0 B14R2.8239 CC1=CC2=CC(N)=CC=C2NC1=O H-8547 [0,0,0,0,0,0|2,0,0]=2 1 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=N1 L19334 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 M15624 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.8239 OC1=NC2=CC=C(Cl)C=C2N=C1O P51549 [0,0,0,0,0,0|1,1,2]=4 4 B13R2.155 NC1=CC=C2N=CC(Br)=CC2=C1 O31508 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 I-9876 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.155 O=C1C=CC2=CC=C(F)C=C2N1 L18395 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.155 OC1=CC2=C(C=C1)C=NC(Cl)=C2 O29459 [1,0,0,0,0,0|2,1,0]=4 8 B13R2.369 BrC1=C(Br)C=C2C=CC=CC2=C1 G-7412 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.369 BrC1=CC2=CC=CC=C2N=C1I Q67670 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.369 CC1=CC2=CC=CC=C2N=C1Br O29594 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.369 CC1=CC2=CC=CC=C2NC1=O H-8558 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.369 CC1=NC2=CC=CC=C2C=C1Br O33096 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.369 CC1NC2=CC=CC=C2NC1=O C-2873 [1,0,0,0,0,0|2,0,1]=4 14 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br C-2201 [1,0,0,0,0,0|2,0,1]=4 15 B13R2.369 NC1=C(O)N=C2C=CC=CC2=N1 G-6217 [1,0,0,0,0,0|2,0,1]=4 16 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O O31934 [1,0,0,0,0,0|2,0,0]=3 17 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br N25822 [1,0,0,0,0,0|1,0,0]=2 18 B13R2.369 OC1=C(Cl)N=C2C=CC=CC2=N1 G-7209 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)C=C2 L22415 [1,0,0,0,0,0|1,0,0]=2 20 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 P39589 [1,0,0,0,0,0|1,0,2]=4 21 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 P39254 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.3683 O=C1C=CC2=CC(Cl)=NC=C2N1 O29891 [1,0,0,0,0,0|1,1,0]=3 23 B13R2.3683 O=C1C=NC2=CC(Br)=CC=C2N1 D-2701 [1,0,0,0,0,0|1,1,0]=3 24 B13R2.3683 O=C1C=NC2=NC(Cl)=CC=C2N1 Q53159 [1,0,0,0,0,0|2,1,0]=4 25 B13R2.3683 O=C1COC2=CC(Br)=CC=C2N1 O34505 [1,0,0,0,0,0|1,1,1]=4 26 B13R2.3683 O=C1N=CC2=C(C=CC(Br)=C2)N1 G-7695 [1,0,0,0,0,0|1,1,0]=3 27 B13R2.3683 O=C1NC2=CC=C(Br)C=C2CO1 G-7693 [1,0,0,0,0,0|1,1,1]=4 28 B15R2.1754 O=CC1=CC2=CC=C(F)C=C2N=C1Cl O30555 [0,1,0,0,0,0|3,0,0]=4 29 B15R2.63893 CC1=CC2=CC(N)=CC=C2N(C)C1=O H-8648 [0,1,0,0,0,0|2,0,0]=3 30 B13R1.133 O=C(O)C(=O)CC1=CC=C(Cl)C=C1 O28340 [0,0,1,0,0,0|2,1,0]=4 31 B13R1.133 O=C(O)C(=O)CC1=CC=C(F)C=C1 O28428 [0,0,1,0,0,0|2,0,0]=3 32 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 P40943 [0,0,1,0,0,0|3,0,0]=4 33 B13R1.133 O=C(O)C(=O)NC1=NC=C(Cl)C=C1 G-7820 [0,0,1,0,0,0|2,1,0]=4 34 B13R2.3028 CC1=C(Br)C2=C(C=CC(F)=C2)N1 Q55418 [0,0,0,0,1,0|2,0,0]=3 35 B13R2.3028 CC1C(=O)NC2=NC=C(F)C=C21 Q63902 [0,0,0,0,1,0|2,0,1]=4 36 B13R2.3028 CN1C(=O)NC2=CC=C(Br)C=C21 O31455 [0,0,0,0,1,0|2,1,0]=4 37 B13R2.3028 O=C1NC2=CC=C(F)C=C2C1=O Q57204 [0,0,0,0,1,0|0,0,1]=2 38 B13R2.5190 O=C1NC2=C(C=CC(F)=C2)C1=O P38822 [0,0,0,0,1,0|1,0,1]=3 39 B13R2.5190 O=C1NC2=C(C=CC(I)=C2)C1=O O32233 [0,0,0,0,1,0|1,1,1]=4 40 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 P38616 [1,0,1,0,0,0|1,0,1]=4 41 B12R1.43 O=C(O)C(=O)NC1=CN=CC=C1 L18737 [1,0,1,0,0,0|2,0,0]=4 42 B12R1.49 NC1=CC=C(NC(=O)CO)C=C1 P40684 [1,0,1,0,0,0|1,0,1]=4 43 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 P39650 [1,0,1,0,0,0|1,0,1]=4 44 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 P50423 [1,0,1,0,0,0|1,0,0]=3 45 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 H-8931 [1,0,1,0,0,0|1,0,1]=4 46 B12R1.371 C\C(C=O)=C/C1=CC=CC=C1F Q69219 [1,0,1,0,0,0|2,0,0]=4 47 B12R2.24 FC1=CC2=C(C=C1)C=NC=C2 O31839 [2,0,0,0,0,0|2,0,0]=4 48 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 C-3537 [2,0,0,0,0,0|1,0,0]=3 49 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 O34499 [2,0,0,0,0,0|1,0,1]=4 50 B12R2.24 OC1=CC2=CC=CC=C2C=N1 G-6644 [2,0,0,0,0,0|2,0,0]=4 51 B12R2.24 OC1=CC2=CC=CC=C2N=C1 Q67519 [2,0,0,0,0,0|0,0,1]=3 52 B12R2.24 SC1=CC2=CC=CC=C2N=C1 O29500 [2,0,0,0,0,0|0,1,1]=4 53 B14R2.134 COC1=CC2=CC(Br)=CC=C2C=C1 O34040 [1,1,0,0,0,0|1,1,0]=4 54 B14R2.1128 O=CC1=NC2=CC=CC=C2C=C1Br N26382 [1,1,0,0,0,0|1,0,1]=4 55 B14R2.28472 O=C1NC2=C(NC1=O)C(O)=CC=C2 O29383 [1,1,0,0,0,0|1,0,1]=4 56 B14R2.8235 FC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 O31931 [1,1,0,0,0,0|1,0,1]=4 57 B14R2.8235 O=C1NC(=O)C2=C(C=CC(I)=C2)N1 P51233 [1,1,0,0,0,0|1,1,0]=4 58 B14R2.29369 O=C1N=CC2=C(C=CC(Br)=C2F)N1 O32333 [1,1,0,0,0,0|1,1,0]=4 59 B14R2.645 CC1=CC2=C(C=C1C)C(=O)C(=O)N2 Q54286 [0,1,0,0,1,0|1,0,1]=4 60 B14R2.4507 O=C1NC2=CC=C(F)C=C2C1(F)F Q64422 [0,1,0,0,1,0|1,0,1]=4 61 B14R2.9184 O=C1NC2=C(C=C(F)C=C2Cl)C1=O Q52478 [0,1,0,0,1,0|0,0,1]=3 62 B14R2.4217 C(=O)C1=C(C)NC2=C1C=CC(F)=C2 Q55319 [0,1,0,0,1,0|2,0,0]=4 63 B14R2.27750 O=C1NC2=C(C1=O)C(F)=CC(F)=C2 P51311 [0,1,0,0,1,0|1,0,1]=4 64 B14R2.27750 O=C1NC2=CC(F)=CC(Cl)=C2C1=O Q61055 [0,1,0,0,1,0|1,0,1]=4 65 B16R2.3885 CC1=CC2=C(C=CC([N+](=O)[O-])=C2)NC1=O H-8559 [0,2,0,0,0,0|2,0,0]=4 66 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2O1 P37481 [0,0,1,1,0,0|1,1,0]=4 67 B12R1.20 CC1=CC=C(C(=O)C(=O)O)C=C1 P36454 [0,0,1,0,1,0|2,0,0]=4 68 B12R1.20 O=C(O)C(=O)C1=CC=C(Br)C=C1 P36491 [0,0,1,0,1,0|1,1,0]=4 69 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 P36490 [0,0,1,0,1,0|1,1,0]=4 70 B12R1.20 O=C(O)C(=O)C1=CC=C(F)C=C1 P39557 [0,0,1,0,1,0|1,0,0]=3 71 B12R1.20 O=C(O)C(=O)C1=CC=C(I)C=C1 P36018 [0,0,1,0,1,0|1,1,0]=4 72 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 P36019 [0,0,1,0,1,0|1,0,1]=4 73 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 P38344 [0,0,1,0,1,0|1,0,1]=4 74 B12R1.1703 O=CC(=O)C1=CC=C(F)C=C1F P36005 [0,0,1,0,1,0|1,0,1]=4 75 B12R2.132 BrC1=CC=C2NC=C(I)C2=C1 Q60085 [1,0,0,0,1,0|1,1,0]=4 76 B12R2.132 CC1=CNC2=C1C=C(Br)C=C2 Q55299 [1,0,0,0,1,0|1,1,0]=4 77 B12R2.132 CC1=CNC2=C1C=C(Cl)C=C2 G-7513 [1,0,0,0,1,0|1,1,0]=4 78 B12R2.132 CC1=CNC2=C1C=C(N)C=C2 Q55296 [1,0,0,0,1,0|2,0,0]=4 79 B12R2.132 CC1=CNC2=C1N=C(F)C=C2 P49870 [1,0,0,0,1,0|2,0,0]=4 80 B12R2.132 CC1=CNC2=CN=C(F)C=C12 P46189 [1,0,0,0,1,0|2,0,0]=4 81 B12R2.132 CC1=CNC2=NC=C(F)C=C12 P49079 [1,0,0,0,1,0|2,0,0]=4 82 B12R2.132 FC1=CC2=C(C=C1)NN=C2Br O32912 [1,0,0,0,1,0|2,0,0]=4 83 B12R2.132 FC1=CC2=C(C=C1)NN=C2I O30721 [1,0,0,0,1,0|2,0,0]=4 84 B12R2.132 FC1=CC2=C(N=C1)NC=C2Br I-9458 [1,0,0,0,1,0|2,0,0]=4 85 B12R2.132 FC1=CC2=C(N=C1)NC=C2I I-9530 [1,0,0,0,1,0|2,0,0]=4 86 B12R2.132 FC1=CN=C2NC=C(Cl)C2=C1 P49477 [1,0,0,0,1,0|2,0,0]=4 87 B12R2.132 FC1=NC2=C(C=C1)NC=C2Br P49584 [1,0,0,0,1,0|2,0,0]=4 88 B12R2.132 FC1=NC2=C(C=C1)NC=C2I P49570 [1,0,0,0,1,0|2,0,0]=4 89 B12R2.132 FC1=NC=C2NC=C(Br)C2=C1 P46083 [1,0,0,0,1,0|2,0,0]=4 90 B12R2.132 FC1=NC=C2NC=C(I)C2=C1 P50436 [1,0,0,0,1,0|2,0,0]=4 91 B12R2.132 NC1=CC=C2NC=C(Cl)C2=C1 Q53319 [1,0,0,0,1,0|2,0,0]=4 92 B12R2.132 NC1=CNC2=NC=C(F)C=C12 P49479 [1,0,0,0,1,0|2,0,0]=4 93 B12R2.132 NC1=NNC2=C1C=C(F)C=C2 P51011 [1,0,0,0,1,0|2,0,0]=4 94 B12R2.606 CC1=CC2=C(C=C(F)C=C2)N1 Q69286 [1,0,0,0,1,0|2,0,0]=4 95 B12R2.606 CC1=CC2=C(C=CC(I)=C2)N1 Q55414 [1,0,0,0,1,0|1,1,0]=4 96 B12R2.606 CC1=CC2=CC(F)=CN=C2N1 P48074 [1,0,0,0,1,0|2,0,0]=4 97 B12R2.606 CC1=CC2=CC(F)=NC=C2N1 P50437 [1,0,0,0,1,0|2,0,0]=4 98 B12R2.606 FC1=NC=C2NC(I)=CC2=C1 P50456 [1,0,0,0,1,0|2,0,0]=4 99 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 E-3094 [1,0,0,0,1,0|0,0,2]=4 100 B12R2.18 C=C1C(=O)NC2=C1C=CC=N2 Q55064 [1,0,0,0,1,0|2,0,0]=4 101 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O P45467 [1,0,0,0,1,0|1,0,1]=4 102 B12R2.18 O=C1NC2=C(N=CC=C2)C1=O Q52820 [1,0,0,0,1,0|1,0,1]=4 103 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 O32491 [1,0,0,0,1,0|1,0,1]=4