36 OC1=CC=C2NN=CC2=C1 15661 [1,0,0,0,0,0|3,0,0]=4 181 B11R2.36 OC1=CN=C2C=CNC2=C1 26986 [1,0,0,0,0,0|3,0,0]=4 182 B13R2.662 CC1=CC=C2C(C=O)=CNC2=C1 7241 [0,1,0,0,0,0|2,0,1]=4 183 B13R2.662 N#CC1=NNC2=CC(Br)=CC=C21 7813 [0,1,0,0,0,0|1,1,0]=3 184 B13R2.662 N#CC1=NNC2=CC(F)=CC=C21 34546 [0,1,0,0,0,0|1,1,0]=3 185 B13R2.662 O=CC1=CNC2=CC(Br)=CC=C12 7691 [0,1,0,0,0,0|1,1,1]=4 186 B13R2.662 O=CC1=CNC2=CC(Cl)=CC=C12 7693 [0,1,0,0,0,0|1,0,1]=3 187 B13R2.662 O=CC1=CNC2=CC(F)=CC=C12 7269 [0,1,0,0,0,0|1,1,1]=4 188 B13R2.662 O=CC1=NNC2=CC(Br)=CC=C21 7806 [0,1,0,0,0,0|0,1,1]=3 189 B13R2.2130 COC1=CC=C2C(=C1)NN=C2C 32531 [0,1,0,0,0,0|2,0,0]=3 190 B13R2.5180 CC1=NNC2=C(F)C(F)=CC=C12 32540 [0,1,0,0,0,0|1,1,0]=3 191 B13R2.5187 CN1N=C(Br)C2=CC=C(N)C=C21 22113 [0,1,0,0,0,0|2,0,0]=3 192 B13R2.5187 CN1N=C(N)C2=CC=C(Cl)N=C21 32569 [0,1,0,0,0,0|2,0,0]=3 193 B13R2.5187 CN1N=C(N)C2=CC=C(O)C=C21 34752 [0,1,0,0,0,0|2,0,0]=3 194 B13R2.5187 O=C1OC(=O)C2=CC(Cl)=CC=C12 12512 [0,1,0,0,0,0|2,0,1]=4 195 B13R2.5190 O=C1NC2=CC(Br)=CC=C2C1=O 29201 [0,1,0,0,0,0|1,1,1]=4 196 B13R2.5190 O=C1NC2=CC(Cl)=CC=C2C1=O 13996 [0,1,0,0,0,0|1,0,1]=3 197 B13R2.5190 O=C1NC2=CC(F)=CC=C2C1=O 20320 [0,1,0,0,0,0|1,1,1]=4 198 B13R2.11634 CC1=NNC2=CC(F)=C(Br)C=C21 22062 [0,1,0,0,0,0|1,1,0]=3 199 B13R2.11634 FC1=C(Br)C=C2C(=C1)NN=C2I 34519 [0,1,0,0,0,0|1,1,0]=3 200 B13R2.11634 O=C1NCC2=CC(Cl)=C(I)C=C12 34692 [0,1,0,0,0,0|1,0,2]=4 201 B13R2.11642 CC1=CC(C)=C2C(N)=NNC2=N1 32987 [0,1,0,0,0,0|3,0,0]=4 202 B13R2.11642 CC1=NNC2=CC(Br)=CC(F)=C21 32541 [0,1,0,0,0,0|1,1,0]=3 203 B13R2.11642 CC1=NNC2=NC(Cl)=NC(Cl)=C12 35800 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 22351 [0,0,1,0,0,0|2,0,1]=4 205 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 23893 [0,0,1,0,0,0|2,0,1]=4 206 B11R1.22 CC1=CC=C([C@H](O)CN)C=C1 19376 [0,0,1,0,0,0|2,0,1]=4 207 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 36050 [0,0,1,0,0,0|2,0,1]=4 208 B11R1.22 CC[C@@H](O)C1=CC=C(Cl)C=C1 15579 [0,0,1,0,0,0|2,0,1]=4 209 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 3708 [0,0,1,0,0,0|2,0,1]=4 210 B11R1.22 N#C[C@H](O)C1=CC=C(Cl)C=C1 17478 [0,0,1,0,0,0|1,0,2]=4 211 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 16820 [0,0,1,0,0,0|1,1,1]=4 212 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 16752 [0,0,1,0,0,0|1,0,1]=3 213 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 22326 [0,0,1,0,0,0|1,1,1]=4 214 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 19370 [0,0,1,0,0,0|1,0,1]=3 215 B11R1.22 NCC(O)C1=CC=C(O)C=C1 18242 [0,0,1,0,0,0|2,0,1]=4 216 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 3743 [0,0,1,0,0,0|0,1,2]=4 217 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 3622 [0,0,1,0,0,0|0,0,2]=3 218 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 3483 [0,0,1,0,0,0|0,1,2]=4 219 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 3885 [0,0,1,0,0,0|1,0,2]=4 220 B11R1.22 NNC(=O)C1=CN=C(Cl)C=C1 18551 [0,0,1,0,0,0|1,0,2]=4 221 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 28432 [0,0,1,0,0,0|2,1,0]=4 222 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 3260 [0,0,1,0,0,0|2,0,1]=4 223 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 3372 [0,0,1,0,0,0|2,0,1]=4 224 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 12090 [0,0,1,0,0,0|2,0,1]=4 225 B11R1.24 OCCCC1=CC(Cl)=CC=C1 3101 [0,0,1,0,0,0|2,0,1]=4 226 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 28397 [0,0,1,0,0,0|2,0,1]=4 227 B11R1.37 COC1=C(NN)C=C(Cl)C=C1 4473 [0,0,1,0,0,0|2,0,1]=4 228 B11R1.37 N#CC1=C(C=O)C=CC(Cl)=C1 30970 [0,0,1,0,0,0|1,0,2]=4 229 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 29258 [0,0,1,0,0,0|2,0,1]=4 230 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 29273 [0,0,1,0,0,0|2,0,1]=4 231 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 13619 [0,0,1,0,0,0|2,0,1]=4 232 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 4207 [0,0,1,0,0,0|2,0,1]=4 233 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 36301 [0,0,1,0,0,0|1,0,1]=3 234 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 27374 [0,0,1,0,0,0|1,1,1]=4 235 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 29061 [0,0,1,0,0,0|2,0,1]=4 236 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 29614 [0,0,1,0,0,0|3,0,0]=4 237 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 4029 [0,0,1,0,0,0|2,1,0]=4 238 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 4570 [0,0,1,0,0,0|2,0,0]=3 239 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 33689 [0,0,1,0,0,0|3,0,0]=4 240 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 1327 [0,0,1,0,0,0|2,1,0]=4 241 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 10924 [0,0,1,0,0,0|3,0,0]=4 242 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=C1 35774 [0,0,1,0,0,0|3,0,0]=4 243 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 4719 [0,0,1,0,0,0|3,0,0]=4 244 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 15441 [0,0,1,0,0,0|3,0,0]=4 245 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 4567 [0,0,1,0,0,0|3,0,0]=4 246 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 1395 [0,0,1,0,0,0|3,0,0]=4 247 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 30572 [0,0,1,0,0,0|3,0,0]=4 248 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 4952 [0,0,1,0,0,0|2,0,0]=3 249 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 4030 [0,0,1,0,0,0|1,0,2]=4 250 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 18270 [0,0,1,0,0,0|3,0,0]=4 251 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 25784 [0,0,1,0,0,0|0,0,2]=3 252 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 20132 [0,0,1,0,0,0|1,1,1]=4 253 B11R1.166 NC1=C(B(O)O)C=CC(Cl)=C1 20178 [0,0,1,0,0,0|2,0,0]=3 254 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 13462 [0,0,1,0,0,0|1,1,0]=3 255 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 26435 [0,0,1,0,0,0|2,1,0]=4 256 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 11211 [0,0,1,0,0,0|1,0,0]=2 257 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 1323 [0,0,1,0,0,0|1,1,0]=3 258 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 22552 [0,0,1,0,0,0|1,1,0]=3 259 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Cl)=C1 4369 [0,0,1,0,0,0|2,0,1]=4 260 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 3109 [0,0,1,0,0,0|3,0,0]=4 261 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 4693 [0,0,1,0,0,0|3,0,0]=4 262 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 23542 [0,0,1,0,0,0|3,0,0]=4 263 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 3856 [0,0,1,0,0,0|2,1,0]=4 264 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 4028 [0,0,1,0,0,0|2,0,0]=3 265 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 1314 [0,0,1,0,0,0|2,1,0]=4 266 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 3586 [0,0,1,0,0,0|2,1,0]=4 267 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 21313 [0,0,1,0,0,0|2,0,0]=3 268 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)N=C1 18521 [0,0,1,0,0,0|3,0,0]=4 269 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 1370 [0,0,1,0,0,0|2,1,0]=4 270 B11R1.166 O=C(O)C1=C(Cl)C=C(I)C=C1 10153 [0,0,1,0,0,0|2,1,0]=4 271 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 4561 [0,0,1,0,0,0|3,0,0]=4 272 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 1225 [0,0,1,0,0,0|3,0,0]=4 273 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 1313 [0,0,1,0,0,0|2,1,0]=4 274 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 1374 [0,0,1,0,0,0|2,0,0]=3 275 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 1336 [0,0,1,0,0,0|2,1,0]=4 276 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 1384 [0,0,1,0,0,0|2,1,0]=4 277 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 2608 [0,0,1,0,0,0|3,0,0]=4 278 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 13466 [0,0,1,0,0,0|2,1,0]=4 279 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 4018 [0,0,1,0,0,0|2,0,0]=3 280 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 1389 [0,0,1,0,0,0|2,1,0]=4 281 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 27646 [0,0,1,0,0,0|3,0,0]=4 282 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 4010 [0,0,1,0,0,0|2,1,0]=4 283 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 3845 [0,0,1,0,0,0|2,0,0]=3 284 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 3493 [0,0,1,0,0,0|2,1,0]=4 285 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 3888 [0,0,1,0,0,0|2,1,0]=4 286 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl 4005 [0,0,1,0,0,0|3,0,0]=4 287 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F 17534 [0,0,1,0,0,0|3,0,0]=4 288 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 1806 [0,0,1,0,0,0|3,0,0]=4 289 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 5034 [0,0,1,0,0,0|3,0,0]=4 290 B11R1.166 OB(O)C1=C(O)C=C(Cl)C=C1 33194 [0,0,1,0,0,0|3,0,0]=4 291 B13R2.3683 BrC1=CC=C2N=C(I)N=CC2=C1 33957 [0,0,0,0,0,1|2,1,0]=4 292 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 33548 [0,0,0,0,0,1|3,0,0]=4 293 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 21567 [0,0,0,0,0,1|2,0,1]=4 294 B13R2.3683 ClC1=CC=C2N=C(Br)C=CC2=C1 25737 [0,0,0,0,0,1|3,0,0]=4 295 B13R2.3683 ClC1=CC=C2N=C(Cl)C=NC2=C1 7583 [0,0,0,0,0,1|2,0,1]=4 296 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=N1 14677 [0,0,0,0,0,1|2,1,0]=4 297 B13R2.3683 FC1=CC=C2N=C(Cl)N=CC2=C1 14302 [0,0,0,0,0,1|2,1,0]=4 298 B13R2.3683 NC1=CC2=CC=C(Cl)C=C2N=C1 21568 [0,0,0,0,0,1|2,0,1]=4 299 B13R2.3683 NC1=NC2=CC=C(Br)C=C2C=N1 16392 [0,0,0,0,0,1|2,1,0]=4 300 B13R2.3683 NC1=NC2=CC=C(Cl)C=C2C=N1 17841 [0,0,0,0,0,1|2,0,0]=3 301 B13R2.3683 NC1=NC2=CC=C(F)C=C2C=N1 14303 [0,0,0,0,0,1|2,1,0]=4 302 B13R2.3683 O=C1C=CC2=CC(Cl)=CC=C2N1 25736 [0,0,0,0,0,1|2,0,1]=4 303 B13R2.3683 O=C1C=NC2=CC(Cl)=CC=C2N1 18351 [0,0,0,0,0,1|1,0,2]=4 304 B13R2.3683 O=C1CCC2=CC(Cl)=CC=C2C1 17950 [0,0,0,0,0,1|2,0,1]=4 305 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2C1 18375 [0,0,0,0,0,1|2,0,1]=4 306 B13R2.3683 O=C1N=CC2=CC(Br)=CC=C2N1 35223 [0,0,0,0,0,1|1,1,1]=4 307 B13R2.3683 OC1=CC2=CC=C(Br)C=C2C=C1 2170 [0,0,0,0,0,1|2,1,0]=4 308 B13R2.3683 OC1=CC2=CC=C(Cl)C=C2C=C1 27928 [0,0,0,0,0,1|2,0,0]=3 309 B13R2.3683 OC1=CC2=CC=C(F)C=C2C=C1 27847 [0,0,0,0,0,1|2,1,0]=4 310 B13R2.5179 ClC1=CC=C2C(=C1)C=CN=C2Cl 29719 [0,0,0,0,0,1|2,0,0]=3 311 B13R2.5179 ClC1=CC=C2C(=C1)N=CN=C2Cl 17769 [0,0,0,0,0,1|1,0,1]=3 312 B13R2.5179 ClC1=CC=C2C(Cl)=CC=NC2=C1 5880 [0,0,0,0,0,1|2,0,1]=4 313 B13R2.5179 ClC1=NC=CC2=CC(Br)=CC=C21 23144 [0,0,0,0,0,1|2,1,0]=4 314 B13R2.5179 ClC1=NC=NC2=CC(Br)=CC=C21 14672 [0,0,0,0,0,1|1,1,1]=4 315 B13R2.5179 FC1=CC=C2C(=C1)N=CN=C2Cl 14306 [0,0,0,0,0,1|1,1,1]=4 316 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 12474 [0,0,0,0,0,1|3,0,0]=4 317 B13R2.5179 NC1=NC=CC2=CC(Br)=CC=C21 14693 [0,0,0,0,0,1|2,1,0]=4 318 B13R2.5179 NC1=NC=CC2=CC(Cl)=CC=C21 34797 [0,0,0,0,0,1|2,0,0]=3 319 B13R2.5179 NC1=NC=NC2=CC(F)=CC=C21 14307 [0,0,0,0,0,1|1,1,1]=4 320 B13R2.5179 O=C1CCCC2=CC(Cl)=CC=C12 13789 [0,0,0,0,0,1|2,0,1]=4 321 B13R2.5179 O=C1CCOC2=CC(Cl)=CC=C12 17925 [0,0,0,0,0,1|2,0,1]=4 322 B13R2.5179 OC1=CC=NC2=CC(Br)=CC=C12 16404 [0,0,0,0,0,1|1,1,1]=4 323 B10R1.1 C\N=C\C1=CC=C(Cl)N=C1 17586 [1,0,1,0,0,0|2,0,0]=4 324 B10R1.1 NCCC1=CC=C(Cl)C=C1 36132 [1,0,1,0,0,0|1,0,1]=4 325 B10R1.1 O\N=C\C1=CC=C(F)C=C1 24097 [1,0,1,0,0,0|1,1,0]=4 326 B10R1.1 O\N=C\C1=CC=C(F)C=C1 3479 [1,0,1,0,0,0|1,1,0]=4 327 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 3297 [1,0,1,0,0,0|1,0,1]=4 328 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 27544 [1,0,1,0,0,0|1,0,1]=4 329 B10R1.13 CC1=CC=C(C(=O)O)C=C1 15433 [1,0,1,0,0,0|2,0,0]=4 330 B10R1.13 CC1=CC=C(C(N)=O)C=C1 27569 [1,0,1,0,0,0|1,0,1]=4 331 B10R1.13 CC1=CC=C(C(O)=S)C=C1 10665 [1,0,1,0,0,0|2,0,0]=4 332 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 15222 [1,0,1,0,0,0|1,0,1]=4 333 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 14249 [1,0,1,0,0,0|1,0,1]=4 334 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 15221 [1,0,1,0,0,0|1,0,1]=4 335 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 14251 [1,0,1,0,0,0|1,0,1]=4 336 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 25824 [1,0,1,0,0,0|1,1,0]=4 337 B10R1.13 N=C(N)C1=CC=C(N)C=C1 13445 [1,0,1,0,0,0|2,0,0]=4 338 B10R1.13 N=C(N)C1=CC=C(O)C=C1 18174 [1,0,1,0,0,0|2,0,0]=4 339 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 3737 [1,0,1,0,0,0|0,1,1]=4 340 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 3619 [1,0,1,0,0,0|0,0,1]=3 341 B10R1.13 NC(=O)C1=CC=C(F)C=C1 3407 [1,0,1,0,0,0|0,1,1]=4 342 B10R1.13 NC(=O)C1=CC=C(N)C=C1 35461 [1,0,1,0,0,0|1,0,1]=4 343 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 10912 [1,0,1,0,0,0|0,1,0]=3 344 B10R1.13 NC(=S)C1=CC=C(N)C=C1 13560 [1,0,1,0,0,0|1,1,0]=4 345 B10R1.13 NC(=S)C1=CC=C(O)C=C1 13555 [1,0,1,0,0,0|1,1,0]=4 346 B10R1.13 NC1=CC=C(C(=O)O)C=C1 13422 [1,0,1,0,0,0|2,0,0]=4 347 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 14145 [1,0,1,0,0,0|1,0,1]=4 348 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 3741 [1,0,1,0,0,0|1,1,0]=4 349 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 8985 [1,0,1,0,0,0|1,0,0]=3 350 B10R1.13 O=C(O)C1=CC=C(F)C=C1 8221 [1,0,1,0,0,0|1,1,0]=4 351 B10R1.13 O=C(O)C1=CC=C(I)C=C1 3928 [1,0,1,0,0,0|1,1,0]=4 352 B10R1.13 O=C(O)C1=CC=C(O)C=C1 16819 [1,0,1,0,0,0|2,0,0]=4 353 B10R1.13 O=C(O)C1=CC=C(S)C=C1 6842 [1,0,1,0,0,0|2,0,0]=4 354 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 2600 [1,0,1,0,0,0|2,0,0]=4 355 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 10379 [1,0,1,0,0,0|2,0,0]=4 356 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 1798 [1,0,1,0,0,0|2,0,0]=4 357 B10R1.15 NCC(=O)C1=CC=CC=C1 10002 [1,0,1,0,0,0|1,0,1]=4 358 B10R1.15 NCC(=O)C1=CC=CC=C1 21792 [1,0,1,0,0,0|1,0,1]=4 359 B10R1.15 NCC(=O)C1=CC=CC=C1 3247 [1,0,1,0,0,0|1,0,1]=4 360 B10R1.15 NCC(O)C1=CC=CC=C1 44911 [1,0,1,0,0,0|1,0,1]=4 361 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 13836 [1,0,1,0,0,0|1,0,1]=4 362 B10R1.15 NC[C@H](O)C1=CC=CC=C1 14747 [1,0,1,0,0,0|1,0,1]=4 363 B10R1.15 NNC(=O)c1ccccc1 21535 [1,0,1,0,0,0|0,0,2]=4 364 B10R1.15 N\C(=N/O)C1=CC=CC=C1 12481 [1,0,1,0,0,0|2,0,0]=4 365 B10R1.10 O\N=C\C1=CC(Br)=CC=C1 3732 [1,0,1,0,0,0|1,1,0]=4 366 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 23457 [1,0,1,0,0,0|1,0,1]=4 367 B10R1.25 N#CC1=C(N)C=C(Cl)C=C1 20756 [1,0,1,0,0,0|0,0,2]=4 368 B10R1.25 NC1=C(C=O)C=CC(F)=C1 27192 [1,0,1,0,0,0|0,1,1]=4 369 B10R1.25 NC1=C(C=O)C=NC(Cl)=C1 22052 [1,0,1,0,0,0|1,0,1]=4 370 B10R1.25 NC1=C(CO)C=CC(Br)=C1 31328 [1,0,1,0,0,0|0,1,1]=4 371 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 16872 [1,0,1,0,0,0|1,0,1]=4 372 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 1435 [1,0,1,0,0,0|1,0,1]=4 373 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 22996 [1,0,1,0,0,0|1,0,1]=4 374 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 22142 [1,0,1,0,0,0|1,0,1]=4 375 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 9993 [1,0,1,0,0,0|1,0,1]=4 376 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 26669 [1,0,1,0,0,0|1,0,1]=4 377 B10R1.30 CNC1=C(O)C=CC(N)=C1 20872 [1,0,1,0,0,0|2,0,0]=4 378 B10R1.30 COC1=C(O)C=CC(Cl)=C1 3665 [1,0,1,0,0,0|2,0,0]=4 379 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 33422 [1,0,1,0,0,0|1,0,1]=4 380 B10R1.30 NNC1=C(Cl)C=CC(Cl)=C1 7525 [1,0,1,0,0,0|1,0,1]=4 381 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 4471 [1,0,1,0,0,0|1,0,1]=4 382 B10R1.30 O=CC1=CC(Cl)=CC=C1O 8203 [1,0,1,0,0,0|2,0,0]=4 383 B10R1.61 CC1=C(C(O)=S)C=CC=C1 10795 [1,0,1,0,0,0|2,0,0]=4 384 B10R1.61 CC1=CC=CC=C1C(=O)O 15431 [1,0,1,0,0,0|2,0,0]=4 385 B10R1.61 NC(=O)C1=CC=CC=C1N 13631 [1,0,1,0,0,0|0,0,2]=4 386 B10R1.61 NC1=C(B(O)O)C=CC=C1 1746 [1,0,1,0,0,0|2,0,0]=4 387 B10R1.61 NC1=C(B(O)O)C=CC=C1 9885 [1,0,1,0,0,0|2,0,0]=4 388 B10R1.61 NC1=C(C(=O)O)C=CC=N1 1216 [1,0,1,0,0,0|2,0,0]=4 389 B10R1.61 NC1=C(C(=O)O)C=CN=C1 16665 [1,0,1,0,0,0|2,0,0]=4 390 B10R1.61 NC1=C(C(=O)O)C=CN=C1 2420 [1,0,1,0,0,0|2,0,0]=4 391 B10R1.61 NC1=CC=CN=C1C(=O)O 2015 [1,0,1,0,0,0|2,0,0]=4 392 B10R1.61 NC1=CC=NC=C1C(=O)O 1214 [1,0,1,0,0,0|2,0,0]=4 393 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 3739 [1,0,1,0,0,0|2,0,0]=4 394 B10R1.61 O=C(O)C1=C(F)C=CC=C1 9650 [1,0,1,0,0,0|2,0,0]=4 395 B10R1.61 O=C(O)C1=C(I)C=CC=C1 3924 [1,0,1,0,0,0|2,0,0]=4 396 B10R1.61 O=C(O)C1=CC=CC=C1S 6841 [1,0,1,0,0,0|2,0,0]=4 397 B10R2.7 C1=CC2=C(C=C1)NC=N2 11074 [2,0,0,0,0,0|2,0,0]=4 398 B10R2.7 C1=CC2=C(C=C1)NN=N2 16004 [2,0,0,0,0,0|1,0,0]=3 399 B10R2.7 C1=CC2=C(C=C1)OC=C2 7003 [2,0,0,0,0,0|2,0,0]=4 400 B10R2.7 C1=CC2=C(C=C1)SC=C2 13545 [2,0,0,0,0,0|2,0,0]=4 401 B10R2.7 C1=CC2=C(C=N1)C=NN2 18028 [2,0,0,0,0,0|1,0,0]=3 402 B10R2.7 C1=CC2=CC=NC=C2N1 7678 [2,0,0,0,0,0|2,0,0]=4 403 B10R2.7 C1=CC2=CN=CC=C2N1 7676 [2,0,0,0,0,0|2,0,0]=4 404 B10R2.7 C1=CC2=CN=CN2C=C1 23158 [2,0,0,0,0,0|2,0,0]=4 405 B10R2.7 C1=CC2=NN=CN2C=C1 33799 [2,0,0,0,0,0|1,0,1]=4 406 B10R2.7 C1=CC=C2CC=CC2=C1 20728 [2,0,0,0,0,0|2,0,0]=4 407 B10R2.7 C1=CC=C2NCCC2=C1 7502 [2,0,0,0,0,0|1,0,1]=4 408 B10R2.7 C1=CC=C2NN=CC2=C1 15665 [2,0,0,0,0,0|0,0,0]=2 409 B10R2.7 C1=CN=C2C=CNC2=C1 7675 [2,0,0,0,0,0|2,0,0]=4 410 B10R2.7 C1=CN=C2C=NNC2=C1 19278 [2,0,0,0,0,0|1,0,0]=3 411 B10R2.7 C1=CN=C2NC=CC2=C1 7679 [2,0,0,0,0,0|2,0,0]=4 412 B10R2.7 C1=CN=C2NN=CC2=C1 25768 [2,0,0,0,0,0|1,0,0]=3 413 B10R2.7 C1=CN=C2NN=CC2=N1 33390 [2,0,0,0,0,0|2,0,0]=4 414 B10R2.7 C1=NC=C2C=NNC2=N1 23879 [2,0,0,0,0,0|2,0,0]=4 415 B10R2.7 C1=NC=C2NN=CC2=C1 33376 [2,0,0,0,0,0|1,0,0]=3 416 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 18183 [0,1,1,0,0,0|1,0,1]=4 417 B12R1.1703 NC[C@@H](O)C1=C(Cl)C=C(Cl)C=C1 19373 [0,1,1,0,0,0|1,0,1]=4 418 B12R1.1703 N\C(=N/O)C1=C(Cl)C=C(Cl)C=C1 31887 [0,1,1,0,0,0|2,0,0]=4 419 B12R1.226 O=C(O)CCC1=CC(Cl)=CC=C1 25814 [0,1,1,0,0,0|2,0,0]=4 420 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 3629 [0,1,1,0,0,0|2,0,0]=4 421 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 24655 [0,1,1,0,0,0|2,0,0]=4 422 B12R1.232 CC(=O)C1=C(N)C=C(Cl)C(Br)=C1 29247 [0,1,1,0,0,0|1,0,1]=4 423 B12R1.232 CC(=O)C1=C(N)C=C(Cl)C(F)=C1 29129 [0,1,1,0,0,0|1,0,1]=4 424 B12R1.232 CC1=CC(C(=O)O)=C(N)C=C1Cl 15932 [0,1,1,0,0,0|1,0,0]=3 425 B12R1.232 CC1=CC(N)=C(C(=O)O)C=C1C 28519 [0,1,1,0,0,0|2,0,0]=4 426 B12R1.232 NC1=C(C(=O)O)C=C(Br)C(Br)=C1 27557 [0,1,1,0,0,0|1,1,0]=4 427 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Br)=C1 19833 [0,1,1,0,0,0|1,1,0]=4 428 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Cl)=C1 4657 [0,1,1,0,0,0|1,0,0]=3 429 B12R1.232 NC1=C(C(=O)O)C=C(F)C(Cl)=C1 30560 [0,1,1,0,0,0|1,0,0]=3 430 B12R1.232 NC1=C(C(=O)O)C=C(F)C(F)=C1 4675 [0,1,1,0,0,0|1,1,0]=4 431 B12R1.232 NC1=CC(C(=O)O)=C(Cl)C=C1Cl 28514 [0,1,1,0,0,0|2,0,0]=4 432 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(F)=C1 1338 [0,1,1,0,0,0|2,0,0]=4 433 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Br)=C1 3556 [0,1,1,0,0,0|2,0,0]=4 434 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Cl)=C1 4615 [0,1,1,0,0,0|2,0,0]=4 435 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(F)=C1 1367 [0,1,1,0,0,0|2,0,0]=4 436 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 11856 [0,1,1,0,0,0|2,0,0]=4 437 B12R1.452 N#CC1=CC(N)=C(C(=O)O)C=C1 30630 [0,1,1,0,0,0|2,0,0]=4 438 B12R1.893 CC1=C(C)C(N)=C(C(=O)O)C=C1 4683 [0,1,1,0,0,0|2,0,0]=4 439 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F 30699 [0,1,1,0,0,0|1,1,0]=4 440 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1Cl 17205 [0,1,1,0,0,0|1,0,0]=3 441 B12R1.893 NC1=C(C(=O)O)C=CC(F)=C1F 28515 [0,1,1,0,0,0|1,1,0]=4 442 B12R1.893 O=C(O)C1=C(F)C(F)=C(Cl)C=C1 4744 [0,1,1,0,0,0|2,0,0]=4 443 B12R1.1000 NC1=C(C(=O)O)C(Cl)=CC(Cl)=C1 17204 [0,1,1,0,0,0|1,0,0]=3 444 B12R1.1000 NC1=C(C(=O)O)C(F)=CC(F)=C1 19803 [0,1,1,0,0,0|1,1,0]=4 445 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1Cl 18496 [0,1,1,0,0,0|2,0,0]=4 446 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1F 17575 [0,1,1,0,0,0|2,0,0]=4 447 B12R2.1 BrCC1=NNC2=NC=CC=C12 20679 [1,1,0,0,0,0|2,0,0]=4 448 B12R2.1 BrCC1=NOC2=C1C=CC=C2 26214 [1,1,0,0,0,0|2,0,0]=4 449 B12R2.1 N#CC1=CNC2=CC=CC=C12 7325 [1,1,0,0,0,0|2,0,0]=4 450 B12R2.1 N#CC1=NNC2=CC=CC=C21 11864 [1,1,0,0,0,0|1,0,0]=3 451 B12R2.1 N#CC1=NNC2=NC=CC=C12 29727 [1,1,0,0,0,0|2,0,0]=4 452 B12R2.1 O=CC1=CNC2=CC=CC=C12 7247 [1,1,0,0,0,0|1,0,1]=4 453 B12R2.1 O=CC1=NNC2=CC=CC=C21 11853 [1,1,0,0,0,0|0,0,1]=3 454 B12R2.1 OCC1=NNC2=CC=CC=C21 11866 [1,1,0,0,0,0|0,0,0]=2 455 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 7334 [1,1,0,0,0,0|2,0,0]=4 456 B12R2.18 CN1NC2=CC=CC=C2C1=O 27652 [1,1,0,0,0,0|0,0,2]=4 457 B12R2.18 O=C1NC2=CC=CC=C2C1=O 13609 [1,1,0,0,0,0|1,0,1]=4 458 B12R2.132 BrC1=CC=C2NC=C(Br)C2=C1 8321 [1,1,0,0,0,0|2,0,0]=4 459 B12R2.132 BrC1=CC=C2NN=C(I)C2=C1 33042 [1,1,0,0,0,0|1,0,0]=3 460 B12R2.132 BrC1=CN=C2NN=C(I)C2=C1 14859 [1,1,0,0,0,0|2,0,0]=4 461 B12R2.132 CC1=CC=C2NC=C(Br)C2=C1 8323 [1,1,0,0,0,0|2,0,0]=4 462 B12R2.132 CC1=CNC2=CC=C(F)C=C12 1686 [1,1,0,0,0,0|2,0,0]=4 463 B12R2.132 CC1=CNC2=CC=C(O)C=C12 21876 [1,1,0,0,0,0|2,0,0]=4 464 B12R2.132 CC1=NNC2=CC=C(Br)C=C21 7815 [1,1,0,0,0,0|1,0,0]=3 465 B12R2.132 CC1=NNC2=CC=C(Cl)C=C21 32533 [1,1,0,0,0,0|1,0,0]=3 466 B12R2.132 CC1=NNC2=CC=C(F)C=C21 28054 [1,1,0,0,0,0|1,0,0]=3 467 B12R2.132 CC1=NNC2=CC=C(I)C=C21 28052 [1,1,0,0,0,0|1,0,0]=3 468 B12R2.132 CC1=NNC2=CC=C(N)C=C21 7825 [1,1,0,0,0,0|1,0,0]=3 469 B12R2.132 CC1=NNC2=CC=C(O)C=C21 32538 [1,1,0,0,0,0|1,0,0]=3 470 B12R2.132 CC1=NNC2=CN=C(Cl)C=C21 33380 [1,1,0,0,0,0|2,0,0]=4 471 B12R2.132 CC1=NNC2=NC=C(Br)C=C12 18085 [1,1,0,0,0,0|2,0,0]=4 472 B12R2.132 CC1=NNC2=NC=C(F)C=C12 32578 [1,1,0,0,0,0|2,0,0]=4 473 B12R2.132 ClC1=CC=C2NC=C(Br)C2=C1 8326 [1,1,0,0,0,0|2,0,0]=4 474 B12R2.132 ClC1=CC=C2NN=C(Br)C2=C1 33046 [1,1,0,0,0,0|1,0,0]=3 475 B12R2.132 ClC1=CC=C2NN=C(I)C2=C1 16737 [1,1,0,0,0,0|1,0,0]=3 476 B12R2.132 ClC1=NNC2=CC=C(Br)C=C21 20690 [1,1,0,0,0,0|1,0,0]=3 477 B12R2.132 FC1=CC=C2NN=C(Br)C2=C1 33036 [1,1,0,0,0,0|1,0,0]=3 478 B12R2.132 FC1=CC=C2NN=C(I)C2=C1 33037 [1,1,0,0,0,0|1,0,0]=3 479 B12R2.132 FC1=CN=C2NN=C(I)C2=C1 33059 [1,1,0,0,0,0|2,0,0]=4 480 B12R2.132 NC1=CC=C2NN=C(Br)C2=C1 23040 [1,1,0,0,0,0|1,0,0]=3 481 B12R2.132 NC1=CC=C2NN=C(Cl)C2=C1 33052 [1,1,0,0,0,0|1,0,0]=3 482 B12R2.132 NC1=CNC2=CC=C(Br)C=C12 9446 [1,1,0,0,0,0|2,0,0]=4 483 B12R2.132 NC1=NNC2=CC=C(Br)C=C21 18573 [1,1,0,0,0,0|1,0,0]=3 484 B12R2.132 NC1=NNC2=CC=C(Br)N=C21 32995 [1,1,0,0,0,0|2,0,0]=4 485 B12R2.132 NC1=NNC2=CC=C(Cl)C=C21 32563 [1,1,0,0,0,0|1,0,0]=3 486 B12R2.132 NC1=NNC2=CC=C(F)C=C21 32560 [1,1,0,0,0,0|1,0,0]=3 487 B12R2.132 NC1=NNC2=CN=C(Cl)C=C21 33381 [1,1,0,0,0,0|2,0,0]=4 488 B12R2.132 NC1=NNC2=NC=C(Br)C=C12 32583 [1,1,0,0,0,0|2,0,0]=4 489 B12R2.132 NC1=NNC2=NC=C(Cl)C=C12 32581 [1,1,0,0,0,0|2,0,0]=4 490 B12R2.132 NC1=NNC2=NC=C(F)C=C12 32582 [1,1,0,0,0,0|2,0,0]=4 491 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 35091 [1,1,0,0,0,0|2,0,0]=4 492 B12R2.132 ON1N=NC2=C1C=C(Cl)C=C2 12743 [1,1,0,0,0,0|1,0,1]=4 493 B12R2.196 CC1=C2NC=C(Br)C2=CC=C1 8324 [1,1,0,0,0,0|2,0,0]=4 494 B12R2.196 CC1=NNC2=C(Br)C=CC=C12 28049 [1,1,0,0,0,0|1,0,0]=3 495 B12R2.196 CC1=NNC2=C(F)C=CC=C12 28046 [1,1,0,0,0,0|1,0,0]=3 496 B12R2.196 CC1=NNC2=C(N)C=CC=C12 32933 [1,1,0,0,0,0|1,0,0]=3 497 B12R2.196 ClC1=C2NC=C(Br)C2=CC=C1 7965 [1,1,0,0,0,0|2,0,0]=4 498 B12R2.196 ClC1=C2NN=C(Br)C2=CC=C1 33047 [1,1,0,0,0,0|1,0,0]=3 499 B12R2.196 ClC1=C2NN=C(I)C2=CC=C1 33048 [1,1,0,0,0,0|1,0,0]=3 500 B12R2.196 ClC1=NNC2=C(Br)C=CC=C12 33040 [1,1,0,0,0,0|1,0,0]=3 501 B12R2.196 FC1=C2NN=C(Br)C2=CC=C1 33032 [1,1,0,0,0,0|1,0,0]=3 502 B12R2.196 FC1=C2NN=C(I)C2=CC=C1 33033 [1,1,0,0,0,0|1,0,0]=3 503 B12R2.196 NC1=NNC2=C(Br)C=CC=C12 32561 [1,1,0,0,0,0|1,0,0]=3 504 B12R2.196 NC1=NNC2=C1C=NC=C2Br 32992 [1,1,0,0,0,0|2,0,0]=4 505 B12R2.203 BrC1=C2C(=CC=C1)NN=C2I 33043 [1,1,0,0,0,0|1,0,0]=3 506 B12R2.203 CC1=NNC2=C1C(Cl)=NC=C2 32591 [1,1,0,0,0,0|2,0,0]=4 507 B12R2.203 CC1=NNC2=C1C(N)=CC=C2 28072 [1,1,0,0,0,0|1,0,0]=3 508 B12R2.203 CC1=NNC2=C1C(O)=CC=C2 32534 [1,1,0,0,0,0|1,0,0]=3 509 B12R2.203 CC1=NNC2=CC=CC(Br)=C21 28048 [1,1,0,0,0,0|1,0,0]=3 510 B12R2.203 CC1=NNC2=CC=CC(Cl)=C21 32535 [1,1,0,0,0,0|1,0,0]=3 511 B12R2.203 CC1=NNC2=CC=CC(F)=C21 28053 [1,1,0,0,0,0|1,0,0]=3 512 B12R2.203 CC1=NNC2=CN=CC(Br)=C21 33386 [1,1,0,0,0,0|2,0,0]=4 513 B12R2.203 CC1=NNC2=CN=CC(Cl)=C21 33387 [1,1,0,0,0,0|2,0,0]=4 514 B12R2.203 CC1=NNC2=NC=CC(Cl)=C12 33057 [1,1,0,0,0,0|2,0,0]=4 515 B12R2.203 CC1=NNC2=NC=CC(I)=C12 32580 [1,1,0,0,0,0|2,0,0]=4 516 B12R2.203 ClC1=C2C(=CC=C1)NN=C2Br 33044 [1,1,0,0,0,0|1,0,0]=3 517 B12R2.203 ClC1=C2C(=CC=C1)NN=C2I 33045 [1,1,0,0,0,0|1,0,0]=3 518 B12R2.203 ClC1=NC=CC2=C1C(I)=NN2 28074 [1,1,0,0,0,0|2,0,0]=4 519 B12R2.203 ClC1=NNC2=CC=CC(Br)=C21 20680 [1,1,0,0,0,0|1,0,0]=3 520 B12R2.203 FC1=C2C(=CC=C1)NN=C2Br 33038 [1,1,0,0,0,0|1,0,0]=3 521 B12R2.203 FC1=C2C(=CC=C1)NN=C2I 33039 [1,1,0,0,0,0|1,0,0]=3 522 B12R2.203 NC1=C2C(=CC=N1)NN=C2I 16192 [1,1,0,0,0,0|2,0,0]=4 523 B12R2.203 NC1=NNC2=C1C(Br)=NC=C2 32990 [1,1,0,0,0,0|2,0,0]=4 524 B12R2.203 NC1=NNC2=C1C(Cl)=NC=C2 33373 [1,1,0,0,0,0|2,0,0]=4 525 B12R2.203 NC1=NNC2=CC=CC(Br)=C21 20681 [1,1,0,0,0,0|1,0,0]=3 526 B12R2.203 NC1=NNC2=CC=CC(Cl)=C21 32562 [1,1,0,0,0,0|1,0,0]=3 527 B12R2.203 NC1=NNC2=CC=CC(F)=C21 32559 [1,1,0,0,0,0|1,0,0]=3 528 B12R2.203 NC1=NNC2=CC=CC(I)=C21 32565 [1,1,0,0,0,0|1,0,0]=3 529 B12R2.203 NC1=NNC2=CN=CC(Br)=C21 33007 [1,1,0,0,0,0|2,0,0]=4 530 B12R2.203 NC1=NNC2=CN=CC(Cl)=C21 33008 [1,1,0,0,0,0|2,0,0]=4 531 B12R2.203 NC1=NNC2=CN=CC(F)=C21 33009 [1,1,0,0,0,0|2,0,0]=4 532 B12R2.2028 CN1C=C(Br)C2=CC=CC=C21 27908 [1,1,0,0,0,0|2,0,0]=4 533 B12R2.2028 CN1N=C(N)C2=CC=CN=C21 15809 [1,1,0,0,0,0|2,0,0]=4 534 B12R2.44 CCC1=CC=C2C=CNC2=C1 22663 [1,1,0,0,0,0|2,0,0]=4 535 B12R2.44 COC1=CC=C2C=CNC2=C1 1701 [1,1,0,0,0,0|2,0,0]=4 536 B12R2.44 COC1=CC=C2C=NNC2=N1 34387 [1,1,0,0,0,0|2,0,0]=4 537 B12R2.44 N#CC1=CC=C2C=CNC2=C1 7239 [1,1,0,0,0,0|2,0,0]=4 538 B12R2.44 O=CC1=CC=C2C=CNC2=C1 7176 [1,1,0,0,0,0|2,0,0]=4 539 B12R2.44 O=CC1=CC=C2C=NNC2=C1 23878 [1,1,0,0,0,0|1,0,0]=3 540 B12R2.44 OCC1=CC=C2C=CNC2=C1 7966 [1,1,0,0,0,0|2,0,0]=4 541 B12R2.82 CC1=C2NC=CC2=CC=C1F 11483 [1,1,0,0,0,0|1,1,0]=4 542 B12R2.82 CC1=CC=C2C=NNC2=C1Br 34378 [1,1,0,0,0,0|1,0,0]=3 543 B12R2.82 ClC1=CC=C2C=NNC2=C1Cl 28060 [1,1,0,0,0,0|0,0,0]=2 544 B12R2.82 FC1=CC=C2C=NNC2=C1F 34507 [1,1,0,0,0,0|0,1,0]=3 545 B12R2.82 NC1=CC=C2C=NNC2=C1Cl 28058 [1,1,0,0,0,0|1,0,0]=3 546 B12R2.100 CC1=C(Br)C=C2C=NNC2=C1 20589 [1,1,0,0,0,0|1,0,0]=3 547 B12R2.100 CC1=C(Br)C=C2NN=CC2=C1 20674 [1,1,0,0,0,0|0,1,0]=3 548 B12R2.100 CC1=C(O)C=C2C=NNC2=C1 23781 [1,1,0,0,0,0|1,0,0]=3 549 B12R2.100 ClC1=C(Br)C=C2C=CNC2=C1 25867 [1,1,0,0,0,0|1,0,0]=3 550 B12R2.100 ClC1=CC2=C(C=C1Cl)NC=N2 7653 [1,1,0,0,0,0|2,0,0]=4 551 B12R2.100 FC1=C(Br)C=C2NN=CC2=C1 18070 [1,1,0,0,0,0|0,1,0]=3 552 B12R2.100 FC1=C(Cl)C=C2NC=CC2=C1 7290 [1,1,0,0,0,0|1,0,0]=3 553 B12R2.100 FC1=C(F)C=C2NC=CC2=C1 1675 [1,1,0,0,0,0|1,1,0]=4 554 B12R2.100 FC1=CC2=C(C=C1Cl)NN=N2 2193 [1,1,0,0,0,0|1,0,0]=3 555 B12R2.100 NC1=C(F)C=C2NN=CC2=C1 23043 [1,1,0,0,0,0|0,1,0]=3 556 B12R2.100 OC1=C(F)C=C2C=NNC2=C1 28059 [1,1,0,0,0,0|1,0,0]=3 557 B12R2.246 BrC1=CC(Br)=C2C=CNC2=C1 22615 [1,1,0,0,0,0|1,1,0]=4 558 B12R2.246 CC1=C2C=CNC2=NC(Cl)=C1 30402 [1,1,0,0,0,0|2,0,0]=4 559 B12R2.246 ClC1=CC(Br)=C2C=CNC2=N1 19351 [1,1,0,0,0,0|2,0,0]=4 560 B12R2.246 ClC1=CC(Br)=C2NN=CC2=C1 32523 [1,1,0,0,0,0|2,0,0]=4 561 B12R2.246 ClC1=CC(Cl)=C2C=CNC2=C1 9375 [1,1,0,0,0,0|1,0,0]=3 562 B12R2.246 ClC1=CC(Cl)=C2C=CNC2=N1 19341 [1,1,0,0,0,0|2,0,0]=4 563 B12R2.246 ClC1=CC2=C(C=CN2)C(Cl)=N1 15466 [1,1,0,0,0,0|2,0,0]=4 564 B12R2.246 ClC1=CC2=C(C=CO2)C(Cl)=C1 34337 [1,1,0,0,0,0|2,0,0]=4 565 B12R2.246 ClC1=NC(Cl)=C2C=NNC2=N1 14623 [1,1,0,0,0,0|2,0,0]=4 566 B12R2.246 FC1=C2C=NNC2=CC(Br)=C1 28063 [1,1,0,0,0,0|0,1,0]=3 567 B12R2.246 FC1=CC(Br)=C2C=CNC2=C1 23229 [1,1,0,0,0,0|1,1,0]=4 568 B12R2.246 FC1=CC(Cl)=C2C=CNC2=C1 31692 [1,1,0,0,0,0|1,1,0]=4 569 B12R2.246 FC1=CC(F)=C2C=CNC2=C1 7179 [1,1,0,0,0,0|1,1,0]=4 570 B12R2.246 NC1=CC(Br)=C2C=CNC2=C1 20263 [1,1,0,0,0,0|2,0,0]=4 571 B12R2.246 OC1=CC(Br)=CC2=C1C=NN2 32526 [1,1,0,0,0,0|0,1,0]=3 572 B12R2.246 OC1=CC(Cl)=CC2=C1C=NN2 28071 [1,1,0,0,0,0|0,0,0]=2 573 B12R2.606 CC1=CC2=CC=C(Cl)C=C2N1 19921 [1,1,0,0,0,0|1,0,0]=3 574 B12R2.606 CC1=CC2=CC=C(F)C=C2N1 19920 [1,1,0,0,0,0|1,1,0]=4 575 B12R2.606 CC1=CC2=CC=C(O)C=C2N1 19945 [1,1,0,0,0,0|2,0,0]=4 576 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)N1 7651 [1,1,0,0,0,0|2,0,0]=4 577 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 1674 [1,1,0,0,0,0|1,0,1]=4 578 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 8642 [1,1,0,0,0,0|2,0,0]=4 579 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)S1 13573 [1,1,0,0,0,0|2,0,0]=4 580 B14R2.8235 ClC1=CC=C2N=C(Cl)N=C(Cl)C2=C1 23074 [0,1,0,0,0,1|2,0,0]=4 581 B14R2.8235 OC1=NC2=CC=C(F)C=C2C(O)=N1 14296 [0,1,0,0,0,1|1,1,0]=4 582 B14R2.8239 OC1=NC2=CC=C(Cl)C=C2N=C1O 15426 [0,1,0,0,0,1|1,0,1]=4 583 B14R2.29369 CN1C(=O)CNC2=CC(Cl)=CC=C21 34758 [0,1,0,0,0,1|1,0,1]=4 584 B14R2.28472 ClC1=NC=NC2=CC(Cl)=C(Cl)C=C21 31676 [0,1,0,0,0,1|1,0,1]=4 585 B14R2.29365 ClC1=CC=C2C(=C1)N=C(Cl)N=C2Cl 18745 [0,1,0,0,0,1|1,0,1]=4 586 B14R2.29365 NC1=NC2=CC(Br)=CC=C2C(O)=N1 27779 [0,1,0,0,0,1|0,1,1]=4 587 B14R2.29365 O=C1NC2=CC(Cl)=CC=C2C(=O)O1 12751 [0,1,0,0,0,1|1,0,1]=4 588 B14R2.29365 OC1=NC2=C(C=CC(Cl)=N2)C(O)=N1 23136 [0,1,0,0,0,1|1,0,1]=4 589 B14R2.152 COC1=CC=C2C(=C1)NN=C2C#N 7809 [0,2,0,0,0,0|2,0,0]=4 590 B14R2.152 COC1=CC=C2C(=C1)NN=C2C=O 7805 [0,2,0,0,0,0|1,0,1]=4 591 B14R2.300 O=C(O)C1=CNC2=CC(Br)=CC=C21 8304 [0,2,0,0,0,0|1,1,0]=4 592 B14R2.300 O=C(O)C1=CNC2=NC(Cl)=CC=C12 14911 [0,2,0,0,0,0|2,0,0]=4 593 B14R2.300 O=C(O)C1=NNC2=CC(Cl)=CC=C21 24877 [0,2,0,0,0,0|0,0,0]=2 594 B14R2.300 O=C(O)C1=NSC2=C1C=CC(Br)=C2 18561 [0,2,0,0,0,0|1,1,0]=4 595 B14R2.467 N#CCC1=CNC2=CC(Cl)=CC=C12 23894 [0,2,0,0,0,0|2,0,0]=4 596 B14R2.5719 CC1=NNC2=CC(B(O)O)=CC=C21 32810 [0,2,0,0,0,0|2,0,0]=4 597 B14R2.5719 CC1=NNC2=CC(C(=O)O)=CC=C21 32528 [0,2,0,0,0,0|2,0,0]=4 598 B14R2.5719 CC1=NNC2=CC([N+](=O)[O-])=CC=C21 9492 [0,2,0,0,0,0|2,0,0]=4 599 B14R2.5719 O=[N+]([O-])C1=CC=C2C(=C1)NN=C2Br 22111 [0,2,0,0,0,0|2,0,0]=4 600 B14R2.5719 O=[N+]([O-])C1=CC=C2C(=C1)NN=C2I 33053 [0,2,0,0,0,0|2,0,0]=4 601 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 27891 [0,0,1,1,0,0|1,0,1]=4 602 B12R2.24 ClC1=CC=C2N=CN=CC2=C1 14680 [0,0,1,1,0,0|2,0,0]=4 603 B12R2.1081 ClC1=C2N=CN=CC2=CC=C1 23036 [0,0,1,1,0,0|2,0,0]=4 604 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 11165 [0,0,1,0,0,1|2,0,0]=4 605 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 15026 [0,0,1,0,0,1|2,0,0]=4 606 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 4292 [0,0,1,0,0,1|2,0,0]=4