0 B9R1.35 CC(=O)C1=CC=C(Cl)S1 CS-W019588 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CN=C(N)S1 CS-0052918 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC(=O)C1=NNC(C)=C1 CS-0061279 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 CC(=O)C1=NOC(C)=C1 CS-W007034 [0,0,0,0,0,0|2,1,0]=3 4 B9R1.35 CC1=CC(B(O)O)=NN1 CS-W018579 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.35 CC1=CC(C(=O)O)=CN1 CS-0018766 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.35 CC1=CC(C(N)=O)=NO1 CS-W006577 [0,0,0,0,0,0|2,1,0]=3 7 B9R1.35 CC1=CN=C(C(=O)O)N1 CS-W019454 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CC1=COC(C(=O)O)=C1 CS-W007308 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.35 CC1=NC(C(=O)O)=CN1 CS-W023071 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.35 CC1=NC(C(=O)O)=CS1 CS-0037835 [0,0,0,0,0,0|1,0,0]=1 11 B9R1.35 CC1=NC=C(C(=O)O)O1 CS-W006682 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.35 CN1C=CC(C(=O)O)=C1 CS-W003777 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.35 CN1C=CC(C(=O)O)=N1 CS-D1728 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.35 CN1C=CC(C(N)=O)=N1 CS-W007031 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 CN1C=NC(C(=O)O)=N1 CS-0037269 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 N=C1NC(C(=O)O)CS1 CS-0044002 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.35 NC1=NC(C(=O)O)=CS1 CS-W023136 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.35 O=C(O)C1=CC(Br)=CO1 CS-W009277 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.35 O=C(O)C1=CC(Br)=NN1 CS-W006919 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.35 O=C(O)C1=CC(Cl)=CS1 CS-0040858 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.35 O=C(O)C1=CC(F)=CS1 CS-0040859 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.35 O=C(O)C1=CC=C(F)S1 CS-D0304 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.35 O=C(O)C1=CNC(Cl)=C1 CS-0035544 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.35 O=C(O)C1=COC(Br)=C1 CS-W023154 [0,0,0,0,0,0|1,1,0]=2 25 B9R1.35 O=C(O)C1=CSC(Cl)=N1 CS-0006101 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.35 O=C1NC=C(C(=O)O)N1 CS-W009540 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.1 CC1=CC(C=O)=NN1 CS-W005538 [1,0,0,0,0,0|2,0,0]=3 28 B8R1.1 CC1=CC(CO)=NN1 CS-0037641 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.1 CC1=CC=C(C=O)N1 CS-0038064 [1,0,0,0,0,0|2,0,0]=3 30 B8R1.1 CC1=NOC(CO)=C1 CS-0047000 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.1 CN1C=NC(C=O)=C1 CS-0052470 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.1 O=CC1=CC(Br)=CO1 CS-B0789 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.1 O=CC1=CC(I)=CN1 CS-B1239 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.7 CC(=O)C1=CNN=C1 CS-0044097 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.7 O=C(O)C1=CC=NS1 CS-W022767 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.7 O=C(O)C1=CN=CN1 CS-W007695 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.7 O=C(O)C1=CN=NN1 CS-W009031 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.7 O=C(O)C1=CON=C1 CS-W004867 [1,0,0,0,0,0|1,1,0]=3 39 B8R1.7 O=C(O)C1=CSN=C1 CS-D0308 [1,0,0,0,0,0|1,0,0]=2 40 B8R1.7 O=C(O)C1=NC=CS1 CS-W019827 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.7 O=C(O)C1=NOC=C1 CS-W008200 [1,0,0,0,0,0|1,1,0]=3 42 B8R1.7 O=[N+]([O-])C1=CNC=C1 CS-W008547 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.7 O=[N+]([O-])C1=CSN=C1 CS-0095615 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.14 COC(=O)C1=CC(C)=NO1 CS-0035753 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.14 COC(=O)C1=CC(I)=CN1 CS-0007661 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.14 COC(=O)C1=CC=C(Br)N1 CS-W006646 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.14 COC(=O)C1=CC=C(Br)S1 CS-B0140 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.14 COC(=O)C1=CC=C(N)S1 CS-W005967 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.14 COC(=O)C1=CN=C(N)S1 CS-W019982 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.14 COC(=O)C1=CNC(=O)N1 CS-0098094 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.14 COC(=O)C1=COC(Br)=N1 CS-0042753 [0,1,0,0,0,0|2,1,0]=4 52 B10R1.14 COC(=O)C1=CSC(Br)=C1 CS-W006344 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.14 COC(=O)C1=NC(C)=NO1 CS-0079992 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.14 COC(=O)C1=NNC(Br)=C1 CS-W018564 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.14 COC(=O)C1=NOC(N)=C1 CS-0058753 [0,1,0,0,0,0|2,1,0]=4 56 B10R1.31 CCN1C=CC(C(=O)O)=N1 CS-0097982 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.31 COC1=NOC(C(=O)O)=C1 CS-0036212 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.31 N#CC1=CC(C(=O)O)=NN1 CS-0040253 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.31 N#CC1=CC=C(C(=O)O)O1 CS-0030839 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.31 O=CC1=CC=C(C(=O)O)O1 CS-W005879 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.31 OCC1=CC(B(O)O)=CS1 CS-0029511 [0,1,0,0,0,0|1,0,1]=3 62 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)S1 CS-W005123 [0,1,0,0,0,0|3,0,0]=4 63 B10R1.59 CC(=O)C1=C(C)SC(=N)N1 CS-0043931 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.59 CC(=O)C1=CC(C)=NN1C CS-W019855 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.59 CC1=C(C(=O)O)C=C(Br)S1 CS-0080177 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 CS-W021622 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 CS-W021570 [0,1,0,0,0,0|2,0,0]=3 68 B10R1.59 CC1=CN(C)N=C1C(=O)O CS-W006950 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.59 CC1=NN(C)C=C1C(=O)O CS-W005947 [0,1,0,0,0,0|2,0,0]=3 70 B10R1.59 CN1C=C(C(=O)O)C(I)=N1 CS-0097442 [0,1,0,0,0,0|2,0,0]=3 71 B10R1.59 CN1NC(=O)C=C1C(=O)O CS-0101609 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.59 O=C(O)C1=C(Br)N=C(Br)S1 CS-0036234 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 CS-0094208 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 CS-0036851 [0,1,0,0,0,0|0,0,0]=1 75 B10R1.194 NC1=C(C(=O)O)SC=C1Br CS-0095337 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.194 O=C(O)C1=C(Cl)C(Cl)=NS1 CS-W021795 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS-W019730 [0,0,0,0,0,1|3,0,0]=4 78 B10R1.13 CC(=O)C1=CC=C(C)N=C1 CS-B0461 [0,0,0,0,0,1|2,0,0]=3 79 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS-0040244 [0,0,0,0,0,1|3,0,0]=4 80 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 CS-W018594 [0,0,0,0,0,1|3,0,0]=4 81 B10R1.13 CC(=O)C1=NC=C(O)C=C1 CS-W021245 [0,0,0,0,0,1|3,0,0]=4 82 B10R1.13 CC1=CC=C(C(C)O)C=N1 CS-B0462 [0,0,0,0,0,1|2,0,1]=4 83 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 CS-M1249 [0,0,0,0,0,1|3,0,0]=4 84 B10R1.13 CC1=NC=C(B(O)O)C=N1 CS-0030061 [0,0,0,0,0,1|2,0,1]=4 85 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS-W008333 [0,0,0,0,0,1|1,0,0]=2 86 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 CS-W003158 [0,0,0,0,0,1|2,0,1]=4 87 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 CS-W022338 [0,0,0,0,0,1|3,0,0]=4 88 B10R1.13 NC(=O)C1=NC=C(N)N=C1 CS-W019230 [0,0,0,0,0,1|3,0,0]=4 89 B10R1.13 O=C(O)C1=CC=C(F)N=C1 CS-W019722 [0,0,0,0,0,1|2,0,0]=3 90 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS-D0613 [0,0,0,0,0,1|2,0,0]=3 91 B10R1.54 CC(=O)NC1=NNC(C)=C1 CS-0036178 [0,0,0,0,0,1|3,0,0]=4 92 B10R1.54 CC1=NOC(CC(=O)O)=N1 CS-0037991 [0,0,0,0,0,1|3,0,0]=4 93 B10R1.54 CN1C=CC(CC(=O)O)=N1 CS-0037801 [0,0,0,0,0,1|3,0,0]=4 94 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 CS-0035867 [0,0,0,0,0,1|3,0,0]=4 95 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS-W015631 [0,0,0,0,0,1|3,0,0]=4 96 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS-0101623 [0,0,0,0,0,1|2,0,0]=3 97 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS-W008996 [0,0,0,0,0,1|2,0,0]=3 98 B10R1.113 CC(=O)C1=CC(Cl)=CC=N1 CS-0037389 [0,0,0,0,0,1|3,0,0]=4 99 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 CS-M0495 [0,0,0,0,0,1|3,0,0]=4 100 B10R1.113 CC1=CC(C(=N)N)=NC=C1 CS-0038257 [0,0,0,0,0,1|3,0,0]=4 101 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS-W005037 [0,0,0,0,0,1|1,0,0]=2 102 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS-W008764 [0,0,0,0,0,1|1,0,0]=2 103 B10R1.113 NC(=O)C1=CC(=O)NC=N1 CS-0107166 [0,0,0,0,0,1|3,0,0]=4 104 B10R1.113 NC1=CC=NC(C(=O)O)=C1 CS-W022082 [0,0,0,0,0,1|2,0,0]=3 105 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 CS-B1791 [0,0,0,0,0,1|3,0,0]=4 106 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 CS-W005983 [0,0,0,0,0,1|2,0,0]=3 107 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS-W009049 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 CS-W005070 [0,0,0,0,0,1|3,0,0]=4 109 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 CS-W008759 [0,0,0,0,0,1|3,0,0]=4 110 B10R1.113 O=C1C=C(C(=O)O)C=NN1 CS-W022517 [0,0,0,0,0,1|2,0,0]=3 111 B10R1.113 O=C1N=CC=C(C(=O)O)N1 CS-0019355 [0,0,0,0,0,1|3,0,0]=4 112 B7R1.1 O=CC1=CC=CN1 CS-D0925 [2,0,0,0,0,0|2,0,0]=4 113 B7R1.1 O=CC1=CN=CS1 CS-D0828 [2,0,0,0,0,0|2,0,0]=4 114 B7R1.1 O=CC1=CNN=C1 CS-W019597 [2,0,0,0,0,0|2,0,0]=4 115 B7R1.2 CC1=CC(=O)CC1 CS-W013730 [2,0,0,0,0,0|1,0,1]=4 116 B7R1.2 CC1=CC(N)=NS1 CS-0040519 [2,0,0,0,0,0|2,0,0]=4 117 B7R1.2 CN1C=C(O)C=N1 CS-0044173 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.22 CC1=NC(C)=C(C=O)N1 CS-B0800 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.132 CC1=NC=C(C=O)N1C CS-0044360 [1,1,0,0,0,0|2,0,0]=4 120 B9R1.11 COC(=O)C1=CC=CN1 CS-W013518 [1,1,0,0,0,0|2,0,0]=4 121 B9R1.11 COC(=O)C1=CSN=N1 CS-0047194 [1,1,0,0,0,0|2,0,0]=4 122 B9R1.11 COC(=O)C1=NNC=C1 CS-W008807 [1,1,0,0,0,0|2,0,0]=4 123 B9R1.11 N=C(NO)C1=CSC=C1 CS-0036040 [1,1,0,0,0,0|1,0,0]=3 124 B9R1.41 CC1=C(C(=O)O)C=CS1 CS-W005121 [1,1,0,0,0,0|0,0,0]=2 125 B9R1.41 CC1=C(C(=O)O)C=NO1 CS-W011150 [1,1,0,0,0,0|1,1,0]=4 126 B9R1.41 CC1=C(C(=O)O)SC=C1 CS-W004782 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.41 CC1=C(C(=O)O)SC=N1 CS-W008019 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.41 CC1=CNN=C1C(=O)O CS-0063428 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.41 CC1=CSC=C1C(=O)O CS-W019951 [1,1,0,0,0,0|0,0,0]=2 130 B9R1.41 CC1=NSC=C1C(=O)O CS-0061411 [1,1,0,0,0,0|1,0,0]=3 131 B9R1.41 CN1C=CC=C1C(=O)O CS-W013520 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.41 NC1=CNN=C1C(=O)O CS-W007190 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.41 O=C(O)C1=C(Br)C=CO1 CS-W021884 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.41 O=C(O)C1=C(Br)OC=C1 CS-0029968 [1,1,0,0,0,0|0,1,0]=3 135 B9R1.41 O=C(O)C1=C(Br)SC=C1 CS-D0553 [1,1,0,0,0,0|0,0,0]=2 136 B9R1.41 O=C(O)C1=C(I)OC=C1 CS-0047021 [1,1,0,0,0,0|0,1,0]=3 137 B9R1.41 O=C(O)C1=NNC=C1Cl CS-W005681 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.3 COC1=CN=C(C(=O)O)N=C1 CS-0036848 [0,1,0,0,0,1|2,0,0]=4 139 B11R1.3 N#CC1=CC=C(C(=O)O)N=C1 CS-W016339 [0,1,0,0,0,1|1,0,1]=4 140 B11R1.3 N#CC1=CN=C(C(=O)O)C=N1 CS-0097641 [0,1,0,0,0,1|1,0,1]=4 141 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 CS-0047067 [0,1,0,0,0,1|2,0,0]=4 142 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-0084282 [0,1,0,0,0,1|2,0,0]=4 143 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-M2553 [0,1,0,0,0,1|2,0,0]=4 144 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0210 [0,1,0,0,0,1|2,0,0]=4 145 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS-WAA0255 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 CS-0032914 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl CS-W017676 [0,1,0,0,0,1|2,0,0]=4 148 B11R1.21 CC1=CN=C(C(=O)O)C=C1F CS-0094255 [0,1,0,0,0,1|1,0,0]=3 149 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 CS-W007229 [0,1,0,0,0,1|2,0,0]=4 150 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS-W005466 [0,1,0,0,0,1|2,0,0]=4 151 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 CS-0041182 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.21 O=C(O)C1=CC=C(O)C(Cl)=C1 CS-0063147 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 CS-W008917 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.21 O=C(O)C1=CNC(=O)C(=O)N1 CS-0109434 [0,1,0,0,0,1|2,0,0]=4 155 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 CS-B0745 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 CS-W009205 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)N=C1 CS-0097645 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 CS-W018684 [0,1,0,0,0,1|2,0,0]=4 159 B11R1.22 COC(=O)C1=CC=C(S)C=C1 CS-0037057 [0,1,0,0,0,1|2,0,0]=4 160 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 CS-W018560 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.22 COC(=O)C1=CN=C(O)C=C1 CS-W005768 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.22 COC(=O)C1=CNC(=O)N=C1 CS-0045841 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 CS-B0937 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 CS-W007177 [0,1,0,0,0,1|2,0,0]=4 165 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 CS-W006084 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CS-W008011 [0,1,0,0,0,1|1,0,0]=3 167 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O CS-W007037 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.166 CC1=CC(N)=NC=C1C(=O)O CS-0005496 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 CS-0038247 [0,1,0,0,0,1|1,0,0]=3 170 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 CS-0045881 [0,1,0,0,0,1|1,0,0]=3 171 B11R1.166 CC1=NC(F)=CC=C1C(=O)O CS-W022498 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 CS-B0703 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=C1 CS-W005731 [0,1,0,0,0,1|1,0,0]=3 174 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 CS-W007847 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CS-W017585 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=N1 CS-W006689 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=N1 CS-W005596 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 CS-W007725 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 CS-W022476 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl CS-0030261 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br CS-0041697 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl CS-0079379 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.645 CC1=NC(CC(=O)O)=C(C)S1 CS-0061202 [0,1,0,0,0,1|1,0,0]=3 184 B11R1.23 COC(=O)C1=CC(C)=CN=C1 CS-W019377 [0,1,0,0,0,1|1,0,0]=3 185 B11R1.23 COC(=O)C1=CC(F)=CN=C1 CS-0043948 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.23 COC(=O)C1=CC(O)=CN=C1 CS-0044458 [0,1,0,0,0,1|2,0,0]=4 187 B11R1.23 COC(=O)C1=CC(O)=NN=C1 CS-0061835 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.23 COC(=O)C1=CC(S)=CC=C1 CS-M0304 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.23 COC(=O)C1=CC=CC(N)=C1 CS-W018124 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.23 COC(=O)C1=NC=CC(O)=C1 CS-0040761 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 CS-0007511 [0,1,0,0,0,1|1,0,0]=3 192 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 CS-0038256 [0,1,0,0,0,1|1,0,0]=3 193 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 CS-W019036 [0,1,0,0,0,1|1,0,0]=3 194 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=N1 CS-0045868 [0,1,0,0,0,1|1,0,0]=3 195 B11R1.74 CC1=NC(Br)=CC(C(=O)O)=C1 CS-0098743 [0,1,0,0,0,1|1,0,0]=3 196 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 CS-W021836 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CS-M1190 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 CS-W011977 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O CS-0046901 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.159 CC1=NC=NC(C(=O)O)=C1C CS-0036852 [0,1,0,0,0,1|1,0,0]=3 201 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O CS-B0777 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.159 NC1=C(C(=O)O)C=NC=C1Br CS-W006865 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.159 NC1=C(I)C=CC=C1C(=O)O CS-0030571 [0,1,0,0,0,1|2,0,0]=4 204 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 CS-W017481 [0,1,0,0,0,1|2,0,0]=4 205 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 CS-W007697 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 CS-W006030 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I CS-0098092 [0,1,0,0,0,1|2,0,0]=4 208 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I CS-0041180 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 CS-D1105 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 CS-0008584 [0,1,0,0,0,1|1,0,0]=3 211 B11R1.167 CC1=CC=C(F)C(C(=O)O)=C1 CS-W019919 [0,1,0,0,0,1|1,0,0]=3 212 B11R1.167 CC1=CC=C(I)C(C(=O)O)=C1 CS-W009152 [0,1,0,0,0,1|1,0,0]=3 213 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O CS-W009220 [0,1,0,0,0,1|2,0,0]=4 214 B11R1.167 NC1=CN=C(F)C=C1C(=O)O CS-W006661 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 CS-D1207 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F CS-D0438 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br CS-D1730 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.266 COC1=CC=CC(C(=O)O)=N1 CS-D1581 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.266 N#CC1=CC(C(=O)O)=CC=C1 CS-D1397 [0,1,0,0,0,1|1,0,1]=4 220 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 CS-0099794 [0,1,0,0,0,1|1,0,0]=3 221 B11R1.15 CCOC(=O)C1=CC(C)=CN1 CS-W018073 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.15 CCOC(=O)C1=CSC(=S)N1 CS-0095184 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.15 CCOC(=O)C1=CSC(N)=N1 CS-W009022 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.44 COC(=O)C1=CC(CO)=CN1 CS-0099238 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.225 COC(=O)C1=C(C)C=C(C)N1 CS-0099240 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.865 COC(=O)C1=C(N)C(C)=NO1 CS-0036833 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.865 COC(=O)C1=C(N)N(C)N=C1 CS-W022858 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.865 COC(=O)C1=CSC(C)=C1N CS-W020376 [0,2,0,0,0,0|0,0,0]=2 229 B11R1.50 COC1=NN(C)C(C(=O)O)=C1 CS-0043937 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.175 CC(=O)C1=CC(C(=O)O)=NN1 CS-0037190 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.175 CC(=O)C1=NC=C(C(=O)O)S1 CS-M1606 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.175 CC(C)C1=CC(C(=O)O)=NN1 CS-W006370 [0,2,0,0,0,0|2,0,0]=4 233 B11R1.175 O=C(O)C1=NSC([N+](=O)[O-])=C1 CS-B0028 [0,2,0,0,0,0|2,0,0]=4 234 B11R1.49 COC1=NN(C)C=C1C(=O)O CS-0035740 [0,2,0,0,0,0|2,0,0]=4 235 B9R1.6 O=C(O)C1=CN=CN=C1 CS-B0029 [0,0,1,1,0,0|2,0,0]=4 236 B9R1.2 CC1=CN=CC(C=O)=N1 CS-0054600 [1,0,0,0,0,1|2,0,0]=4 237 B9R1.2 O=CC1=CC(Cl)=NC=C1 CS-W011025 [1,0,0,0,0,1|2,0,0]=4 238 B9R1.2 O=CC1=CC(O)=CN=C1 CS-0063897 [1,0,0,0,0,1|2,0,0]=4 239 B9R1.2 O=CC1=NC=CC(Cl)=C1 CS-D1623 [1,0,0,0,0,1|2,0,0]=4 240 B9R1.2 O=CC1=NC=CC(F)=C1 CS-W006870 [1,0,0,0,0,1|2,0,0]=4 241 B9R1.2 O=CC1=NC=CC(O)=C1 CS-0103517 [1,0,0,0,0,1|2,0,0]=4 242 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 CS-0059277 [0,0,0,0,0,2|1,0,0]=3 243 B11R1.20 O=C(O)CC1=CC=C(F)C=N1 CS-0047181 [0,0,0,0,0,2|2,0,0]=4 244 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 CS-W008991 [0,0,0,0,0,2|2,0,0]=4 245 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 CS-0054139 [0,0,0,0,0,2|2,0,0]=4 246 B11R1.75 CC1=CC=C(\C=C\C(=O)O)S1 CS-0031380 [0,0,0,0,0,2|2,0,0]=4 247 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 CS-0060700 [0,0,0,0,0,2|2,0,0]=4 248 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 CS-W008629 [0,0,0,0,0,2|2,0,0]=4