0 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)S1 CS-W005123 [0,0,0,0,0,0|0,1,0]=1 1 B9R1.23 O=CC1=CC(Br)=C(Br)S1 CS-W014034 [1,0,0,0,0,0|0,3,0]=4 2 B9R1.35 CC(=O)C1=CC=C(Cl)S1 CS-W019588 [1,0,0,0,0,0|1,1,0]=3 3 B9R1.35 CC1=CC(C(=O)O)=CN1 CS-0018766 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-W019454 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.35 CC1=COC(C(=O)O)=C1 CS-W007308 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.35 CC1=NC(C(=O)O)=CN1 CS-W023071 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.35 CC1=NC(C(=O)O)=CS1 CS-0037835 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.35 CC1=NC=C(C(=O)O)O1 CS-W006682 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.35 CN1C=CC(C(=O)O)=C1 CS-W003777 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.35 CN1C=CC(C(=O)O)=N1 CS-D1728 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.35 NC1=NC(C(=O)O)=CS1 CS-W023136 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.35 O=C(O)C1=CC(Br)=CO1 CS-W009277 [1,0,0,0,0,0|0,1,0]=2 13 B9R1.35 O=C(O)C1=CC(Br)=NN1 CS-W006919 [1,0,0,0,0,0|2,1,0]=4 14 B9R1.35 O=C(O)C1=CC(Cl)=CS1 CS-0040858 [1,0,0,0,0,0|0,1,0]=2 15 B9R1.35 O=C(O)C1=CC(F)=CS1 CS-0040859 [1,0,0,0,0,0|0,2,0]=3 16 B9R1.35 O=C(O)C1=CC=C(F)S1 CS-D0304 [1,0,0,0,0,0|0,2,0]=3 17 B9R1.35 O=C(O)C1=CNC(Cl)=C1 CS-0035544 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.35 O=C(O)C1=COC(Br)=C1 CS-W023154 [1,0,0,0,0,0|2,1,0]=4 19 B9R1.35 O=C(O)C1=CSC(Cl)=N1 CS-0006101 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.35 O=C1NC=C(C(=O)O)N1 CS-W009540 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.226 COC(=O)C1=CC(Br)=C(Br)O1 CS-0011220 [0,1,0,0,0,0|0,2,0]=3 22 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 CS-0032914 [0,0,0,0,0,1|3,0,0]=4 23 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 CS-W017576 [0,0,0,0,0,1|2,1,0]=4 24 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl CS-W017676 [0,0,0,0,0,1|2,0,0]=3 25 B11R1.21 CC1=CN=C(C(=O)O)C=C1F CS-0094255 [0,0,0,0,0,1|2,1,0]=4 26 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 CS-W007229 [0,0,0,0,0,1|1,2,0]=4 27 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS-W005466 [0,0,0,0,0,1|2,0,0]=3 28 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 CS-0041182 [0,0,0,0,0,1|1,1,0]=3 29 B11R1.21 O=C(O)C1=CC=C(O)C(Cl)=C1 CS-0063147 [0,0,0,0,0,1|2,0,0]=3 30 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 CS-W008917 [0,0,0,0,0,1|2,1,0]=4 31 B11R1.21 O=C(O)C1=CNC(=O)C(=O)N1 CS-0109434 [0,0,0,0,0,1|3,0,0]=4 32 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 CS-B0745 [0,0,0,0,0,1|1,2,0]=4 33 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 CS-W009205 [0,0,0,0,0,1|1,0,0]=2 34 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)N=C1 CS-0097645 [0,0,0,0,0,1|1,0,0]=2 35 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 CS-W018684 [0,0,0,0,0,1|1,1,0]=3 36 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 CS-W009090 [0,0,0,0,0,1|2,0,1]=4 37 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 CS-0007511 [0,0,0,0,0,1|3,0,0]=4 38 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 CS-0038256 [0,0,0,0,0,1|3,0,0]=4 39 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 CS-W019036 [0,0,0,0,0,1|2,0,0]=3 40 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=N1 CS-0045868 [0,0,0,0,0,1|2,0,0]=3 41 B11R1.74 CC1=NC(Br)=CC(C(=O)O)=C1 CS-0098743 [0,0,0,0,0,1|2,1,0]=4 42 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 CS-W021836 [0,0,0,0,0,1|2,0,0]=3 43 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CS-M1190 [0,0,0,0,0,1|1,2,0]=4 44 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 CS-W011977 [0,0,0,0,0,1|1,2,0]=4 45 B8R1.1 CC1=CC=C(C=O)N1 CS-0038064 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.1 O=CC1=CC(Br)=CO1 CS-B0789 [2,0,0,0,0,0|0,1,0]=3 47 B8R1.1 O=CC1=CC(I)=CN1 CS-B1239 [2,0,0,0,0,0|1,1,0]=4 48 B8R1.7 O=C(O)C1=CC=NS1 CS-W022767 [2,0,0,0,0,0|1,1,0]=4 49 B8R1.7 O=C(O)C1=CN=CN1 CS-W007695 [2,0,0,0,0,0|2,0,0]=4 50 B8R1.7 O=C(O)C1=NC=CS1 CS-W019827 [2,0,0,0,0,0|1,1,0]=4 51 B8R1.7 O=C(O)C1=NOC=C1 CS-W008200 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.14 COC(=O)C1=CC(C)=NO1 CS-0035753 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.14 COC(=O)C1=CC(I)=CN1 CS-0007661 [1,1,0,0,0,0|1,1,0]=4 54 B10R1.14 COC(=O)C1=CC=C(Br)N1 CS-W006646 [1,1,0,0,0,0|1,1,0]=4 55 B10R1.14 COC(=O)C1=CC=C(Br)S1 CS-B0140 [1,1,0,0,0,0|0,2,0]=4 56 B10R1.14 COC(=O)C1=CC=C(N)S1 CS-W005967 [1,1,0,0,0,0|1,1,0]=4 57 B10R1.31 COC1=NOC(C(=O)O)=C1 CS-0036212 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.31 N#CC1=CC=C(C(=O)O)O1 CS-0030839 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.31 O=CC1=CC=C(C(=O)O)O1 CS-W005879 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 CS-0094208 [1,1,0,0,0,0|0,1,0]=3 61 B10R1.194 NC1=C(C(=O)O)SC=C1Br CS-0095337 [1,1,0,0,0,0|0,2,0]=4 62 B10R1.194 O=C(O)C1=C(Cl)C(Cl)=NS1 CS-W021795 [1,1,0,0,0,0|1,1,0]=4 63 B12R1.48 N#CC1=CC=C(C(=O)O)C=C1Cl CS-0098688 [0,1,0,0,0,1|2,0,0]=4 64 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=N1 CS-0018873 [0,1,0,0,0,1|2,0,0]=4 65 B12R1.232 CC1=CC(C(=O)O)=C(N)C=C1Cl CS-M1328 [0,1,0,0,0,1|2,0,0]=4 66 B12R1.232 NC1=C(C(=O)O)C=C(F)C(Cl)=C1 CS-W005711 [0,1,0,0,0,1|1,1,0]=4 67 B12R1.232 O=C(O)C1=CC(Cl)=C(Br)C=C1F CS-W019357 [0,1,0,0,0,1|1,1,0]=4 68 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)N=C1 CS-WAA0049 [0,1,0,0,0,1|1,0,0]=3 69 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=N1 CS-W019404 [0,1,0,0,0,1|2,0,0]=4 70 B12R1.893 NC1=CC=C(C(=O)O)C(Cl)=C1Cl CS-0098672 [0,1,0,0,0,1|2,0,0]=4 71 B12R1.893 O=C(O)C1=CC=C(Br)C(Cl)=C1F CS-0098670 [0,1,0,0,0,1|1,1,0]=4 72 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 CS-W018899 [0,1,0,0,0,1|1,1,0]=4 73 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(Cl)=C1 CS-W005243 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.11 COC1=CC(C(=O)O)=CC(Cl)=N1 CS-D1069 [0,1,0,0,0,1|2,0,0]=4 75 B12R1.358 COC(=O)C1=NC(Cl)=CC(C)=C1 CS-0105057 [0,1,0,0,0,1|2,0,0]=4 76 B12R1.511 NC1=C(Cl)C=C(Cl)N=C1C(=O)O CS-0100911 [0,1,0,0,0,1|1,0,0]=3 77 B12R1.511 NC1=C(F)C=C(Cl)C=C1C(=O)O CS-0047219 [0,1,0,0,0,1|1,1,0]=4 78 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1F CS-0010961 [0,1,0,0,0,1|1,1,0]=4 79 B12R1.511 O=C(O)C1=CC(I)=CC(Cl)=C1F CS-0098760 [0,1,0,0,0,1|1,1,0]=4 80 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 CS-W005983 [0,0,1,1,0,0|2,0,0]=4 81 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 CS-W008759 [0,0,1,1,0,0|2,0,0]=4 82 B10R1.8 O=CC1=CC(Br)=CC(Cl)=C1 CS-W008214 [1,0,0,0,0,1|1,1,0]=4 83 B10R1.8 O=CC1=CC(F)=CC(Cl)=C1 CS-B0666 [1,0,0,0,0,1|1,1,0]=4 84 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 CS-0035867 [1,0,0,0,0,1|0,1,0]=3 85 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 CS-D0595 [1,0,0,0,0,1|2,0,0]=4