0 B10R1.58 CC(=O)C1=CC(Cl)=C(Cl)S1 CS-0111813 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.58 CC1=CC(C(=O)O)=NN1C CS-W004978 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CC=C(Br)S1 CS-W015388 [1,0,0,0,0,0|1,1,0]=3 3 B9R1.35 CC(=O)C1=CC=C(C)S1 CS-W002097 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.35 CC1=CN=C(C(=O)O)S1 CS-0030600 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.35 CC1=CSC(C(=O)O)=C1 CS-0036630 [1,0,0,0,0,0|0,0,0]=1 6 B9R1.35 NC1=NC=C(C(=O)O)S1 CS-W003268 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.35 O=C(O)C1=CC(Br)=CN1 CS-D0459 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.35 O=C(O)C1=CC=C(Cl)S1 CS-M1254 [1,0,0,0,0,0|0,0,0]=1 9 B9R1.35 O=C(O)C1=CSC(Cl)=C1 CS-W019291 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.35 O=C(O)C1=NC=C(Br)S1 CS-W022341 [1,0,0,0,0,0|1,1,0]=3 11 B9R1.35 O=C1C=C(C(=O)O)ON1 CS-W021938 [1,0,0,0,0,0|2,1,0]=4 12 B9R1.35 OB(O)C1=CC=C(Cl)S1 CS-W016108 [1,0,0,0,0,0|1,0,1]=3 13 B11R1.48 CC1=C(C=O)SC(B(O)O)=C1 CS-0109660 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.48 CCN1N=C(C(=O)O)C=C1C CS-0041556 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 CS-W015973 [0,0,0,0,0,1|3,0,0]=4 16 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 CS-W007765 [0,0,0,0,0,1|3,0,0]=4 17 B11R1.21 CC(=O)C1=CC=C(F)C(C)=C1 CS-W018095 [0,0,0,0,0,1|2,1,0]=4 18 B11R1.21 CC1=CC(C(=O)O)=CC=C1F CS-W007680 [0,0,0,0,0,1|1,1,0]=3 19 B11R1.21 CC1=CC(C(=O)O)=CC=C1I CS-0099438 [0,0,0,0,0,1|1,1,0]=3 20 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1Cl CS-D0963 [0,0,0,0,0,1|2,0,1]=4 21 B11R1.21 CC1=CC=C(C(=O)O)C=C1O CS-0008323 [0,0,0,0,0,1|2,0,0]=3 22 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br CS-D0307 [0,0,0,0,0,1|1,1,0]=3 23 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 CS-W008472 [0,0,0,0,0,1|2,1,0]=4 24 B11R1.21 NC1=CC(C(=O)O)=CC=C1Cl CS-W021834 [0,0,0,0,0,1|2,0,0]=3 25 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 CS-W019483 [0,0,0,0,0,1|2,0,0]=3 26 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 CS-W004834 [0,0,0,0,0,1|2,1,0]=4 27 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 CS-W015855 [0,0,0,0,0,1|2,0,0]=3 28 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 CS-W012258 [0,0,0,0,0,1|2,0,0]=3 29 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 CS-W008636 [0,0,0,0,0,1|2,0,0]=3 30 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 CS-W018495 [0,0,0,0,0,1|2,0,0]=3 31 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 CS-W007965 [0,0,0,0,0,1|3,0,0]=4 32 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 CS-W004982 [0,0,0,0,0,1|3,0,0]=4 33 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 CS-W014908 [0,0,0,0,0,1|1,1,0]=3 34 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 CS-W014828 [0,0,0,0,0,1|2,1,0]=4 35 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 CS-D1400 [0,0,0,0,0,1|2,0,0]=3 36 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=N1 CS-W018783 [0,0,0,0,0,1|2,0,0]=3 37 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 CS-W005808 [0,0,0,0,0,1|2,0,0]=3 38 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 CS-W007536 [0,0,0,0,0,1|2,0,0]=3 39 B11R1.74 O=C(O)C1=CC(F)=CC(I)=C1 CS-0028256 [0,0,0,0,0,1|2,1,0]=4 40 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 CS-W005392 [0,0,0,0,0,1|2,1,0]=4 41 B8R1.1 CC1=NC=C(C=O)S1 CS-W019857 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.1 O=CC1=CC(Br)=CN1 CS-W020675 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.1 O=CC1=CC=C(Br)N1 CS-W005750 [2,0,0,0,0,0|1,1,0]=4 44 B8R1.1 O=CC1=CC=C(Br)S1 CS-W008646 [2,0,0,0,0,0|0,1,0]=3 45 B8R1.1 O=CC1=CN=C(Br)S1 CS-W019735 [2,0,0,0,0,0|1,1,0]=4 46 B8R1.1 OCC1=CC(Br)=CS1 CS-0042536 [2,0,0,0,0,0|1,0,1]=4 47 B8R1.7 CC(=O)C1=CC=CN1 CS-W013672 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.7 CC(=O)C1=CC=CO1 CS-W016628 [2,0,0,0,0,0|1,1,0]=4 49 B8R1.7 CC(=O)C1=CC=CS1 CS-W020047 [2,0,0,0,0,0|1,0,0]=3 50 B8R1.7 CC(=O)C1=NC=CS1 CS-W008970 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.7 O=C(O)C1=CN=CO1 CS-W007534 [2,0,0,0,0,0|1,1,0]=4 52 B10R1.14 COC(=O)C1=CC(Br)=CO1 CS-M2917 [1,1,0,0,0,0|1,1,0]=4 53 B10R1.14 COC(=O)C1=CC=C(Cl)S1 CS-M2941 [1,1,0,0,0,0|0,0,0]=2 54 B10R1.14 COC(=O)C1=CN=C(Br)S1 CS-D1612 [1,1,0,0,0,0|1,1,0]=4 55 B10R1.14 COC(=O)C1=CN=C(Cl)S1 CS-0038286 [1,1,0,0,0,0|1,0,0]=3 56 B10R1.14 COC(=O)C1=NNC(C)=C1 CS-W008500 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.31 N#CC1=CSC(C(=O)O)=C1 CS-0101116 [1,1,0,0,0,0|0,0,1]=3 58 B10R1.31 O=CC1=CC=C(C(=O)O)S1 CS-0017900 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 CS-0084065 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 CS-B1374 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 CS-D0830 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 CS-W017841 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 CS-W017707 [0,1,0,0,0,1|1,1,0]=4 64 B12R1.56 COC1=CC(C(=O)O)=CC=C1Br CS-D1614 [0,1,0,0,0,1|1,1,0]=4 65 B12R1.232 CC1=C(F)C=C(Br)C(C(=O)O)=C1 CS-0097946 [0,1,0,0,0,1|1,1,0]=4 66 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1O CS-0102787 [0,1,0,0,0,1|2,0,0]=4 67 B12R1.367 COC(=O)C1=CC(Cl)=C(F)C=C1 CS-W006070 [0,1,0,0,0,1|2,0,0]=4 68 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 CS-W016935 [0,1,0,0,0,1|2,0,0]=4 69 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 CS-W010822 [0,1,0,0,0,1|2,0,0]=4 70 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 CS-W016934 [0,1,0,0,0,1|2,0,0]=4 71 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 CS-W005275 [0,1,0,0,0,1|2,0,0]=4 72 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 CS-W009204 [0,1,0,0,0,1|1,1,0]=4 73 B12R1.893 CC1=C(C)C(C(=O)O)=CC=C1N CS-0028787 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1Br CS-0041782 [0,1,0,0,0,1|1,1,0]=4 75 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1Cl CS-W018861 [0,1,0,0,0,1|1,0,0]=3 76 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1N CS-W019299 [0,1,0,0,0,1|2,0,0]=4 77 B12R1.11 COC1=CC(C(=O)O)=CC(Br)=N1 CS-W006872 [0,1,0,0,0,1|1,1,0]=4 78 B12R1.11 COC1=CC(C(=O)O)=CC(C)=C1 CS-W018772 [0,1,0,0,0,1|2,0,0]=4 79 B12R1.11 COC1=CC(C(=O)O)=CC(Cl)=C1 CS-WAA0107 [0,1,0,0,0,1|1,0,0]=3 80 B12R1.358 COC(=O)C1=CC(C)=CC(N)=C1 CS-0028806 [0,1,0,0,0,1|2,0,0]=4 81 B12R1.511 NC1=CC(Cl)=NC(C(=O)O)=C1Cl CS-W008484 [0,1,0,0,0,1|2,0,0]=4 82 B12R1.19 CC(=O)NC1=CC=C(C)C(Cl)=C1 CS-M1325 [0,0,0,0,0,2|2,0,0]=4 83 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 CS-W020073 [0,0,0,0,0,2|2,0,0]=4 84 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 CS-W004733 [0,0,0,0,0,2|2,0,0]=4 85 B12R1.101 O=C(O)CC1=CC(Cl)=CC(F)=C1 CS-W008457 [0,0,0,0,0,2|2,0,0]=4