0 B12R1.5 C#CC1=CC=C(C(=O)OC)C=C1 CS-W007435 [0,0,0,0,0,0|1,0,1]=2 1 B12R1.5 C#CC1=CC=C(C(=O)O[Na])C=C1 CS-0132435 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.5 C#CC1=CN=C(C(=O)OC)C=C1 CS-0043882 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.5 C#CC1=NC=C(C(=O)OC)C=C1 CS-0043883 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 CS-W009013 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 CS-W008542 [0,0,0,0,0,0|1,0,1]=2 6 B12R1.5 CCC(=O)C1=CC=C(C#N)C=C1 CS-0305278 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.5 CCC(=O)C1=CC=C(CC)C=C1 CS-W010854 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 CS-W020638 [0,0,0,0,0,0|1,0,0]=1 9 B12R1.5 CCC1=CC=C(C(=O)CBr)C=C1 CS-W006339 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 CS-0152513 [0,0,0,0,0,0|1,0,0]=1 11 B12R1.5 CCC1=CC=C(C(N)CC)C=C1 CS-0498567 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.5 CCC1=CC=C([C@@H](N)CC)C=C1 CS-0528509 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.5 CCC1=CC=C([C@H](N)CC)C=C1 CS-0440231 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.5 CC[C@@H](N)C1=CC=C(OC)C=C1 CS-0363144 [0,0,0,0,0,0|2,0,1]=3 15 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 CS-0197077 [0,0,0,0,0,0|2,0,1]=3 16 B12R1.5 CNC(=O)C1=CC=C(C=O)C=C1 CS-0205621 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 CS-0216609 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.5 CNC1=CC=C(C(=O)OC)C=C1 CS-0094663 [0,0,0,0,0,0|1,0,0]=1 19 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 CS-W019823 [0,0,0,0,0,0|2,0,0]=2 20 B12R1.5 COC(=O)C1=CC=C(C#N)N=C1 CS-0044469 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.5 COC(=O)C1=CC=C(C=O)N=C1 CS-D0517 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 CS-B1334 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 CS-W001885 [0,0,0,0,0,0|2,0,0]=2 24 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 CS-0130415 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 CS-0132197 [0,0,0,0,0,0|2,0,0]=2 26 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 CS-W016058 [0,0,0,0,0,0|0,0,0]=0 27 B12R1.5 COC(=O)C1=CC=C(O[Na])C=C1 CS-W017522 [0,0,0,0,0,0|1,0,0]=1 28 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 CS-0012617 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 CS-0048958 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 CS-W002650 [0,0,0,0,0,0|3,0,0]=3 31 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 CS-W005354 [0,0,0,0,0,0|1,0,0]=1 32 B12R1.5 COC(=O)C1=CN=C(OC)C=N1 CS-M3285 [0,0,0,0,0,0|2,0,0]=2 33 B12R1.5 COC(=O)C1=CN=C(OC)N=C1 CS-0196038 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.5 COC(=O)C1=CN=C(SC)N=C1 CS-0053796 [0,0,0,0,0,0|2,1,0]=3 35 B12R1.5 COC(=O)C1=NC=C(C#N)C=C1 CS-0047189 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.5 COC(=O)C1=NC=C(C=O)C=C1 CS-0054096 [0,0,0,0,0,0|3,0,0]=3 37 B12R1.5 COC(=O)C1=NC=C(C=O)N=C1 CS-W022869 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.5 COC(=O)C1=NC=C(CBr)C=C1 CS-W018767 [0,0,0,0,0,0|3,0,0]=3 39 B12R1.5 COC(=O)C1=NC=C(CBr)N=C1 CS-W019653 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.5 COC(=O)C1=NC=C(CN)C=C1 CS-0218011 [0,0,0,0,0,0|3,0,0]=3 41 B12R1.5 COC(=O)C1=NC=C(CO)C=C1 CS-0150745 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.5 COC(=O)C1=NN=C(OC)C=C1 CS-0097489 [0,0,0,0,0,0|2,0,0]=2 43 B12R1.5 COC1=CC=C(C(=N)NO)C=C1 CS-0647297 [0,0,0,0,0,0|3,0,0]=3 44 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 CS-W014194 [0,0,0,0,0,0|2,0,0]=2 45 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 CS-W016981 [0,0,0,0,0,0|2,0,0]=2 46 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 CS-W015541 [0,0,0,0,0,0|2,0,0]=2 47 B12R1.5 COC1=CC=C(C(=O)CO)C=C1 CS-0308705 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 CS-0116725 [0,0,0,0,0,0|2,0,0]=2 49 B12R1.5 COC1=CC=C(C(N)CO)C=C1 CS-0089903 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.5 COC1=CC=C(C(N)CO)C=C1 CS-0150412 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 CS-0089935 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 CS-M3110 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.5 N#CC1=CC=C(C(=O)CCl)C=C1 CS-0233860 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.5 N#CC1=CC=C(C(=O)CO)C=C1 CS-0157591 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.5 N#CC1=CC=C(C(=O)NN)C=C1 CS-W020613 [0,0,0,0,0,0|4,0,0]=4 56 B12R1.5 N#CC1=CC=C(S(=O)O[Na])C=C1 CS-0889040 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 CS-W007533 [1,0,0,0,0,0|1,0,1]=3 58 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 CS-0063791 [1,0,0,0,0,0|1,0,1]=3 59 B11R1.3 C#CC1=CN=C(C(=O)O)C=C1 CS-0158556 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 CS-0215143 [1,0,0,0,0,0|1,0,0]=2 61 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 CS-W007654 [1,0,0,0,0,0|1,0,1]=3 62 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 CS-W001929 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 CS-W023080 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 CS-0101890 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.3 CC(=O)C1=CN=C(C#N)C=C1 CS-0336224 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.3 CC(=O)C1=NC=C(C#N)C=C1 CS-0062110 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CS-0030581 [1,0,0,0,0,0|1,0,0]=2 68 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 CS-W021233 [1,0,0,0,0,0|1,0,0]=2 69 B11R1.3 CCC1=CC=C([C@@H](C)N)C=C1 CS-0308415 [1,0,0,0,0,0|2,0,1]=4 70 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 CS-0035618 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 CS-0139065 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 CS-0029513 [1,0,0,0,0,0|1,0,0]=2 73 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 CS-0155091 [1,0,0,0,0,0|1,0,0]=2 74 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 CS-0011554 [1,0,0,0,0,0|2,0,1]=4 75 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 CS-0045745 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.3 COC1=CC=C(B(O)O)C=C1 CS-W002177 [1,0,0,0,0,0|1,0,1]=3 77 B11R1.3 COC1=CC=C(B(O)O)C=N1 CS-W019911 [1,0,0,0,0,0|2,0,1]=4 78 B11R1.3 COC1=CC=C(C(=N)N)C=C1 CS-0042893 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.3 COC1=CC=C(C(=O)O)C=C1 CS-B1766 [1,0,0,0,0,0|0,0,0]=1 80 B11R1.3 COC1=CC=C(C(C)=O)C=C1 CS-0008322 [1,0,0,0,0,0|0,0,0]=1 81 B11R1.3 COC1=CC=C(C(C)=O)C=N1 CS-W009176 [1,0,0,0,0,0|1,0,0]=2 82 B11R1.3 COC1=CC=C(C(C)N)C=C1 CS-0094463 [1,0,0,0,0,0|1,0,1]=3 83 B11R1.3 COC1=CC=C(C(C)N)C=C1 CS-0154100 [1,0,0,0,0,0|1,0,1]=3 84 B11R1.3 COC1=CC=C(C(C)O)C=C1 CS-0154099 [1,0,0,0,0,0|0,0,2]=3 85 B11R1.3 COC1=CC=C(C(N)=O)C=C1 CS-W022205 [1,0,0,0,0,0|1,0,0]=2 86 B11R1.3 COC1=CC=C(C(N)=O)C=N1 CS-W000376 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.3 COC1=CC=C(C(N)=S)C=C1 CS-W017831 [1,0,0,0,0,0|1,1,0]=3 88 B11R1.3 COC1=CC=C(N(C)C)C=C1 CS-W007102 [1,0,0,0,0,0|2,0,0]=3 89 B11R1.3 COC1=CC=C(S(C)=O)C=C1 CS-0046999 [1,0,0,0,0,0|1,0,0]=2 90 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 CS-W019916 [1,0,0,0,0,0|1,0,1]=3 91 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 CS-0030800 [1,0,0,0,0,0|0,0,2]=3 92 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 CS-W009113 [1,0,0,0,0,0|1,0,1]=3 93 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 CS-0086357 [1,0,0,0,0,0|0,0,2]=3 94 B11R1.3 COC1=CC=C([N+](=O)[O-])C=N1 CS-0082347 [1,0,0,0,0,0|2,0,1]=4 95 B11R1.3 COC1=CN=C(C(=N)N)C=C1 CS-0196536 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.3 COC1=CN=C(C(=O)O)C=N1 CS-W019666 [1,0,0,0,0,0|2,0,0]=3 97 B11R1.3 COC1=CN=C(C(=O)O)N=C1 CS-0036848 [1,0,0,0,0,0|2,0,0]=3 98 B11R1.3 COC1=CN=C(C(C)=O)C=C1 CS-0054869 [1,0,0,0,0,0|1,0,0]=2 99 B11R1.3 COC1=CN=C(C(C)=O)C=N1 CS-0060855 [1,0,0,0,0,0|2,0,0]=3 100 B11R1.3 COC1=NC=C(C(=N)N)C=C1 CS-0150223 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.3 COC1=NC=C(C(=O)O)C=C1 CS-W004797 [1,0,0,0,0,0|1,0,0]=2 102 B11R1.3 COC1=NC=C(C(=O)O)C=N1 CS-0054460 [1,0,0,0,0,0|2,0,0]=3 103 B11R1.3 COC1=NC=C(C(N)=S)C=C1 CS-0150224 [1,0,0,0,0,0|2,1,0]=4 104 B11R1.3 COC1=NC=C([C@@H](C)N)C=C1 CS-0594405 [1,0,0,0,0,0|2,0,1]=4 105 B11R1.3 COC1=NN=C(C(=O)O)C=C1 CS-0050177 [1,0,0,0,0,0|2,0,0]=3 106 B11R1.3 CSC1=CC=C(B(O)O)C=C1 CS-D1041 [1,0,0,0,0,0|1,1,1]=4 107 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 CS-0063816 [1,0,0,0,0,0|0,1,0]=2 108 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 CS-W017854 [1,0,0,0,0,0|0,1,0]=2 109 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 CS-0131594 [1,0,0,0,0,0|1,1,1]=4 110 B11R1.3 CSC1=CC=C([N+](=O)[O-])C=C1 CS-W010788 [1,0,0,0,0,0|1,1,1]=4 111 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 CS-D1546 [1,0,0,0,0,0|2,1,0]=4 112 B11R1.3 N#CC1=CC=C(C(=O)O)N=C1 CS-W016339 [1,0,0,0,0,0|3,0,0]=4 113 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 CS-0206293 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 CS-0197313 [1,0,0,0,0,0|3,0,0]=4 115 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 CS-4892 [1,0,0,0,0,0|2,0,0]=3 116 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 CS-W007313 [1,0,0,0,0,0|3,0,0]=4 117 B11R1.3 NCC1=CN=C(C(=O)O)C=C1 CS-0188352 [1,0,0,0,0,0|3,0,0]=4 118 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CS-W015985 [1,0,0,0,0,0|2,0,0]=3 119 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CS-W018098 [1,0,0,0,0,0|2,0,0]=3 120 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 CS-W003107 [1,0,0,0,0,0|3,0,0]=4 121 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 CS-W022928 [1,0,0,0,0,0|2,0,1]=4 122 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 CS-W017672 [1,0,0,0,0,0|2,0,0]=3 123 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 CS-W018100 [1,0,0,0,0,0|2,0,0]=3 124 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 CS-W022262 [1,0,0,0,0,0|3,0,0]=4 125 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 CS-W018162 [1,0,0,0,0,0|2,0,0]=3 126 B11R1.3 O=CC1=CN=C(C(=O)O)C=C1 CS-0089586 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.3 O=CC1=NC=C(C(=O)O)C=C1 CS-0454615 [1,0,0,0,0,0|3,0,0]=4 128 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 CS-W007335 [1,0,0,0,0,0|2,0,0]=3 129 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 CS-0205248 [1,0,0,0,0,0|2,0,0]=3 130 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 CS-0096272 [1,0,0,0,0,0|2,0,0]=3 131 B11R1.22 CC1=NC=C(C(=O)NN)C=C1 CS-0312605 [1,0,0,0,0,0|3,0,0]=4 132 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS-W014980 [1,0,0,0,0,0|2,0,0]=3 133 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 CS-W017746 [1,0,0,0,0,0|1,0,0]=2 134 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS-W016035 [1,0,0,0,0,0|2,0,0]=3 135 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS-0059258 [1,0,0,0,0,0|2,0,0]=3 136 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 CS-0041354 [1,0,0,0,0,0|2,0,0]=3 137 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 CS-0152655 [1,0,0,0,0,0|2,0,0]=3 138 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 CS-7973 [1,0,0,0,0,0|1,0,0]=2 139 B11R1.22 CCC(=O)C1=NC=C(Br)C=C1 CS-0135397 [1,0,0,0,0,0|3,0,0]=4 140 B11R1.22 CCC(N)C1=CC=C(C)C=C1 CS-0116596 [1,0,0,0,0,0|2,0,1]=4 141 B11R1.22 CCC(N)C1=CC=C(C)C=C1 CS-0701483 [1,0,0,0,0,0|2,0,1]=4 142 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 CS-0188455 [1,0,0,0,0,0|2,0,1]=4 143 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 CS-0372159 [1,0,0,0,0,0|2,0,1]=4 144 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 CS-0067754 [1,0,0,0,0,0|2,0,0]=3 145 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 CS-0151058 [1,0,0,0,0,0|2,0,0]=3 146 B11R1.22 CNC(=O)C1=CC=C(Cl)N=C1 CS-W006347 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.22 CNC(=O)C1=CC=C(F)C=C1 CS-W018076 [1,0,0,0,0,0|2,0,0]=3 148 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 CS-0102088 [1,0,0,0,0,0|2,0,0]=3 149 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 CS-W018773 [1,0,0,0,0,0|2,0,0]=3 150 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 CS-0138031 [1,0,0,0,0,0|1,0,0]=2 151 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 CS-0030263 [1,0,0,0,0,0|3,0,0]=4 152 B11R1.22 CNC(=O)C1=NC=C(O)C=C1 CS-0456491 [1,0,0,0,0,0|2,0,0]=3 153 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 CS-W004846 [1,0,0,0,0,0|1,0,0]=2 154 B11R1.22 COC(=O)C1=CC=C(C)C=C1 CS-0008417 [1,0,0,0,0,0|0,0,0]=1 155 B11R1.22 COC(=O)C1=CC=C(C)C=C1 CS-M1189 [1,0,0,0,0,0|0,0,0]=1 156 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 CS-B1786 [1,0,0,0,0,0|1,0,0]=2 157 B11R1.22 COC(=O)C1=CC=C(F)C=C1 CS-W007781 [1,0,0,0,0,0|1,0,0]=2 158 B11R1.22 COC(=O)C1=CC=C(F)N=C1 CS-W008583 [1,0,0,0,0,0|2,0,0]=3 159 B11R1.22 COC(=O)C1=CC=C(I)C=C1 CS-W007583 [1,0,0,0,0,0|1,0,0]=2 160 B11R1.22 COC(=O)C1=CC=C(N)C=C1 CS-W009283 [1,0,0,0,0,0|1,0,0]=2 161 B11R1.22 COC(=O)C1=CC=C(N)N=C1 CS-W002681 [1,0,0,0,0,0|2,0,0]=3 162 B11R1.22 COC(=O)C1=CC=C(O)C=C1 CS-D1181 [1,0,0,0,0,0|0,0,0]=1 163 B11R1.22 COC(=O)C1=CC=C(S)C=C1 CS-0037057 [1,0,0,0,0,0|0,1,0]=2 164 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 CS-W003208 [1,0,0,0,0,0|2,0,0]=3 165 B11R1.22 COC(=O)C1=CN=C(C)C=C1 CS-M0627 [1,0,0,0,0,0|1,0,0]=2 166 B11R1.22 COC(=O)C1=CN=C(C)C=N1 CS-0038852 [1,0,0,0,0,0|2,0,0]=3 167 B11R1.22 COC(=O)C1=CN=C(C)N=C1 CS-0029749 [1,0,0,0,0,0|2,0,0]=3 168 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 CS-W004062 [1,0,0,0,0,0|2,0,0]=3 169 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 CS-W018560 [1,0,0,0,0,0|3,0,0]=4 170 B11R1.22 COC(=O)C1=CN=C(I)C=C1 CS-0150768 [1,0,0,0,0,0|2,0,0]=3 171 B11R1.22 COC(=O)C1=CN=C(N)C=N1 CS-W003640 [1,0,0,0,0,0|3,0,0]=4 172 B11R1.22 COC(=O)C1=CN=C(N)N=C1 CS-W008071 [1,0,0,0,0,0|3,0,0]=4 173 B11R1.22 COC(=O)C1=CN=C(O)C=C1 CS-W005768 [1,0,0,0,0,0|1,0,0]=2 174 B11R1.22 COC(=O)C1=CNC(=O)C=N1 CS-M3260 [1,0,0,0,0,0|2,0,1]=4 175 B11R1.22 COC(=O)C1=CNC(=O)N=C1 CS-0045841 [1,0,0,0,0,0|2,0,1]=4 176 B11R1.22 COC(=O)C1=COC(=O)C=C1 CS-W008753 [1,0,0,0,0,0|1,0,1]=3 177 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 CS-D0954 [1,0,0,0,0,0|2,0,0]=3 178 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 CS-W004847 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 CS-W019731 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.22 COC(=O)C1=NC=C(C)C=C1 CS-W006118 [1,0,0,0,0,0|1,0,0]=2 181 B11R1.22 COC(=O)C1=NC=C(C)C=N1 CS-W000730 [1,0,0,0,0,0|2,0,0]=3 182 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 CS-W018846 [1,0,0,0,0,0|2,0,0]=3 183 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 CS-0036347 [1,0,0,0,0,0|3,0,0]=4 184 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 CS-B0937 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.22 COC(=O)C1=NC=C(F)C=C1 CS-0018830 [1,0,0,0,0,0|2,0,0]=3 186 B11R1.22 COC(=O)C1=NC=C(F)C=N1 CS-0038962 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.22 COC(=O)C1=NC=C(I)C=C1 CS-0150744 [1,0,0,0,0,0|2,0,0]=3 188 B11R1.22 COC(=O)C1=NC=C(N)C=C1 CS-W009245 [1,0,0,0,0,0|2,0,0]=3 189 B11R1.22 COC(=O)C1=NC=C(N)C=N1 CS-0049006 [1,0,0,0,0,0|3,0,0]=4 190 B11R1.22 COC(=O)C1=NC=C(O)C=C1 CS-W005963 [1,0,0,0,0,0|1,0,0]=2 191 B11R1.22 COC(=O)C1=NC=C(O)C=N1 CS-0056562 [1,0,0,0,0,0|2,0,0]=3 192 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 CS-0097934 [1,0,0,0,0,0|3,0,0]=4 193 B11R1.22 COC(=O)C1=NN=C(C)C=C1 CS-0152722 [1,0,0,0,0,0|2,0,0]=3 194 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 CS-W005175 [1,0,0,0,0,0|3,0,0]=4 195 B11R1.22 COC(=O)C1=NN=C(N)C=C1 CS-0039253 [1,0,0,0,0,0|3,0,0]=4 196 B11R1.22 COC(=O)C1=NN=C(O)C=C1 CS-0043958 [1,0,0,0,0,0|2,0,0]=3 197 B11R1.22 COS(=O)C1=CC=C(Cl)C=C1 CS-0373588 [1,0,0,0,0,0|2,0,0]=3 198 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 CS-0111410 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 CS-0170983 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.22 NC1=CC=C(C(=O)CCl)C=C1 CS-0450499 [1,0,0,0,0,0|3,0,0]=4 201 B11R1.22 NC1=CC=C(C(=O)O[Na])C=C1 CS-W010885 [1,0,0,0,0,0|2,0,0]=3 202 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS-W009051 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS-W019054 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 CS-W020378 [1,0,0,0,0,0|3,0,0]=4 205 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 CS-0130435 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 CS-0142936 [1,0,0,0,0,0|3,0,0]=4 207 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 CS-W022181 [1,0,0,0,0,0|3,0,0]=4 208 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 CS-0157513 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 CS-0012956 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 CS-W013295 [1,0,0,0,0,0|2,0,0]=3 211 B11R1.22 N\C(=N/O)C1=CC=C(O)C=C1 CS-0651537 [1,0,0,0,0,0|3,0,0]=4 212 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 CS-W014171 [1,0,0,0,0,0|3,0,0]=4 213 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS-W009314 [1,0,0,0,0,0|3,0,0]=4 214 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 CS-0186567 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS-W002314 [1,0,0,0,0,0|2,0,0]=3 216 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 CS-W014170 [1,0,0,0,0,0|3,0,0]=4 217 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 CS-0238967 [1,0,0,0,0,0|3,0,0]=4 218 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 CS-W017579 [1,0,0,0,0,0|3,0,0]=4 219 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 CS-W017674 [1,0,0,0,0,0|2,0,0]=3 220 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 CS-0060232 [1,0,0,0,0,0|3,0,0]=4 221 B11R1.22 O=C(NO)C1=CC=C(Br)C=C1 CS-0145138 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.22 O=C(NO)C1=CC=C(Cl)C=C1 CS-0145140 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.22 O=C(NO)C1=CC=C(I)C=C1 CS-0145141 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.22 O=C(O[Na])C1=CC=C(O)C=C1 CS-W010880 [1,0,0,0,0,0|1,0,0]=2 225 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 CS-0186414 [1,0,0,0,0,0|3,0,0]=4 226 B11R1.22 O=S(O[Na])C1=CC=C(F)C=C1 CS-W005156 [1,0,0,0,0,0|3,0,0]=4 227 B11R1.83 CCC1=CC=C(CNC)C=C1 CS-0152510 [1,0,0,0,0,0|2,0,1]=4 228 B11R1.83 CCCC1=CC=C(OC)C=C1 CS-0152413 [1,0,0,0,0,0|1,0,1]=3 229 B11R1.83 CNCC1=CC=C(OC)C=C1 CS-D0541 [1,0,0,0,0,0|1,0,1]=3 230 B11R1.83 CNCC1=CC=C(OC)C=C1 CS-D0566 [1,0,0,0,0,0|1,0,1]=3 231 B11R1.83 COC1=CC=C(CC#N)C=C1 CS-W001932 [1,0,0,0,0,0|2,0,1]=4 232 B11R1.83 COC1=CC=C(CCBr)C=C1 CS-0150393 [1,0,0,0,0,0|2,0,1]=4 233 B11R1.83 COC1=CC=C(CCO)C=C1 CS-W004056 [1,0,0,0,0,0|2,0,1]=4 234 B11R1.83 COC1=CC=C(CNN)C=C1 CS-0053733 [1,0,0,0,0,0|2,0,1]=4 235 B11R1.83 COC1=CC=C(CNN)C=C1 CS-W018557 [1,0,0,0,0,0|2,0,1]=4 236 B11R1.83 COC1=CC=C(CNO)C=C1 CS-0150387 [1,0,0,0,0,0|2,0,1]=4 237 B11R1.83 COC1=CC=C(CON)C=C1 CS-W004482 [1,0,0,0,0,0|1,0,1]=3 238 B11R1.83 COC1=CC=C(CON)C=C1 CS-W005477 [1,0,0,0,0,0|1,0,1]=3 239 B11R1.83 COC1=CC=C(\C=N\O)C=C1 CS-0369380 [1,0,0,0,0,0|2,0,0]=3 240 B11R1.83 COCC1=CC=C(OC)C=C1 CS-0150191 [1,0,0,0,0,0|0,0,1]=2 241 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS-4365 [1,0,0,0,0,0|1,0,0]=2 242 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS-W020065 [1,0,0,0,0,0|1,0,0]=2 243 B13R1.36 CCC1=CC=C(C(=O)C(=O)O)C=C1 CS-0296613 [0,1,0,0,0,0|3,0,0]=4 244 B13R1.36 CCC1=CC=C(C(=O)C(C)C)C=C1 CS-0001449 [0,1,0,0,0,0|2,0,0]=3 245 B13R1.36 COC1=CC=C(C(=O)C(=O)O)C=C1 CS-0262830 [0,1,0,0,0,0|2,0,0]=3 246 B13R1.36 CSC1=CC=C(C(=O)C(F)F)C=C1 CS-0303872 [0,1,0,0,0,0|2,1,0]=4 247 B13R1.39 COC1=CC=C(C(OC)OC)C=C1 CS-M1998 [0,1,0,0,0,0|0,0,2]=3 248 B13R1.95 CCC(=O)C1=C(O)C=C(OC)C=C1 CS-0197337 [0,1,0,0,0,0|1,0,0]=2 249 B13R1.95 COC(=O)C1=C(Br)C=C(OC)C=C1 CS-W022802 [0,1,0,0,0,0|0,0,0]=1 250 B13R1.95 COC(=O)C1=C(Br)N=C(OC)C=C1 CS-0150240 [0,1,0,0,0,0|1,0,0]=2 251 B13R1.95 COC(=O)C1=C(Cl)C=C(C#N)C=C1 CS-0061807 [0,1,0,0,0,0|2,0,0]=3 252 B13R1.95 COC(=O)C1=C(F)C=C(C#N)C=C1 CS-0043682 [0,1,0,0,0,0|2,0,0]=3 253 B13R1.95 COC(=O)C1=C(F)C=C(C=O)C=C1 CS-W006141 [0,1,0,0,0,0|2,0,0]=3 254 B13R1.95 COC(=O)C1=C(N)C=C(OC)C=C1 CS-W005578 [0,1,0,0,0,0|0,0,0]=1 255 B13R1.95 COC(=O)C1=CC=C(C#N)C=C1C CS-B1028 [0,1,0,0,0,0|2,0,0]=3 256 B13R1.95 COC(=O)C1=CC=C(C=O)C=C1C CS-0188428 [0,1,0,0,0,0|2,0,0]=3 257 B13R1.95 COC(=O)C1=CC=C(C=O)N=C1Cl CS-0526911 [0,1,0,0,0,0|3,0,0]=4 258 B13R1.95 COC(=O)C1=CC=C(CBr)C=C1Cl CS-0158443 [0,1,0,0,0,0|2,0,0]=3 259 B13R1.95 COC(=O)C1=CC=C(CO)C=C1F CS-0097658 [0,1,0,0,0,0|2,0,0]=3 260 B13R1.95 COC(=O)C1=CC=C(OC)C=C1C CS-0043197 [0,1,0,0,0,0|0,0,0]=1 261 B13R1.95 COC(=O)C1=CC=C(OC)C=C1Cl CS-0131320 [0,1,0,0,0,0|0,0,0]=1 262 B13R1.95 COC(=O)C1=CC=C(OC)C=C1F CS-0131322 [0,1,0,0,0,0|0,0,0]=1 263 B13R1.95 COC(=O)C1=CC=C(OC)C=C1I CS-0131337 [0,1,0,0,0,0|0,0,0]=1 264 B13R1.95 COC(=O)C1=CC=C(OC)C=C1O CS-W009087 [0,1,0,0,0,0|0,0,0]=1 265 B13R1.95 COC(=O)C1=CC=C(OC)N=C1C CS-0035796 [0,1,0,0,0,0|1,0,0]=2 266 B13R1.95 COC(=O)C1=CC=C(OC)N=C1Cl CS-0040125 [0,1,0,0,0,0|1,0,0]=2 267 B13R1.95 COC(=O)C1=CN=C(OC)C=C1Cl CS-0102117 [0,1,0,0,0,0|1,0,0]=2 268 B13R1.95 COC(=O)C1=CN=C(SC)N=C1C CS-0078739 [0,1,0,0,0,0|2,1,0]=4 269 B13R1.95 COC1=CC(F)=C(C(=O)CBr)C=C1 CS-0212039 [0,1,0,0,0,0|2,0,0]=3 270 B13R1.95 COC1=CC=C(C(=O)NN)C(O)=C1 CS-0100349 [0,1,0,0,0,0|2,0,0]=3 271 B13R1.139 CCOC1=CC=C(C(=O)OC)C=C1 CS-W017204 [0,1,0,0,0,0|0,0,0]=1 272 B13R1.139 COC(=O)C1=CC=C(C#CBr)C=C1 CS-0112197 [0,1,0,0,0,0|1,0,1]=3 273 B13R1.139 COC(=O)C1=CC=C(CC#N)C=C1 CS-W007933 [0,1,0,0,0,0|1,0,1]=3 274 B13R1.139 COC(=O)C1=CC=C(CCBr)C=C1 CS-W022837 [0,1,0,0,0,0|1,0,0]=2 275 B13R1.139 COC(=O)C1=CC=C(CCO)C=C1 CS-0138580 [0,1,0,0,0,0|1,0,0]=2 276 B13R1.187 COC1=CC=C(S(=O)(=O)NN)C=C1 CS-0150368 [0,1,0,0,0,0|3,0,0]=4 277 B13R1.452 C#CC1=CC=C(C(=O)OCC)C=C1 CS-D0535 [0,1,0,0,0,0|1,0,1]=3 278 B13R1.452 CCCC(=O)C1=CC=C(OC)C=C1 CS-0039064 [0,1,0,0,0,0|1,0,0]=2 279 B13R1.452 CCOC(=O)C1=CC=C(C#N)C=C1 CS-W001928 [0,1,0,0,0,0|2,0,0]=3 280 B13R1.452 CCOC(=O)C1=CC=C(C=O)C=C1 CS-0097281 [0,1,0,0,0,0|2,0,0]=3 281 B13R1.452 CCOC(=O)C1=CC=C(C=O)N=C1 CS-0374092 [0,1,0,0,0,0|3,0,0]=4 282 B13R1.452 CCOC(=O)C1=CC=C(CBr)C=C1 CS-0151759 [0,1,0,0,0,0|2,0,0]=3 283 B13R1.452 CCOC(=O)C1=CC=C(CN)C=C1 CS-W001858 [0,1,0,0,0,0|2,0,0]=3 284 B13R1.452 CCOC(=O)C1=CC=C(CN)N=C1 CS-0102597 [0,1,0,0,0,0|3,0,0]=4 285 B13R1.452 CCOC(=O)C1=CC=C(NN)C=C1 CS-0151753 [0,1,0,0,0,0|2,0,0]=3 286 B13R1.452 CCOC(=O)C1=CC=C(OC)C=C1 CS-0151752 [0,1,0,0,0,0|0,0,0]=1 287 B13R1.452 CCOC(=O)C1=CC=C(O[Na])C=C1 CS-0151760 [0,1,0,0,0,0|1,0,0]=2 288 B13R1.452 CCOC(=O)C1=CN=C(C#N)C=C1 CS-W022716 [0,1,0,0,0,0|3,0,0]=4 289 B13R1.452 CCOC(=O)C1=CN=C(SC)N=C1 CS-0045713 [0,1,0,0,0,0|2,1,0]=4 290 B13R1.452 CCOC(=O)C1=NC=C(CO)C=C1 CS-W022696 [0,1,0,0,0,0|3,0,0]=4 291 B13R1.452 COC1=CC=C(C(=O)CC#N)C=C1 CS-W017454 [0,1,0,0,0,0|1,0,1]=3 292 B13R1.452 COC1=CC=C(C(=O)CCCl)C=C1 CS-W015648 [0,1,0,0,0,0|1,0,0]=2 293 B13R1.537 CCC(=O)C1=CC=C(C(=O)O)C=C1 CS-0167795 [0,1,0,0,0,0|3,0,0]=4 294 B13R1.537 CCC(=O)C1=CC=C(N(C)C)C=C1 CS-0450533 [0,1,0,0,0,0|2,0,0]=3 295 B13R1.537 CN(C)C1=CC=C(C(=O)CBr)C=C1 CS-0186565 [0,1,0,0,0,0|3,0,0]=4 296 B13R1.537 CN(C)C1=CC=C(C(=O)NN)C=C1 CS-0205929 [0,1,0,0,0,0|3,0,0]=4 297 B13R1.537 CNC(=O)C1=CC=C(B(O)O)C=C1 CS-W022019 [0,1,0,0,0,0|3,0,0]=4 298 B13R1.537 CNC(=O)C1=CC=C(C(=O)O)C=C1 CS-0151059 [0,1,0,0,0,0|3,0,0]=4 299 B13R1.537 CNC(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-0138445 [0,1,0,0,0,0|3,0,0]=4 300 B13R1.537 COC(=O)C1=CC=C(B(O)O)C=C1 CS-W003977 [0,1,0,0,0,0|2,0,0]=3 301 B13R1.537 COC(=O)C1=CC=C(C(=N)N)C=C1 CS-0012438 [0,1,0,0,0,0|2,0,0]=3 302 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=C1 CS-W017217 [0,1,0,0,0,0|2,0,0]=3 303 B13R1.537 COC(=O)C1=CC=C(C(=O)O)C=N1 CS-0035737 [0,1,0,0,0,0|3,0,0]=4 304 B13R1.537 COC(=O)C1=CC=C(C(C)=O)C=C1 CS-M0170 [0,1,0,0,0,0|1,0,0]=2 305 B13R1.537 COC(=O)C1=CC=C(C(C)=O)N=C1 CS-0038634 [0,1,0,0,0,0|2,0,0]=3 306 B13R1.537 COC(=O)C1=CC=C(C(C)N)C=C1 CS-M0171 [0,1,0,0,0,0|1,0,0]=2 307 B13R1.537 COC(=O)C1=CC=C(C(N)=S)C=C1 CS-0252170 [0,1,0,0,0,0|2,0,0]=3 308 B13R1.537 COC(=O)C1=CC=C(N(C)C)C=C1 CS-W017264 [0,1,0,0,0,0|1,0,0]=2 309 B13R1.537 COC(=O)C1=CC=C([C@@H](C)N)C=C1 CS-0131595 [0,1,0,0,0,0|1,0,0]=2 310 B13R1.537 COC(=O)C1=CC=C([C@@H](C)N)C=C1 CS-B0181 [0,1,0,0,0,0|1,0,0]=2 311 B13R1.537 COC(=O)C1=CC=C([C@@H](C)O)C=C1 CS-0508719 [0,1,0,0,0,0|1,0,0]=2 312 B13R1.537 COC(=O)C1=CC=C([C@H](C)N)C=C1 CS-B0176 [0,1,0,0,0,0|1,0,0]=2 313 B13R1.537 COC(=O)C1=CC=C([C@H](C)N)C=C1 CS-D0445 [0,1,0,0,0,0|1,0,0]=2 314 B13R1.537 COC(=O)C1=CC=C([C@H](C)O)C=C1 CS-0251712 [0,1,0,0,0,0|1,0,0]=2 315 B13R1.537 COC(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-W016003 [0,1,0,0,0,0|2,0,0]=3 316 B13R1.537 COC(=O)C1=CC=C([N+](=O)[O-])N=C1 CS-0131620 [0,1,0,0,0,0|3,0,0]=4 317 B13R1.537 COC(=O)C1=CN=C(C(=N)N)C=C1 CS-0441893 [0,1,0,0,0,0|3,0,0]=4 318 B13R1.537 COC(=O)C1=CN=C(C(=O)O)C=C1 CS-W004726 [0,1,0,0,0,0|3,0,0]=4 319 B13R1.537 COC(=O)C1=NC=C(B(O)O)C=C1 CS-0082390 [0,1,0,0,0,0|3,0,0]=4 320 B13R1.537 COC(=O)C1=NC=C([N+](=O)[O-])C=C1 CS-0061867 [0,1,0,0,0,0|3,0,0]=4 321 B13R1.537 NOC(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-W005046 [0,1,0,0,0,0|3,0,0]=4 322 B13R1.537 O=C(O[K])C1=CC=C([N+](=O)[O-])C=C1 CS-0182156 [0,1,0,0,0,0|3,0,0]=4 323 B13R1.3088 CCC1=C(N)C=C(C(=O)OC)C=C1 CS-0214874 [0,1,0,0,0,0|1,0,0]=2 324 B13R1.3088 CNC1=CC=C(C(=O)OC)C=C1N CS-0029666 [0,1,0,0,0,0|1,0,0]=2 325 B13R1.3088 COC(=O)C1=CC(Br)=C(C=O)C=C1 CS-0041512 [0,1,0,0,0,0|2,0,0]=3 326 B13R1.3088 COC(=O)C1=CC(Cl)=C(C#N)C=C1 CS-W006734 [0,1,0,0,0,0|2,0,0]=3 327 B13R1.3088 COC(=O)C1=CC(Cl)=C(C=O)C=C1 CS-0042802 [0,1,0,0,0,0|2,0,0]=3 328 B13R1.3088 COC(=O)C1=CC(F)=C(C#N)C=C1 CS-W000768 [0,1,0,0,0,0|2,0,0]=3 329 B13R1.3088 COC(=O)C1=CC(F)=C(C=O)C=C1 CS-W018604 [0,1,0,0,0,0|2,0,0]=3 330 B13R1.3088 COC(=O)C1=CC(F)=C(OC)N=C1 CS-0061918 [0,1,0,0,0,0|1,0,0]=2 331 B13R1.3088 COC(=O)C1=CC(N)=C(OC)C=C1 CS-W017157 [0,1,0,0,0,0|0,0,0]=1 332 B13R1.3088 COC(=O)C1=CC(O)=C(OC)C=C1 CS-W002773 [0,1,0,0,0,0|0,0,0]=1 333 B13R1.3088 COC(=O)C1=CC(O)=C(OC)N=C1 CS-0150567 [0,1,0,0,0,0|1,0,0]=2 334 B13R1.3088 COC(=O)C1=CC=C(C#N)C(C)=C1 CS-W022852 [0,1,0,0,0,0|2,0,0]=3 335 B13R1.3088 COC(=O)C1=CC=C(C#N)C(O)=C1 CS-0136184 [0,1,0,0,0,0|2,0,0]=3 336 B13R1.3088 COC(=O)C1=CC=C(C=O)C(C)=C1 CS-0450251 [0,1,0,0,0,0|2,0,0]=3 337 B13R1.3088 COC(=O)C1=CC=C(C=O)C(O)=C1 CS-0044168 [0,1,0,0,0,0|2,0,0]=3 338 B13R1.3088 COC(=O)C1=CC=C(CO)C(Br)=C1 CS-0096062 [0,1,0,0,0,0|2,0,0]=3 339 B13R1.3088 COC(=O)C1=CC=C(CO)C(F)=C1 CS-0042796 [0,1,0,0,0,0|2,0,0]=3 340 B13R1.3088 COC(=O)C1=CC=C(OC)C(Br)=C1 CS-W012726 [0,1,0,0,0,0|0,0,0]=1 341 B13R1.3088 COC(=O)C1=CC=C(OC)C(C)=C1 CS-0153184 [0,1,0,0,0,0|0,0,0]=1 342 B13R1.3088 COC(=O)C1=CC=C(OC)C(Cl)=C1 CS-0118408 [0,1,0,0,0,0|0,0,0]=1 343 B13R1.3088 COC(=O)C1=CC=C(OC)C(F)=C1 CS-W017010 [0,1,0,0,0,0|0,0,0]=1 344 B13R1.3088 COC(=O)C1=CC=C(OC)C(I)=C1 CS-0045005 [0,1,0,0,0,0|0,0,0]=1 345 B13R1.3088 COC(=O)C1=CN=C(OC)C(Br)=C1 CS-W022865 [0,1,0,0,0,0|1,0,0]=2 346 B13R1.3088 COC(=O)C1=CN=C(OC)C(C)=C1 CS-0195591 [0,1,0,0,0,0|1,0,0]=2 347 B13R1.3088 COC(=O)C1=CN=C(OC)C(Cl)=C1 CS-0042992 [0,1,0,0,0,0|1,0,0]=2 348 B13R1.3088 COC(=O)C1=CN=C(OC)C(N)=C1 CS-0043126 [0,1,0,0,0,0|1,0,0]=2 349 B13R1.3088 COC(=O)C1=NC(Br)=C(OC)C=C1 CS-0041484 [0,1,0,0,0,0|1,0,0]=2 350 B13R1.3088 COC(=O)C1=NC(Cl)=C(C=O)C=C1 CS-0513781 [0,1,0,0,0,0|3,0,0]=4 351 B13R1.3088 COC(=O)C1=NC(Cl)=C(CO)C=C1 CS-0197753 [0,1,0,0,0,0|3,0,0]=4 352 B13R1.3088 COC(=O)C1=NC=C(OC)C(Br)=C1 CS-0145977 [0,1,0,0,0,0|1,0,0]=2 353 B13R1.3088 COC(=O)C1=NC=C(OC)C(Cl)=C1 CS-0055440 [0,1,0,0,0,0|1,0,0]=2 354 B13R2.186 COC1=CC=C(C2(N)CC2)C=C1 CS-0208720 [0,0,0,1,0,0|2,0,1]=4 355 B13R2.2130 C#CC1=CC2=C(C=C1)C(=O)OC2 CS-0529939 [0,0,0,1,0,0|1,0,1]=3 356 B13R2.2130 CCC1=CC2=C(C=C1)C(=O)CC2 CS-0211710 [0,0,0,1,0,0|2,0,0]=3 357 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CO2 CS-0196832 [0,0,0,1,0,0|2,0,0]=3 358 B13R2.2130 COC1=CC2=C(C=C1)C(N)=NN2 CS-0205203 [0,0,0,1,0,0|3,0,0]=4 359 B13R2.2130 COC1=CC2=NNC(C)=C2C=C1 CS-0153384 [0,0,0,1,0,0|3,0,0]=4 360 B13R2.2130 COC1=CC=C2B(O)OCC2=C1 CS-0078596 [0,0,0,1,0,0|1,0,1]=3 361 B13R2.2130 COC1=CC=C2C(=C1)NN=C2I CS-W021946 [0,0,0,1,0,0|3,0,0]=4 362 B13R2.2130 COC1=CC=C2C(=C1)ON=C2N CS-0146447 [0,0,0,1,0,0|3,0,0]=4 363 B13R2.2130 COC1=CC=C2C(=O)CCC2=C1 CS-W001196 [0,0,0,1,0,0|1,0,0]=2 364 B13R2.2130 COC1=CC=C2C(=O)NCC2=C1 CS-W006552 [0,0,0,1,0,0|1,0,0]=2 365 B13R2.2130 COC1=CC=C2C(=O)OCC2=C1 CS-0036954 [0,0,0,1,0,0|0,0,0]=1 366 B13R2.2130 N#CC1=CC2=C(C=C1)C(=O)CC2 CS-W023175 [0,0,0,1,0,0|3,0,0]=4 367 B13R2.2130 N#CC1=CC2=C(C=C1)C(=O)NC2 CS-0099136 [0,0,0,1,0,0|3,0,0]=4 368 B13R2.2130 N#CC1=CC2=C(C=C1)C(=O)OC2 CS-W016184 [0,0,0,1,0,0|2,0,0]=3 369 B13R2.2130 O=C1NCC2=C1C=CC(CO)=C2 CS-0149655 [0,0,0,1,0,0|3,0,0]=4 370 B13R2.2130 O=CC1=CC2=C(C=C1)C(=O)NC2 CS-0149698 [0,0,0,1,0,0|3,0,0]=4 371 B11R1.44 COC(=O)C1=CC(C#N)=CN1 CS-0343314 [0,0,0,0,1,0|3,0,0]=4 372 B11R1.44 COC(=O)C1=CC(C#N)=CO1 CS-0150826 [0,0,0,0,1,0|3,0,0]=4 373 B11R1.44 COC(=O)C1=CC(C=O)=CN1 CS-0099218 [0,0,0,0,1,0|3,0,0]=4 374 B11R1.44 COC(=O)C1=CC=C(C#N)N1 CS-0150820 [0,0,0,0,1,0|3,0,0]=4 375 B11R1.44 COC(=O)C1=CC=C(C#N)S1 CS-0145281 [0,0,0,0,1,0|3,0,0]=4 376 B11R1.44 COC(=O)C1=CC=C(C=O)N1 CS-0040617 [0,0,0,0,1,0|3,0,0]=4 377 B11R1.44 COC(=O)C1=CC=C(C=O)O1 CS-0247813 [0,0,0,0,1,0|3,0,0]=4 378 B11R1.44 COC(=O)C1=CC=C(C=O)S1 CS-W002832 [0,0,0,0,1,0|3,0,0]=4 379 B11R1.44 COC(=O)C1=CC=C(CCl)O1 CS-W017480 [0,0,0,0,1,0|3,0,0]=4 380 B11R1.44 COC(=O)C1=CC=C(CN)O1 CS-0074328 [0,0,0,0,1,0|3,0,0]=4 381 B11R1.44 COC(=O)C1=CC=C(CO)N1 CS-0102080 [0,0,0,0,1,0|3,0,0]=4 382 B11R1.44 COC(=O)C1=CC=C(CO)O1 CS-0498391 [0,0,0,0,1,0|3,0,0]=4 383 B11R1.44 COC(=O)C1=CC=C(OC)S1 CS-0150435 [0,0,0,0,1,0|1,0,0]=2 384 B11R1.44 COC(=O)C1=COC(C=O)=C1 CS-0526908 [0,0,0,0,1,0|3,0,0]=4 385 B11R1.44 COC(=O)C1=CSC(C=O)=C1 CS-D0187 [0,0,0,0,1,0|3,0,0]=4 386 B11R1.44 COC(=O)C1=NC=C(OC)O1 CS-0217133 [0,0,0,0,1,0|2,0,0]=3 387 B13R1.5 C#CC1=CC=C(CC(=O)OC)C=C1 CS-0310533 [0,0,0,0,0,1|1,0,1]=3 388 B13R1.5 CNC(=O)CC1=CC=C(OC)C=C1 CS-0911438 [0,0,0,0,0,1|1,0,0]=2 389 B13R1.5 COC(=O)CC1=CC=C(C#N)C=C1 CS-W005340 [0,0,0,0,0,1|2,0,0]=3 390 B13R1.5 COC(=O)CC1=CC=C(C=O)C=C1 CS-W019639 [0,0,0,0,0,1|2,0,0]=3 391 B13R1.5 COC(=O)CC1=CC=C(CN)C=C1 CS-0119755 [0,0,0,0,0,1|2,0,0]=3 392 B13R1.5 COC(=O)CC1=CC=C(CO)C=C1 CS-0187457 [0,0,0,0,0,1|2,0,0]=3 393 B13R1.5 COC(=O)CC1=CC=C(OC)C=C1 CS-0130330 [0,0,0,0,0,1|0,0,0]=1 394 B13R1.5 COC1=CC=C(CC(=O)NN)C=C1 CS-0150359 [0,0,0,0,0,1|2,0,0]=3 395 B13R1.5 COC1=CC=C(NC(=O)CN)C=C1 CS-0232283 [0,0,0,0,0,1|2,0,0]=3 396 B13R1.5 COC1=CC=C(NC(=O)CO)C=C1 CS-0302851 [0,0,0,0,0,1|2,0,0]=3 397 B13R1.5 COC1=CC=C(OC(=O)CCl)C=C1 CS-0530091 [0,0,0,0,0,1|2,0,0]=3 398 B10R0.59 COC(=O)\C=C\CC(=O)OC CS-0130488 [1,0,1,0,0,0|1,0,1]=4 399 B10R1.3 C#CC1=CC=C(C=O)C=C1 CS-W008115 [2,0,0,0,0,0|1,0,1]=4 400 B10R1.3 C#CC1=CC=C(OC)C=C1 CS-W004104 [2,0,0,0,0,0|0,0,2]=4 401 B10R1.3 C=CC1=CC=C(C=O)C=C1 CS-0109481 [2,0,0,0,0,0|1,0,1]=4 402 B10R1.3 C=CC1=CC=C(OC)C=C1 CS-W013377 [2,0,0,0,0,0|0,0,1]=3 403 B10R1.3 CCC1=CC=C(C=O)C=C1 CS-W013373 [2,0,0,0,0,0|1,0,0]=3 404 B10R1.3 CCC1=CC=C(CO)C=C1 CS-0186074 [2,0,0,0,0,0|1,0,1]=4 405 B10R1.3 CCC1=CC=C(OC)C=C1 CS-W011060 [2,0,0,0,0,0|0,0,1]=3 406 B10R1.3 CNC1=CC=C(C=O)C=C1 CS-0527406 [2,0,0,0,0,0|1,0,0]=3 407 B10R1.3 CNC1=CC=C(OC)C=C1 CS-0151029 [2,0,0,0,0,0|1,0,0]=3 408 B10R1.3 CNC1=CC=C(OC)C=C1 CS-W013331 [2,0,0,0,0,0|1,0,0]=3 409 B10R1.3 COC1=CC=C(C#N)C=C1 CS-W013398 [2,0,0,0,0,0|1,0,1]=4 410 B10R1.3 COC1=CC=C(C=O)C=C1 CS-W020189 [2,0,0,0,0,0|0,0,0]=2 411 B10R1.3 COC1=CC=C(C=O)C=N1 CS-D0960 [2,0,0,0,0,0|1,0,0]=3 412 B10R1.3 COC1=CC=C(CO)C=C1 CS-W016493 [2,0,0,0,0,0|0,0,1]=3 413 B10R1.3 COC1=CC=C(CO)C=N1 CS-W018598 [2,0,0,0,0,0|1,0,1]=4 414 B10R1.3 COC1=CC=C(NN)C=C1 CS-W007694 [2,0,0,0,0,0|2,0,0]=4 415 B10R1.3 COC1=CC=C(OC)C=C1 CS-W016496 [2,0,0,0,0,0|0,0,0]=2 416 B10R1.3 COC1=CC=C(SC)C=C1 CS-0019062 [2,0,0,0,0,0|0,1,0]=3 417 B10R1.3 COC1=CC=C([N+]#N)C=C1 CS-W009319 [2,0,0,0,0,0|2,0,0]=4 418 B10R1.3 COC1=CN=C(C=O)C=C1 CS-W005343 [2,0,0,0,0,0|1,0,0]=3 419 B10R1.3 COC1=CN=C(C=O)C=N1 CS-0054598 [2,0,0,0,0,0|2,0,0]=4 420 B10R1.3 COC1=CN=C(C=O)N=C1 CS-0005506 [2,0,0,0,0,0|2,0,0]=4 421 B10R1.3 COC1=CN=C(CO)C=C1 CS-W006204 [2,0,0,0,0,0|1,0,1]=4 422 B10R1.3 COC1=CN=C(OC)C=C1 CS-0044152 [2,0,0,0,0,0|1,0,0]=3 423 B10R1.3 COC1=NC=C(C=O)C=N1 CS-W003085 [2,0,0,0,0,0|2,0,0]=4 424 B10R1.3 COC1=NN=C(OC)C=C1 CS-0111913 [2,0,0,0,0,0|2,0,0]=4 425 B10R1.3 CSC1=CC=C(C=O)C=C1 CS-W016298 [2,0,0,0,0,0|0,1,0]=3 426 B10R1.3 CSC1=NC=C(C=O)C=C1 CS-0195739 [2,0,0,0,0,0|1,1,0]=4 427 B10R1.3 N#CC1=CC=C(C=O)C=C1 CS-W001948 [2,0,0,0,0,0|2,0,0]=4 428 B10R1.3 O=CC1=CC=C(C=O)C=C1 CS-W020006 [2,0,0,0,0,0|2,0,0]=4 429 B10R1.3 O=CC1=CC=C(CBr)C=C1 CS-0038637 [2,0,0,0,0,0|2,0,0]=4 430 B10R1.3 O=CC1=CC=C(CCl)C=C1 CS-W022010 [2,0,0,0,0,0|2,0,0]=4 431 B10R1.3 O=CC1=CC=C(CO)C=C1 CS-W005041 [2,0,0,0,0,0|2,0,0]=4 432 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 CS-W018084 [2,0,0,0,0,0|2,0,0]=4 433 B10R1.13 C=C(C)C1=CC=C(F)C=C1 CS-0069566 [2,0,0,0,0,0|2,0,0]=4 434 B10R1.13 C=C(C)C1=CC=C(O)C=C1 CS-W005287 [2,0,0,0,0,0|1,0,0]=3 435 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS-W020546 [2,0,0,0,0,0|1,0,0]=3 436 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS-W019730 [2,0,0,0,0,0|2,0,0]=4 437 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS-W013369 [2,0,0,0,0,0|0,0,0]=2 438 B10R1.13 CC(=O)C1=CC=C(C)N=C1 CS-B0461 [2,0,0,0,0,0|1,0,0]=3 439 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS-W016264 [2,0,0,0,0,0|1,0,0]=3 440 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS-D0744 [2,0,0,0,0,0|2,0,0]=4 441 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS-W020117 [2,0,0,0,0,0|1,0,0]=3 442 B10R1.13 CC(=O)C1=CC=C(I)C=C1 CS-W012703 [2,0,0,0,0,0|1,0,0]=3 443 B10R1.13 CC(=O)C1=CC=C(N)C=C1 CS-0327393 [2,0,0,0,0,0|1,0,0]=3 444 B10R1.13 CC(=O)C1=CC=C(N)C=C1 CS-W009534 [2,0,0,0,0,0|1,0,0]=3 445 B10R1.13 CC(=O)C1=CC=C(O)C=C1 CS-D1120 [2,0,0,0,0,0|0,0,0]=2 446 B10R1.13 CC(=O)C1=CN=C(C)C=N1 CS-0318294 [2,0,0,0,0,0|2,0,0]=4 447 B10R1.13 CC(=O)C1=CN=C(C)N=C1 CS-0006460 [2,0,0,0,0,0|2,0,0]=4 448 B10R1.13 CC(=O)C1=CN=C(F)C=C1 CS-W003402 [2,0,0,0,0,0|2,0,0]=4 449 B10R1.13 CC(=O)C1=CNC(=N)C=C1 CS-0044041 [2,0,0,0,0,0|2,0,0]=4 450 B10R1.13 CC(=O)C1=CNC(=O)C=C1 CS-W003737 [2,0,0,0,0,0|1,0,1]=4 451 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CS-W003223 [2,0,0,0,0,0|2,0,0]=4 452 B10R1.13 CC(=O)C1=NC=C(C)C=C1 CS-0005383 [2,0,0,0,0,0|1,0,0]=3 453 B10R1.13 CC(=O)C1=NC=C(C)C=N1 CS-0282135 [2,0,0,0,0,0|2,0,0]=4 454 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS-0040244 [2,0,0,0,0,0|2,0,0]=4 455 B10R1.13 CC(=O)C1=NC=C(F)C=C1 CS-0088242 [2,0,0,0,0,0|2,0,0]=4 456 B10R1.13 CC(=O)C1=NC=C(N)C=C1 CS-0142552 [2,0,0,0,0,0|2,0,0]=4 457 B10R1.13 CC(=O)C1=NC=C(O)C=C1 CS-W021245 [2,0,0,0,0,0|1,0,0]=3 458 B10R1.13 CC(O)C1=CC=C(O)C=C1 CS-W006209 [2,0,0,0,0,0|0,0,2]=4 459 B10R1.13 CC1=CC=C(B(O)O)C=C1 CS-W009284 [2,0,0,0,0,0|1,0,1]=4 460 B10R1.13 CC1=CC=C(C(=N)N)C=C1 CS-W010775 [2,0,0,0,0,0|2,0,0]=4 461 B10R1.13 CC1=CC=C(C(=O)O)C=C1 CS-D0602 [2,0,0,0,0,0|0,0,0]=2 462 B10R1.13 CC1=CC=C(C(C)N)C=C1 CS-0145974 [2,0,0,0,0,0|1,0,1]=4 463 B10R1.13 CC1=CC=C(C(C)O)C=C1 CS-0153076 [2,0,0,0,0,0|0,0,2]=4 464 B10R1.13 CC1=CC=C(C(N)=O)C=C1 CS-0071610 [2,0,0,0,0,0|1,0,0]=3 465 B10R1.13 CC1=CC=C(N(C)C)C=C1 CS-0039176 [2,0,0,0,0,0|2,0,0]=4 466 B10R1.13 CC1=CC=C(S(=O)O)C=C1 CS-W022214 [2,0,0,0,0,0|1,0,0]=3 467 B10R1.13 CC1=CC=C(S(=O)O)C=C1 CS-W022215 [2,0,0,0,0,0|1,0,0]=3 468 B10R1.13 CC1=CC=C(S(C)=O)C=C1 CS-0505662 [2,0,0,0,0,0|1,0,0]=3 469 B10R1.13 CC1=CC=C(S(N)=O)C=C1 CS-0153012 [2,0,0,0,0,0|2,0,0]=4 470 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 CS-0000299 [2,0,0,0,0,0|1,0,1]=4 471 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 CS-0086366 [2,0,0,0,0,0|0,0,2]=4 472 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 CS-0000292 [2,0,0,0,0,0|1,0,1]=4 473 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 CS-0153087 [2,0,0,0,0,0|1,0,1]=4 474 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 CS-M1249 [2,0,0,0,0,0|1,0,0]=3 475 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 CS-W019426 [2,0,0,0,0,0|2,0,0]=4 476 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 CS-0880560 [2,0,0,0,0,0|1,0,0]=3 477 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 CS-0041528 [2,0,0,0,0,0|2,0,0]=4 478 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS-0043751 [2,0,0,0,0,0|1,0,0]=3 479 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS-D1603 [2,0,0,0,0,0|1,0,0]=3 480 B10R1.13 CC1=CN=C(C(=O)O)C=N1 CS-0007012 [2,0,0,0,0,0|2,0,0]=4 481 B10R1.13 CC1=CN=C(C(=O)O)N=C1 CS-W022418 [2,0,0,0,0,0|2,0,0]=4 482 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS-W008333 [2,0,0,0,0,0|1,0,0]=3 483 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CS-W016511 [2,0,0,0,0,0|2,0,0]=4 484 B10R1.13 CC1=NC=C(C(N)=O)C=C1 CS-W016531 [2,0,0,0,0,0|2,0,0]=4 485 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS-W008911 [2,0,0,0,0,0|2,0,0]=4 486 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 CS-0096007 [2,0,0,0,0,0|2,0,0]=4 487 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 CS-0208117 [2,0,0,0,0,0|2,0,0]=4 488 B10R1.13 CS(=O)C1=CC=C(N)C=C1 CS-0376030 [2,0,0,0,0,0|2,0,0]=4 489 B10R1.13 CS(=O)C1=CC=C(O)C=C1 CS-0375674 [2,0,0,0,0,0|1,0,0]=3 490 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 CS-0162857 [2,0,0,0,0,0|1,0,1]=4 491 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 CS-0465173 [2,0,0,0,0,0|2,0,0]=4 492 B10R1.13 Cc1ccc(C(C)C)cc1 CS-0016226 [2,0,0,0,0,0|1,0,1]=4 493 B10R1.13 Cc1ccc(C(C)C)cc1 CS-M3206 [2,0,0,0,0,0|1,0,1]=4 494 B10R1.13 N=C(N)C1=CC=C(O)C=C1 CS-W017570 [2,0,0,0,0,0|2,0,0]=4 495 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 CS-W004151 [2,0,0,0,0,0|2,0,0]=4 496 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 CS-W019519 [2,0,0,0,0,0|2,0,0]=4 497 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS-W016478 [2,0,0,0,0,0|2,0,0]=4 498 B10R1.13 NC(=O)C1=CC=C(I)C=C1 CS-W016701 [2,0,0,0,0,0|2,0,0]=4 499 B10R1.13 NC(=O)C1=CC=C(N)C=C1 CS-W017757 [2,0,0,0,0,0|2,0,0]=4 500 B10R1.13 NC(=O)C1=CC=C(O)C=C1 CS-0130378 [2,0,0,0,0,0|1,0,0]=3 501 B10R1.13 NC(=O)C1=CN=C(O)C=C1 CS-0197190 [2,0,0,0,0,0|2,0,0]=4 502 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS-W018071 [2,0,0,0,0,0|1,1,0]=4 503 B10R1.13 NC1=CC=C(C(=O)O)C=C1 CS-4505 [2,0,0,0,0,0|1,0,0]=3 504 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS-D0614 [2,0,0,0,0,0|2,0,0]=4 505 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CS-W016509 [2,0,0,0,0,0|2,0,0]=4 506 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 CS-W020100 [2,0,0,0,0,0|1,0,0]=3 507 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS-0205288 [2,0,0,0,0,0|1,0,0]=3 508 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS-M3680 [2,0,0,0,0,0|1,0,0]=3 509 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 CS-D1204 [2,0,0,0,0,0|2,0,0]=4 510 B10R1.13 O=C(O)C1=CC=C(F)C=C1 CS-W014393 [2,0,0,0,0,0|1,0,0]=3 511 B10R1.13 O=C(O)C1=CC=C(F)N=C1 CS-W019722 [2,0,0,0,0,0|2,0,0]=4 512 B10R1.13 O=C(O)C1=CC=C(O)C=C1 CS-D1180 [2,0,0,0,0,0|0,0,0]=2 513 B10R1.13 O=C(O)C1=CC=C(O)N=C1 CS-W001996 [2,0,0,0,0,0|1,0,0]=3 514 B10R1.13 O=C(O)C1=CC=C(S)C=C1 CS-W018038 [2,0,0,0,0,0|0,1,0]=3 515 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 CS-W002864 [2,0,0,0,0,0|2,0,0]=4 516 B10R1.13 O=C(O)C1=CN=C(I)C=C1 CS-0463033 [2,0,0,0,0,0|2,0,0]=4 517 B10R1.13 O=C(O)C1=CN=C(O)N=C1 CS-0044024 [2,0,0,0,0,0|2,0,0]=4 518 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS-D0613 [2,0,0,0,0,0|2,0,0]=4 519 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS-W016216 [2,0,0,0,0,0|2,0,0]=4 520 B10R1.13 O=C(O)C1=NC=C(F)C=C1 CS-W003161 [2,0,0,0,0,0|2,0,0]=4 521 B10R1.13 O=C(O)C1=NC=C(I)C=C1 CS-W022397 [2,0,0,0,0,0|2,0,0]=4 522 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS-W002653 [2,0,0,0,0,0|1,0,0]=3 523 B10R1.13 O=C(O)C1=NC=C(O)N=C1 CS-0876 [2,0,0,0,0,0|2,0,0]=4 524 B10R1.13 O=C(O)C1=NN=C(O)C=C1 CS-0156743 [2,0,0,0,0,0|2,0,0]=4 525 B10R1.13 O=C(O)C1=NN=C(O)C=C1 CS-W005425 [2,0,0,0,0,0|2,0,0]=4 526 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 CS-0157531 [2,0,0,0,0,0|1,0,1]=4 527 B10R1.13 O=C1C=CC(C(=O)O)=CO1 CS-0001427 [2,0,0,0,0,0|1,0,1]=4 528 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 CS-0157405 [2,0,0,0,0,0|2,0,0]=4 529 B10R1.13 O=S(O)C1=CC=C(Cl)C=C1 CS-0613156 [2,0,0,0,0,0|2,0,0]=4 530 B10R1.13 OB(O)C1=CC=C(O)C=C1 CS-D1375 [2,0,0,0,0,0|1,0,1]=4 531 B10R1.1 CCCC1=CC=C(O)C=C1 CS-W018327 [2,0,0,0,0,0|1,0,1]=4 532 B10R1.1 CCOC1=CC=C(O)C=C1 CS-W016502 [2,0,0,0,0,0|2,0,0]=4 533 B10R1.1 CNCC1=CC=C(C)C=C1 CS-W003184 [2,0,0,0,0,0|1,0,1]=4 534 B10R1.1 CNCC1=CC=C(O)C=C1 CS-0169434 [2,0,0,0,0,0|1,0,1]=4 535 B10R1.1 COCC1=CC=C(Br)C=C1 CS-0149213 [2,0,0,0,0,0|1,0,1]=4 536 B10R1.1 COCC1=CC=C(Cl)C=C1 CS-0182615 [2,0,0,0,0,0|1,0,1]=4 537 B10R1.1 COCC1=CC=C(N)C=C1 CS-0150192 [2,0,0,0,0,0|1,0,1]=4 538 B10R1.15 C=C(CC)C1=CC=CC=C1 CS-0187333 [2,0,0,0,0,0|2,0,0]=4 539 B10R1.15 CCC(=O)C1=CC=NC=C1 CS-0215468 [2,0,0,0,0,0|2,0,0]=4 540 B10R1.15 CNC(=O)C1=CC=CC=C1 CS-0114596 [2,0,0,0,0,0|1,0,0]=3 541 B10R1.15 CNC(=O)C1=CC=CN=C1 CS-0084271 [2,0,0,0,0,0|2,0,0]=4 542 B10R1.15 CNC(=O)C1=NC=CC=C1 CS-0181542 [2,0,0,0,0,0|2,0,0]=4 543 B10R1.15 CNC(=S)C1=CC=CC=C1 CS-0251442 [2,0,0,0,0,0|1,1,0]=4 544 B10R1.15 COC(=N)C1=CC=CC=N1 CS-0150962 [2,0,0,0,0,0|2,0,0]=4 545 B10R1.15 COC(=O)C1=CC=CC=N1 CS-W005458 [2,0,0,0,0,0|1,0,0]=3 546 B10R1.15 COC(=O)C1=CC=CN=C1 CS-D1355 [2,0,0,0,0,0|1,0,0]=3 547 B10R1.15 COC(=O)C1=CC=NC=C1 CS-D1405 [2,0,0,0,0,0|1,0,0]=3 548 B10R1.15 COC(=O)C1=CC=NC=N1 CS-0036314 [2,0,0,0,0,0|2,0,0]=4 549 B10R1.15 COC(=O)C1=CN=CN=C1 CS-D0147 [2,0,0,0,0,0|2,0,0]=4 550 B10R1.15 COC(=O)C1=NC=CC=N1 CS-M2690 [2,0,0,0,0,0|2,0,0]=4 551 B10R1.15 COC(=O)C1=NC=CN=C1 CS-0080007 [2,0,0,0,0,0|2,0,0]=4 552 B10R1.15 COS(=O)C1=CC=CC=C1 CS-M2210 [2,0,0,0,0,0|1,0,0]=3 553 B10R1.15 NCC(=O)C1=CC=CC=C1 CS-W002084 [2,0,0,0,0,0|2,0,0]=4 554 B10R1.15 NNC(=O)C1=CC=CC=C1 CS-W017759 [2,0,0,0,0,0|2,0,0]=4 555 B10R1.15 O=C(CO)C1=CC=CC=C1 CS-W002198 [2,0,0,0,0,0|2,0,0]=4 556 B10R1.15 O=C(NO)C1=CC=CC=C1 CS-0016051 [2,0,0,0,0,0|2,0,0]=4 557 B10R1.15 O=C(O[K])C1=CC=CC=C1 CS-0156574 [2,0,0,0,0,0|1,0,0]=3 558 B10R1.15 O=C(O[Na])C1=CC=CC=C1 CS-0017788 [2,0,0,0,0,0|1,0,0]=3 559 B10R1.15 O=CC(=O)C1=CC=CC=C1 CS-0130526 [2,0,0,0,0,0|2,0,0]=4 560 B10R1.15 O=S(O[Na])C1=CC=CC=C1 CS-W014314 [2,0,0,0,0,0|2,0,0]=4 561 B10R1.15 O=[PH](O[Na])C1=CC=CC=C1 CS-0434157 [2,0,0,0,0,0|2,0,0]=4 562 B10R1.15 [Li]OC(=O)C1=CC=CC=C1 CS-0013645 [2,0,0,0,0,0|1,0,0]=3 563 B12R1.6 CCC1=CC=C(S(=O)(=O)O)C=C1 CS-0069969 [1,1,0,0,0,0|2,0,0]=4 564 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 CS-0071956 [1,1,0,0,0,0|1,0,1]=4 565 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 CS-0112813 [1,1,0,0,0,0|1,0,1]=4 566 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 CS-0431707 [1,1,0,0,0,0|1,0,1]=4 567 B12R1.6 COC1=CC=C(C(C)(C)O)C=C1 CS-0455412 [1,1,0,0,0,0|0,0,2]=4 568 B12R1.6 COC1=CC=C(S(=O)(=O)Cl)C=C1 CS-W004070 [1,1,0,0,0,0|1,0,1]=4 569 B12R1.6 COC1=CC=C(S(C)(=N)=O)C=C1 CS-0455656 [1,1,0,0,0,0|1,0,0]=3 570 B12R1.6 COC1=CC=C(S(N)(=O)=O)C=C1 CS-0136485 [1,1,0,0,0,0|1,0,1]=4 571 B12R1.48 C#CC1=CC=C(C(=O)O)C=C1C CS-0160825 [1,1,0,0,0,0|1,0,1]=4 572 B12R1.48 CC(=O)C1=CC=C(C#N)C(C)=C1 CS-0138675 [1,1,0,0,0,0|2,0,0]=4 573 B12R1.48 CC(=O)C1=CC=C(C#N)C(F)=C1 CS-0030459 [1,1,0,0,0,0|2,0,0]=4 574 B12R1.48 CC1=CC(C(=O)O)=CC=C1C#N CS-W003864 [1,1,0,0,0,0|2,0,0]=4 575 B12R1.48 CC1=CC(C(=O)O)=CC=C1C=O CS-0196056 [1,1,0,0,0,0|2,0,0]=4 576 B12R1.48 CCC1=CC=C(C(=O)O)C=C1N CS-0030449 [1,1,0,0,0,0|1,0,0]=3 577 B12R1.48 CCN1C=CC(C(=O)O)=CC1=O CS-0076030 [1,1,0,0,0,0|2,0,0]=4 578 B12R1.48 CNC1=C(I)C=C(C(=O)O)C=C1 CS-0151039 [1,1,0,0,0,0|1,0,0]=3 579 B12R1.48 CNC1=C(N)C=C(C(=O)O)C=C1 CS-W006930 [1,1,0,0,0,0|1,0,0]=3 580 B12R1.48 CNC1=C(N)C=C(C(C)=O)C=C1 CS-0313267 [1,1,0,0,0,0|1,0,0]=3 581 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 CS-W002124 [1,1,0,0,0,0|0,0,0]=2 582 B12R1.48 COC1=C(Br)N=C(C(=O)O)C=C1 CS-0046118 [1,1,0,0,0,0|1,0,0]=3 583 B12R1.48 COC1=C(C)C=C(C(=O)O)C=N1 CS-0036768 [1,1,0,0,0,0|1,0,0]=3 584 B12R1.48 COC1=C(Cl)C=C(B(O)O)C=C1 CS-W000885 [1,1,0,0,0,0|1,0,1]=4 585 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 CS-W016880 [1,1,0,0,0,0|0,0,0]=2 586 B12R1.48 COC1=C(Cl)N=C(C(=O)O)C=C1 CS-0181078 [1,1,0,0,0,0|1,0,0]=3 587 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 CS-W017706 [1,1,0,0,0,0|0,0,0]=2 588 B12R1.48 COC1=C(F)C=C(C(=O)O)C=N1 CS-0030501 [1,1,0,0,0,0|1,0,0]=3 589 B12R1.48 COC1=C(F)C=C(C(C)=O)C=N1 CS-0513783 [1,1,0,0,0,0|1,0,0]=3 590 B12R1.48 COC1=C(F)C=C([C@@H](C)N)C=C1 CS-0158205 [1,1,0,0,0,0|1,0,1]=4 591 B12R1.48 COC1=C(I)C=C(C(C)=O)C=C1 CS-0257733 [1,1,0,0,0,0|0,0,0]=2 592 B12R1.48 COC1=C(I)C=C([N+](=O)[O-])C=C1 CS-W023099 [1,1,0,0,0,0|1,0,1]=4 593 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 CS-W017841 [1,1,0,0,0,0|0,0,0]=2 594 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 CS-0174504 [1,1,0,0,0,0|1,0,1]=4 595 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 CS-W014300 [1,1,0,0,0,0|0,0,0]=2 596 B12R1.48 COC1=CC=C(B(O)O)C=C1C CS-W016067 [1,1,0,0,0,0|1,0,1]=4 597 B12R1.48 COC1=CC=C(B(O)O)C=C1F CS-0007621 [1,1,0,0,0,0|1,0,1]=4 598 B12R1.48 COC1=CC=C(B(O)O)C=C1N CS-0179245 [1,1,0,0,0,0|1,0,1]=4 599 B12R1.48 COC1=CC=C(C(=O)O)C=C1C CS-B0787 [1,1,0,0,0,0|0,0,0]=2 600 B12R1.48 COC1=CC=C(C(=O)O)C=C1I CS-0113079 [1,1,0,0,0,0|0,0,0]=2 601 B12R1.48 COC1=CC=C(C(C)=O)C=C1Br CS-W021215 [1,1,0,0,0,0|0,0,0]=2 602 B12R1.48 COC1=CC=C(C(C)=O)C=C1C CS-0105545 [1,1,0,0,0,0|0,0,0]=2 603 B12R1.48 COC1=CC=C(C(C)=O)C=C1Cl CS-0144576 [1,1,0,0,0,0|0,0,0]=2 604 B12R1.48 COC1=CC=C(C(C)=O)C=C1F CS-W017811 [1,1,0,0,0,0|0,0,0]=2 605 B12R1.48 COC1=CC=C(C(C)=O)C=C1O CS-W002484 [1,1,0,0,0,0|0,0,0]=2 606 B12R1.48 COC1=CC=C(C(C)N)C=C1C CS-0626976 [1,1,0,0,0,0|1,0,1]=4 607 B12R1.48 COC1=CC=C(C(C)N)C=C1F CS-0094690 [1,1,0,0,0,0|1,0,1]=4 608 B12R1.48 COC1=CC=C(C(C)N)C=C1F CS-0161942 [1,1,0,0,0,0|1,0,1]=4 609 B12R1.48 COC1=CC=C(C(C)O)C=C1Br CS-0275082 [1,1,0,0,0,0|0,0,2]=4 610 B12R1.48 COC1=CC=C(C(N)=O)C=C1N CS-0116116 [1,1,0,0,0,0|1,0,0]=3 611 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Br CS-0015276 [1,1,0,0,0,0|1,0,1]=4 612 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1C CS-W017843 [1,1,0,0,0,0|1,0,1]=4 613 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Cl CS-0042705 [1,1,0,0,0,0|1,0,1]=4 614 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1F CS-0007667 [1,1,0,0,0,0|1,0,1]=4 615 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1N CS-0015286 [1,1,0,0,0,0|1,0,1]=4 616 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1O CS-B1762 [1,1,0,0,0,0|1,0,1]=4 617 B12R1.48 COC1=NC=C(C(=O)O)C=C1Br CS-0041802 [1,1,0,0,0,0|1,0,0]=3 618 B12R1.48 N#CC1=C(F)C=C(C(=O)O)C=C1 CS-W008427 [1,1,0,0,0,0|2,0,0]=4 619 B12R1.48 N#CC1=C(N)C=C(C(=O)O)C=C1 CS-0060338 [1,1,0,0,0,0|2,0,0]=4 620 B12R1.48 N#CC1=CC=C(C(=O)O)C=C1Cl CS-0098688 [1,1,0,0,0,0|2,0,0]=4 621 B12R1.48 O=C(O)C1=CC=C(CO)C(F)=C1 CS-0037901 [1,1,0,0,0,0|2,0,0]=4 622 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 CS-W006155 [1,1,0,0,0,0|2,0,0]=4 623 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 CS-0196054 [1,1,0,0,0,0|2,0,0]=4 624 B12R1.48 O=CC1=C(O)C=C(C(=O)O)C=C1 CS-W007759 [1,1,0,0,0,0|2,0,0]=4 625 B12R1.48 O=CC1=CC=C(C(=O)O)C=C1F CS-0094284 [1,1,0,0,0,0|2,0,0]=4 626 B12R1.113 CC#CC1=CC=C(C(=O)O)C=C1 CS-0435118 [1,1,0,0,0,0|1,0,0]=3 627 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 CS-W010855 [1,1,0,0,0,0|1,0,0]=3 628 B12R1.113 CCOC1=CC=C(B(O)O)C=C1 CS-W007778 [1,1,0,0,0,0|1,0,1]=4 629 B12R1.113 CCOC1=CC=C(C(=N)N)C=C1 CS-0262646 [1,1,0,0,0,0|2,0,0]=4 630 B12R1.113 CCOC1=CC=C(C(=O)O)C=C1 CS-W010810 [1,1,0,0,0,0|0,0,0]=2 631 B12R1.113 CCOC1=CC=C(C(=O)O)C=N1 CS-0070107 [1,1,0,0,0,0|1,0,0]=3 632 B12R1.113 CCOC1=CC=C(C(C)=O)C=C1 CS-W013245 [1,1,0,0,0,0|0,0,0]=2 633 B12R1.113 CCOC1=CC=C(C(C)O)C=C1 CS-0378137 [1,1,0,0,0,0|0,0,2]=4 634 B12R1.113 CCOC1=CC=C(C(N)=O)C=C1 CS-0197285 [1,1,0,0,0,0|1,0,0]=3 635 B12R1.113 CCOC1=CC=C([C@H](C)N)C=C1 CS-0260059 [1,1,0,0,0,0|1,0,1]=4 636 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 CS-0039245 [1,1,0,0,0,0|1,0,0]=3 637 B12R1.113 CCOC1=NC=C(C(C)=O)C=C1 CS-0151438 [1,1,0,0,0,0|1,0,0]=3 638 B12R1.113 CCSC1=CC=C(C(=O)O)C=C1 CS-0043619 [1,1,0,0,0,0|0,1,0]=3 639 B12R1.113 COCC1=CC=C(B(O)O)C=C1 CS-0150194 [1,1,0,0,0,0|1,0,1]=4 640 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 CS-0037806 [1,1,0,0,0,0|0,0,0]=2 641 B12R1.113 N#CCC1=CC=C(C(=O)O)C=C1 CS-W022012 [1,1,0,0,0,0|1,0,1]=4 642 B12R1.113 O=C(O)C1=CC=C(CCBr)C=C1 CS-W012985 [1,1,0,0,0,0|1,0,0]=3 643 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 CS-W021987 [1,1,0,0,0,0|1,0,0]=3 644 B12R1.113 O=CNC1=CC=C(C(=O)O)C=C1 CS-W017891 [1,1,0,0,0,0|1,0,1]=4 645 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 CS-D1037 [1,1,0,0,0,0|2,0,0]=4 646 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 CS-W001939 [1,1,0,0,0,0|1,0,0]=3 647 B12R1.256 CC(=O)C1=CC=C(C(C)=O)C=C1 CS-0155100 [1,1,0,0,0,0|1,0,0]=3 648 B12R1.256 CC(=O)C1=CC=C(C(F)F)C=C1 CS-0314224 [1,1,0,0,0,0|2,0,0]=4 649 B12R1.256 CC(=O)C1=CC=C(N(C)C)C=C1 CS-W007734 [1,1,0,0,0,0|1,0,0]=3 650 B12R1.256 CC(=O)C1=CC=C(N(C)C)N=C1 CS-0888256 [1,1,0,0,0,0|2,0,0]=4 651 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-W020570 [1,1,0,0,0,0|2,0,0]=4 652 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 CS-W014287 [1,1,0,0,0,0|1,0,0]=3 653 B12R1.256 CC(C)C1=NC=C(C(=O)O)C=C1 CS-0187222 [1,1,0,0,0,0|2,0,0]=4 654 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 CS-0005266 [1,1,0,0,0,0|1,0,0]=3 655 B12R1.256 CC(O)C1=CC=C(C(=O)O)C=C1 CS-W021982 [1,1,0,0,0,0|1,0,0]=3 656 B12R1.256 CC(O)C1=CC=C(C(N)=O)C=C1 CS-0154107 [1,1,0,0,0,0|2,0,0]=4 657 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=C1 CS-W019576 [1,1,0,0,0,0|1,0,0]=3 658 B12R1.256 CN(C)C1=CN=C(C(=O)O)C=C1 CS-0434874 [1,1,0,0,0,0|2,0,0]=4 659 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=C1 CS-B1321 [1,1,0,0,0,0|2,0,0]=4 660 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 CS-M0656 [1,1,0,0,0,0|1,0,0]=3 661 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 CS-D0241 [1,1,0,0,0,0|1,0,0]=3 662 B12R1.256 N=C(N)C1=CC=C(C(=O)O)C=C1 CS-W005595 [1,1,0,0,0,0|2,0,0]=4 663 B12R1.256 NC(=O)C1=CC=C(C(=O)O)C=C1 CS-0157588 [1,1,0,0,0,0|2,0,0]=4 664 B12R1.256 NC(=S)C1=CC=C(C(=O)O)C=C1 CS-0244622 [1,1,0,0,0,0|2,0,0]=4 665 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 CS-W019665 [1,1,0,0,0,0|2,0,0]=4 666 B12R1.256 O=C(O)C1=CC=C(C(=O)O)C=C1 CS-W010814 [1,1,0,0,0,0|2,0,0]=4 667 B12R1.256 O=C(O)C1=CC=C(C(F)F)C=C1 CS-0157587 [1,1,0,0,0,0|2,0,0]=4 668 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 CS-M3306 [1,1,0,0,0,0|2,0,0]=4 669 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 CS-W020075 [1,1,0,0,0,0|2,0,0]=4 670 B12R1.452 C#CC1=CC=C(C(=O)O)C(Cl)=C1 CS-0043172 [1,1,0,0,0,0|1,0,1]=4 671 B12R1.452 C#CC1=CC=C(C(=O)O)C(F)=C1 CS-0187006 [1,1,0,0,0,0|1,0,1]=4 672 B12R1.452 CC(=O)C1=CC=C(C#N)C=C1F CS-0197804 [1,1,0,0,0,0|2,0,0]=4 673 B12R1.452 CC1=CC(C#N)=CC=C1C(=O)O CS-0101366 [1,1,0,0,0,0|2,0,0]=4 674 B12R1.452 CC1=CC(C=O)=CC=C1C(=O)O CS-0112527 [1,1,0,0,0,0|2,0,0]=4 675 B12R1.452 COC1=CC(Br)=C(C(=O)O)C=C1 CS-W005678 [1,1,0,0,0,0|0,0,0]=2 676 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 CS-W016876 [1,1,0,0,0,0|0,0,0]=2 677 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=N1 CS-0372925 [1,1,0,0,0,0|1,0,0]=3 678 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 CS-0186222 [1,1,0,0,0,0|0,0,0]=2 679 B12R1.452 COC1=CC(Cl)=C([C@H](C)N)C=C1 CS-0197044 [1,1,0,0,0,0|1,0,1]=4 680 B12R1.452 COC1=CC(F)=C(B(O)O)C=C1 CS-W007883 [1,1,0,0,0,0|1,0,1]=4 681 B12R1.452 COC1=CC(F)=C([C@@H](C)N)C=C1 CS-0158213 [1,1,0,0,0,0|1,0,1]=4 682 B12R1.452 COC1=CC(F)=C([C@H](C)N)C=C1 CS-0158272 [1,1,0,0,0,0|1,0,1]=4 683 B12R1.452 COC1=CC(I)=C(C(=O)O)C=C1 CS-W005751 [1,1,0,0,0,0|0,0,0]=2 684 B12R1.452 COC1=CC(N)=C(C(N)=O)C=C1 CS-0451983 [1,1,0,0,0,0|1,0,0]=3 685 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 CS-0006868 [1,1,0,0,0,0|0,0,0]=2 686 B12R1.452 COC1=CC=C(B(O)O)C(C)=C1 CS-W002973 [1,1,0,0,0,0|1,0,1]=4 687 B12R1.452 COC1=CC=C(B(O)O)C(Cl)=C1 CS-D1033 [1,1,0,0,0,0|1,0,1]=4 688 B12R1.452 COC1=CC=C(C(=O)O)C(=O)N1 CS-0490150 [1,1,0,0,0,0|1,0,0]=3 689 B12R1.452 COC1=CC=C(C(=O)O)C(C)=C1 CS-W007937 [1,1,0,0,0,0|0,0,0]=2 690 B12R1.452 COC1=CC=C(C(=O)O)C(C)=N1 CS-0183609 [1,1,0,0,0,0|1,0,0]=3 691 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 CS-0108677 [1,1,0,0,0,0|1,0,0]=3 692 B12R1.452 COC1=CC=C(C(=O)O)C(F)=C1 CS-W002640 [1,1,0,0,0,0|0,0,0]=2 693 B12R1.452 COC1=CC=C(C(=O)O)C(N)=C1 CS-B0778 [1,1,0,0,0,0|0,0,0]=2 694 B12R1.452 COC1=CC=C(C(=O)[O-])C(O)=C1 CS-0150500 [1,1,0,0,0,0|0,0,1]=3 695 B12R1.452 COC1=CC=C(C(C)=O)C(Br)=C1 CS-0130358 [1,1,0,0,0,0|0,0,0]=2 696 B12R1.452 COC1=CC=C(C(C)=O)C(C)=C1 CS-0105511 [1,1,0,0,0,0|0,0,0]=2 697 B12R1.452 COC1=CC=C(C(C)=O)C(F)=C1 CS-W008763 [1,1,0,0,0,0|0,0,0]=2 698 B12R1.452 COC1=CC=C(C(C)=O)C(N)=C1 CS-0040295 [1,1,0,0,0,0|0,0,0]=2 699 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 CS-4269 [1,1,0,0,0,0|0,0,0]=2 700 B12R1.452 COC1=CC=C([N+](=O)[O-])C(Br)=C1 CS-W005563 [1,1,0,0,0,0|1,0,1]=4 701 B12R1.452 COC1=CC=C([N+](=O)[O-])C(C)=C1 CS-W017846 [1,1,0,0,0,0|1,0,1]=4 702 B12R1.452 COC1=CC=C([N+](=O)[O-])C(Cl)=C1 CS-0028772 [1,1,0,0,0,0|1,0,1]=4 703 B12R1.452 COC1=CC=C([N+](=O)[O-])C(F)=C1 CS-D1687 [1,1,0,0,0,0|1,0,1]=4 704 B12R1.452 COC1=CC=C([N+](=O)[O-])C(I)=C1 CS-0112224 [1,1,0,0,0,0|1,0,1]=4 705 B12R1.452 COC1=CC=C([N+](=O)[O-])C(N)=C1 CS-M1392 [1,1,0,0,0,0|1,0,1]=4 706 B12R1.452 COC1=CC=C([N+](=O)[O-])C(O)=C1 CS-W000056 [1,1,0,0,0,0|1,0,1]=4 707 B12R1.452 COC1=NC=C(C(=O)O)C(C)=C1 CS-0210523 [1,1,0,0,0,0|1,0,0]=3 708 B12R1.452 CSC1=CC=C(C(=O)O)C(C)=C1 CS-0102823 [1,1,0,0,0,0|0,1,0]=3 709 B12R1.452 N#CC1=CC(F)=C(C(=O)O)C=C1 CS-W008006 [1,1,0,0,0,0|2,0,0]=4 710 B12R1.452 N#CC1=CC=C(C(=O)O)C(Cl)=C1 CS-0042704 [1,1,0,0,0,0|2,0,0]=4 711 B12R1.452 NNC1=CC=C(C(=O)O)C(Cl)=C1 CS-0161367 [1,1,0,0,0,0|2,0,0]=4 712 B12R1.452 O=C(O)C1=CC=C(CO)C=C1Cl CS-0132532 [1,1,0,0,0,0|2,0,0]=4 713 B12R1.452 O=C(O)C1=CC=C(CO)C=C1F CS-0097075 [1,1,0,0,0,0|2,0,0]=4 714 B12R1.452 O=CC1=CC(F)=C(C(=O)O)C=C1 CS-0157114 [1,1,0,0,0,0|2,0,0]=4 715 B12R1.452 O=CC1=CC=C(C(=O)O)C(Cl)=C1 CS-0099139 [1,1,0,0,0,0|2,0,0]=4 716 B12R1.9 CC1=CC=C(S(=O)(=O)O[Na])C=C1 CS-W004048 [1,1,0,0,0,0|2,0,0]=4 717 B12R1.9 CNS(=O)(=O)C1=CC=C(C)C=C1 CS-W016946 [1,1,0,0,0,0|2,0,0]=4 718 B12R1.9 COS(=O)(=O)C1=CC=C(Cl)C=C1 CS-0654679 [1,1,0,0,0,0|2,0,0]=4 719 B12R1.9 CSS(=O)(=O)C1=CC=C(C)C=C1 CS-0215789 [1,1,0,0,0,0|1,1,0]=4 720 B12R1.16 CC1=CC=C(C(=O)CC#N)C=C1 CS-0113013 [1,1,0,0,0,0|1,0,1]=4 721 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 CS-W017075 [1,1,0,0,0,0|1,0,0]=3 722 B12R1.16 CCCC(=O)C1=CC=C(Br)C=C1 CS-0152468 [1,1,0,0,0,0|2,0,0]=4 723 B12R1.16 CCCC(=O)C1=CC=C(Cl)C=C1 CS-0179364 [1,1,0,0,0,0|2,0,0]=4 724 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 CS-W007730 [1,1,0,0,0,0|1,0,0]=3 725 B12R1.16 CCOC(=O)C1=CC=C(Br)N=C1 CS-W022712 [1,1,0,0,0,0|2,0,0]=4 726 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 CS-W020602 [1,1,0,0,0,0|0,0,0]=2 727 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 CS-0040862 [1,1,0,0,0,0|1,0,0]=3 728 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 CS-W016987 [1,1,0,0,0,0|1,0,0]=3 729 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 CS-W017810 [1,1,0,0,0,0|1,0,0]=3 730 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 CS-W007981 [1,1,0,0,0,0|1,0,0]=3 731 B12R1.16 CCOC(=O)C1=CC=C(I)N=C1 CS-0513679 [1,1,0,0,0,0|2,0,0]=4 732 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 CS-0030766 [1,1,0,0,0,0|1,0,0]=3 733 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 CS-B0934 [1,1,0,0,0,0|1,0,0]=3 734 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 CS-4403 [1,1,0,0,0,0|0,0,0]=2 735 B12R1.16 CCOC(=O)C1=CC=C(O)N=N1 CS-0071566 [1,1,0,0,0,0|2,0,0]=4 736 B12R1.16 CCOC(=O)C1=CN=C(C)C=N1 CS-0151705 [1,1,0,0,0,0|2,0,0]=4 737 B12R1.16 CCOC(=O)C1=CN=C(C)N=C1 CS-0045943 [1,1,0,0,0,0|2,0,0]=4 738 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 CS-W002340 [1,1,0,0,0,0|2,0,0]=4 739 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 CS-W019557 [1,1,0,0,0,0|2,0,0]=4 740 B12R1.16 CCOC(=O)C1=CNC(=O)C=C1 CS-0029520 [1,1,0,0,0,0|1,0,1]=4 741 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 CS-0018759 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 CS-0019228 [1,1,0,0,0,0|1,0,0]=3 743 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 CS-0043157 [1,1,0,0,0,0|2,0,0]=4 744 B12R1.16 CCOC(=O)C1=NC=C(N)C=C1 CS-0043817 [1,1,0,0,0,0|2,0,0]=4 745 B12R1.16 COCC(=O)C1=CC=C(Cl)C=C1 CS-0237780 [1,1,0,0,0,0|1,0,0]=3 746 B12R1.16 COCC(=O)C1=CC=C(F)C=C1 CS-0464923 [1,1,0,0,0,0|1,0,0]=3 747 B12R1.16 COCC(=O)C1=CC=C(O)C=C1 CS-0150201 [1,1,0,0,0,0|0,0,0]=2 748 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 CS-W014113 [1,1,0,0,0,0|2,0,0]=4 749 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 CS-W015474 [1,1,0,0,0,0|2,0,0]=4 750 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 CS-0031428 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.20 CC(Br)C(=O)C1=CC=C(Br)C=C1 CS-W012184 [1,1,0,0,0,0|2,0,0]=4 752 B12R1.20 CC(Br)C(=O)C1=CC=C(F)C=C1 CS-W014180 [1,1,0,0,0,0|2,0,0]=4 753 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 CS-0131581 [1,1,0,0,0,0|2,0,0]=4 754 B12R1.20 CC(C)C(=O)C1=CC=C(O)C=C1 CS-0105543 [1,1,0,0,0,0|1,0,0]=3 755 B12R1.20 CC1=CC=C(C(=O)C(=O)O)C=C1 CS-0213122 [1,1,0,0,0,0|2,0,0]=4 756 B12R1.20 CC1=CC=C(C(=O)C(O)O)C=C1 CS-W019211 [1,1,0,0,0,0|2,0,0]=4 757 B12R1.20 CN(C)C(=O)C1=CC=C(Br)C=C1 CS-0130734 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 CS-0071544 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.20 CN(C)C(=O)C1=CC=C(O)C=C1 CS-0138027 [1,1,0,0,0,0|1,0,0]=3 760 B12R1.20 O=C(C1=CC=C(O)C=C1)C(O)O CS-0157460 [1,1,0,0,0,0|2,0,0]=4 761 B12R1.20 O=C(O)C(=O)C1=CC=C(O)C=C1 CS-0157461 [1,1,0,0,0,0|2,0,0]=4 762 B12R1.367 CCC(=O)C1=CC(Cl)=C(Cl)C=C1 CS-W015475 [1,1,0,0,0,0|2,0,0]=4 763 B12R1.367 CCC(=O)C1=CC(Cl)=C(O)C=C1 CS-0225540 [1,1,0,0,0,0|1,0,0]=3 764 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 CS-0152659 [1,1,0,0,0,0|2,0,0]=4 765 B12R1.367 CCC(=O)C1=CC=C(O)C(F)=C1 CS-0231785 [1,1,0,0,0,0|1,0,0]=3 766 B12R1.367 CNC(=O)C1=CC(F)=C(Br)C=C1 CS-0210060 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.367 CNC(=O)C1=CC=C(Br)C(C)=C1 CS-0192846 [1,1,0,0,0,0|2,0,0]=4 768 B12R1.367 CNC(=O)C1=CC=C(C)C(N)=C1 CS-0117132 [1,1,0,0,0,0|1,0,0]=3 769 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=C1 CS-W005030 [1,1,0,0,0,0|0,0,0]=2 770 B12R1.367 COC(=O)C1=CC(Br)=C(C)N=C1 CS-0061186 [1,1,0,0,0,0|1,0,0]=3 771 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 CS-W003131 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.367 COC(=O)C1=CC(Br)=C(F)C=C1 CS-W005915 [1,1,0,0,0,0|1,0,0]=3 773 B12R1.367 COC(=O)C1=CC(Br)=C(F)N=C1 CS-0172499 [1,1,0,0,0,0|2,0,0]=4 774 B12R1.367 COC(=O)C1=CC(Br)=C(I)C=C1 CS-W014281 [1,1,0,0,0,0|1,0,0]=3 775 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 CS-W012965 [1,1,0,0,0,0|1,0,0]=3 776 B12R1.367 COC(=O)C1=CC(Br)=C(N)N=C1 CS-W003325 [1,1,0,0,0,0|2,0,0]=4 777 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 CS-W007901 [1,1,0,0,0,0|0,0,0]=2 778 B12R1.367 COC(=O)C1=CC(Br)=C(O)N=C1 CS-0061828 [1,1,0,0,0,0|1,0,0]=3 779 B12R1.367 COC(=O)C1=CC(C)=C(F)N=C1 CS-0038004 [1,1,0,0,0,0|2,0,0]=4 780 B12R1.367 COC(=O)C1=CC(C)=C(N)N=C1 CS-0100539 [1,1,0,0,0,0|2,0,0]=4 781 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)N=C1 CS-0314549 [1,1,0,0,0,0|2,0,0]=4 782 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=C1 CS-W016985 [1,1,0,0,0,0|0,0,0]=2 783 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)C=C1 CS-0061821 [1,1,0,0,0,0|1,0,0]=3 784 B12R1.367 COC(=O)C1=CC(Cl)=C(Cl)N=C1 CS-WAA0049 [1,1,0,0,0,0|2,0,0]=4 785 B12R1.367 COC(=O)C1=CC(Cl)=C(F)C=C1 CS-W006070 [1,1,0,0,0,0|1,0,0]=3 786 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 CS-W016935 [1,1,0,0,0,0|1,0,0]=3 787 B12R1.367 COC(=O)C1=CC(Cl)=C(N)N=C1 CS-0456404 [1,1,0,0,0,0|2,0,0]=4 788 B12R1.367 COC(=O)C1=CC(Cl)=C(O)C=C1 CS-W007871 [1,1,0,0,0,0|0,0,0]=2 789 B12R1.367 COC(=O)C1=CC(F)=C(Br)C=C1 CS-W005414 [1,1,0,0,0,0|1,0,0]=3 790 B12R1.367 COC(=O)C1=CC(F)=C(C)N=C1 CS-0012613 [1,1,0,0,0,0|1,0,0]=3 791 B12R1.367 COC(=O)C1=CC(F)=C(Cl)C=C1 CS-W002513 [1,1,0,0,0,0|1,0,0]=3 792 B12R1.367 COC(=O)C1=CC(F)=C(Cl)N=C1 CS-0181862 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.367 COC(=O)C1=CC(F)=C(F)C=C1 CS-W017623 [1,1,0,0,0,0|1,0,0]=3 794 B12R1.367 COC(=O)C1=CC(F)=C(N)C=C1 CS-M0954 [1,1,0,0,0,0|1,0,0]=3 795 B12R1.367 COC(=O)C1=CC(F)=C(N)N=C1 CS-0149402 [1,1,0,0,0,0|2,0,0]=4 796 B12R1.367 COC(=O)C1=CC(F)=C(O)C=C1 CS-W005048 [1,1,0,0,0,0|0,0,0]=2 797 B12R1.367 COC(=O)C1=CC(I)=C(Cl)N=C1 CS-0012611 [1,1,0,0,0,0|2,0,0]=4 798 B12R1.367 COC(=O)C1=CC(I)=C(N)C=C1 CS-W007631 [1,1,0,0,0,0|1,0,0]=3 799 B12R1.367 COC(=O)C1=CC(I)=C(N)N=C1 CS-0082262 [1,1,0,0,0,0|2,0,0]=4 800 B12R1.367 COC(=O)C1=CC(I)=C(O)N=C1 CS-0081055 [1,1,0,0,0,0|1,0,0]=3 801 B12R1.367 COC(=O)C1=CC(N)=C(Br)C=C1 CS-W004909 [1,1,0,0,0,0|1,0,0]=3 802 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 CS-W010822 [1,1,0,0,0,0|0,0,0]=2 803 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 CS-W019434 [1,1,0,0,0,0|1,0,0]=3 804 B12R1.367 COC(=O)C1=CC(N)=C(I)C=C1 CS-W008063 [1,1,0,0,0,0|1,0,0]=3 805 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 CS-W007431 [1,1,0,0,0,0|1,0,0]=3 806 B12R1.367 COC(=O)C1=CC(N)=C(N)N=C1 CS-0169414 [1,1,0,0,0,0|2,0,0]=4 807 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 CS-W005637 [1,1,0,0,0,0|0,0,0]=2 808 B12R1.367 COC(=O)C1=CC(O)=C(Br)C=C1 CS-W007973 [1,1,0,0,0,0|1,0,0]=3 809 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 CS-W003784 [1,1,0,0,0,0|1,0,0]=3 810 B12R1.367 COC(=O)C1=CC(O)=C(Cl)N=C1 CS-0037678 [1,1,0,0,0,0|2,0,0]=4 811 B12R1.367 COC(=O)C1=CC(O)=C(F)C=C1 CS-0188238 [1,1,0,0,0,0|1,0,0]=3 812 B12R1.367 COC(=O)C1=CC(O)=C(N)N=C1 CS-0103307 [1,1,0,0,0,0|2,0,0]=4 813 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=C1 CS-W008076 [1,1,0,0,0,0|1,0,0]=3 814 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=N1 CS-0152811 [1,1,0,0,0,0|2,0,0]=4 815 B12R1.367 COC(=O)C1=CC=C(Br)C(Cl)=C1 CS-0036923 [1,1,0,0,0,0|1,0,0]=3 816 B12R1.367 COC(=O)C1=CC=C(Br)C(I)=C1 CS-0132101 [1,1,0,0,0,0|1,0,0]=3 817 B12R1.367 COC(=O)C1=CC=C(C)C(C)=C1 CS-0187734 [1,1,0,0,0,0|0,0,0]=2 818 B12R1.367 COC(=O)C1=CC=C(C)C(F)=C1 CS-W022829 [1,1,0,0,0,0|0,0,0]=2 819 B12R1.367 COC(=O)C1=CC=C(C)C(I)=C1 CS-0007663 [1,1,0,0,0,0|0,0,0]=2 820 B12R1.367 COC(=O)C1=CC=C(C)C(O)=C1 CS-0099370 [1,1,0,0,0,0|0,0,0]=2 821 B12R1.367 COC(=O)C1=CC=C(Cl)C(=O)N1 CS-0375860 [1,1,0,0,0,0|2,0,0]=4 822 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=C1 CS-0095864 [1,1,0,0,0,0|1,0,0]=3 823 B12R1.367 COC(=O)C1=CC=C(Cl)C(I)=C1 CS-0094444 [1,1,0,0,0,0|1,0,0]=3 824 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 CS-W016934 [1,1,0,0,0,0|1,0,0]=3 825 B12R1.367 COC(=O)C1=CC=C(F)C(Br)=N1 CS-0081033 [1,1,0,0,0,0|2,0,0]=4 826 B12R1.367 COC(=O)C1=CC=C(F)C(C)=C1 CS-W003270 [1,1,0,0,0,0|1,0,0]=3 827 B12R1.367 COC(=O)C1=CC=C(F)C(I)=C1 CS-0105536 [1,1,0,0,0,0|1,0,0]=3 828 B12R1.367 COC(=O)C1=CC=C(I)C(C)=C1 CS-W008413 [1,1,0,0,0,0|1,0,0]=3 829 B12R1.367 COC(=O)C1=CC=C(I)C(Cl)=C1 CS-0038909 [1,1,0,0,0,0|1,0,0]=3 830 B12R1.367 COC(=O)C1=CC=C(I)C(F)=C1 CS-0131364 [1,1,0,0,0,0|1,0,0]=3 831 B12R1.367 COC(=O)C1=CC=C(I)C(O)=C1 CS-W018915 [1,1,0,0,0,0|1,0,0]=3 832 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 CS-W002375 [1,1,0,0,0,0|1,0,0]=3 833 B12R1.367 COC(=O)C1=CC=C(N)C(O)=C1 CS-W000706 [1,1,0,0,0,0|1,0,0]=3 834 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=N1 CS-B1159 [1,1,0,0,0,0|1,0,0]=3 835 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 CS-W005275 [1,1,0,0,0,0|0,0,0]=2 836 B12R1.367 COC(=O)C1=CC=C(O)C(I)=C1 CS-W019910 [1,1,0,0,0,0|0,0,0]=2 837 B12R1.367 COC(=O)C1=CC=C(O)C(O)=C1 CS-Z0026 [1,1,0,0,0,0|0,0,0]=2 838 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 CS-W010801 [1,1,0,0,0,0|1,0,1]=4 839 B12R1.367 COC(=O)C1=CN=C(Br)C(F)=C1 CS-0081032 [1,1,0,0,0,0|2,0,0]=4 840 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=C1 CS-0153169 [1,1,0,0,0,0|2,0,0]=4 841 B12R1.367 COC(=O)C1=CN=C(Cl)C(N)=C1 CS-0082263 [1,1,0,0,0,0|2,0,0]=4 842 B12R1.367 COC(=O)C1=CN=C(I)C(Br)=C1 CS-0468892 [1,1,0,0,0,0|2,0,0]=4 843 B12R1.367 COC(=O)C1=CNC(=O)C(N)=C1 CS-0377027 [1,1,0,0,0,0|1,0,1]=4 844 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 CS-0106191 [1,1,0,0,0,0|1,0,1]=4 845 B12R1.367 COC(=O)C1=NC(Br)=C(Br)C=C1 CS-0150757 [1,1,0,0,0,0|2,0,0]=4 846 B12R1.367 COC(=O)C1=NC(Br)=C(C)C=C1 CS-0041846 [1,1,0,0,0,0|1,0,0]=3 847 B12R1.367 COC(=O)C1=NC(Br)=C(C)N=C1 CS-0160527 [1,1,0,0,0,0|2,0,0]=4 848 B12R1.367 COC(=O)C1=NC(Br)=C(Cl)C=C1 CS-0150754 [1,1,0,0,0,0|2,0,0]=4 849 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 CS-0043794 [1,1,0,0,0,0|2,0,0]=4 850 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 CS-0150755 [1,1,0,0,0,0|2,0,0]=4 851 B12R1.367 COC(=O)C1=NC(Cl)=C(C)C=C1 CS-W022878 [1,1,0,0,0,0|1,0,0]=3 852 B12R1.367 COC(=O)C1=NC(Cl)=C(Cl)C=C1 CS-0109598 [1,1,0,0,0,0|2,0,0]=4 853 B12R1.367 COC(=O)C1=NC(Cl)=C(F)C=C1 CS-0150753 [1,1,0,0,0,0|2,0,0]=4 854 B12R1.367 COC(=O)C1=NC(F)=C(Br)C=C1 CS-0312388 [1,1,0,0,0,0|2,0,0]=4 855 B12R1.367 COC(=O)C1=NC(I)=C(N)C=C1 CS-0080246 [1,1,0,0,0,0|2,0,0]=4 856 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 CS-W000596 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.367 COC(=O)C1=NC(N)=C(Cl)C=C1 CS-0132511 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.367 COC(=O)C1=NC(O)=C(Br)C=C1 CS-W006157 [1,1,0,0,0,0|2,0,0]=4 859 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 CS-W009204 [1,1,0,0,0,0|2,0,0]=4 860 B12R1.367 COC(=O)C1=NC=C(Br)C(N)=C1 CS-0081631 [1,1,0,0,0,0|2,0,0]=4 861 B12R1.367 COC(=O)C1=NC=C(C)C(Br)=C1 CS-0152864 [1,1,0,0,0,0|1,0,0]=3 862 B12R1.367 COC(=O)C1=NC=C(C)C(Cl)=C1 CS-0018838 [1,1,0,0,0,0|1,0,0]=3 863 B12R1.367 COC(=O)C1=NC=C(Cl)C(Br)=C1 CS-0160801 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.367 COC(=O)C1=NC=C(Cl)C(Cl)=C1 CS-0150748 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.367 COC(=O)C1=NC=C(N)C(Br)=C1 CS-0037399 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.367 NNC(=O)C1=CC(O)=C(O)C=C1 CS-0149904 [1,1,0,0,0,0|2,0,0]=4 867 B12R1.367 O=C(O[Na])C1=CC=C(F)C(Cl)=C1 CS-0159923 [1,1,0,0,0,0|2,0,0]=4 868 B12R1.1703 CC1=CC=C(C(=O)NN)C(C)=C1 CS-0237536 [1,1,0,0,0,0|2,0,0]=4 869 B12R1.1703 CC1=CC=C(C(=O)NN)C(O)=C1 CS-0541409 [1,1,0,0,0,0|2,0,0]=4 870 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 CS-W017703 [1,1,0,0,0,0|2,0,0]=4 871 B12R1.1703 CCC(=O)C1=CC=C(Br)C=C1F CS-0152653 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.1703 CCC(=O)C1=CC=C(O)C=C1O CS-0310660 [1,1,0,0,0,0|1,0,0]=3 873 B12R1.1703 CNC(=O)C1=C(Br)C=C(F)C=C1 CS-0061779 [1,1,0,0,0,0|2,0,0]=4 874 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 CS-0062053 [1,1,0,0,0,0|2,0,0]=4 875 B12R1.1703 CNC(=O)C1=C(F)C=C(N)C=C1 CS-M1520 [1,1,0,0,0,0|2,0,0]=4 876 B12R1.1703 CNC(=O)C1=CC=C(Br)C=C1F CS-0008505 [1,1,0,0,0,0|2,0,0]=4 877 B12R1.1703 CNC(=O)C1=CC=C(Cl)C=C1Br CS-0311914 [1,1,0,0,0,0|2,0,0]=4 878 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 CS-W005363 [1,1,0,0,0,0|0,0,0]=2 879 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=N1 CS-0153352 [1,1,0,0,0,0|1,0,0]=3 880 B12R1.1703 COC(=O)C1=C(Br)C=C(C)N=C1 CS-0468546 [1,1,0,0,0,0|1,0,0]=3 881 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=N1 CS-0193496 [1,1,0,0,0,0|2,0,0]=4 882 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)N=C1 CS-0040505 [1,1,0,0,0,0|2,0,0]=4 883 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 CS-0041783 [1,1,0,0,0,0|1,0,0]=3 884 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=N1 CS-0150873 [1,1,0,0,0,0|2,0,0]=4 885 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 CS-0139258 [1,1,0,0,0,0|1,0,0]=3 886 B12R1.1703 COC(=O)C1=C(C)C=C(Cl)N=C1 CS-0145306 [1,1,0,0,0,0|2,0,0]=4 887 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 CS-0041219 [1,1,0,0,0,0|1,0,0]=3 888 B12R1.1703 COC(=O)C1=C(C)C=C(N)N=C1 CS-0242014 [1,1,0,0,0,0|2,0,0]=4 889 B12R1.1703 COC(=O)C1=C(C)N=C(F)C=C1 CS-0043793 [1,1,0,0,0,0|2,0,0]=4 890 B12R1.1703 COC(=O)C1=C(Cl)C=C(Br)C=C1 CS-W003730 [1,1,0,0,0,0|1,0,0]=3 891 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 CS-W008330 [1,1,0,0,0,0|1,0,0]=3 892 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=C1 CS-W018864 [1,1,0,0,0,0|1,0,0]=3 893 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 CS-0081031 [1,1,0,0,0,0|2,0,0]=4 894 B12R1.1703 COC(=O)C1=C(Cl)N=C(C)C=C1 CS-W022805 [1,1,0,0,0,0|1,0,0]=3 895 B12R1.1703 COC(=O)C1=C(Cl)N=C(Cl)C=C1 CS-W005384 [1,1,0,0,0,0|2,0,0]=4 896 B12R1.1703 COC(=O)C1=C(Cl)N=C(N)C=C1 CS-0150858 [1,1,0,0,0,0|2,0,0]=4 897 B12R1.1703 COC(=O)C1=C(Cl)NC(=O)C=C1 CS-0617980 [1,1,0,0,0,0|1,0,1]=4 898 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 CS-W003269 [1,1,0,0,0,0|1,0,0]=3 899 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=N1 CS-0046913 [1,1,0,0,0,0|2,0,0]=4 900 B12R1.1703 COC(=O)C1=C(F)C=C(Cl)C=N1 CS-0313303 [1,1,0,0,0,0|2,0,0]=4 901 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 CS-W004937 [1,1,0,0,0,0|1,0,0]=3 902 B12R1.1703 COC(=O)C1=C(F)C=C(N)C=C1 CS-W004728 [1,1,0,0,0,0|1,0,0]=3 903 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=C1 CS-W008400 [1,1,0,0,0,0|0,0,0]=2 904 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 CS-0132568 [1,1,0,0,0,0|2,0,0]=4 905 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 CS-W004770 [1,1,0,0,0,0|1,0,0]=3 906 B12R1.1703 COC(=O)C1=C(N)C=C(Cl)C=C1 CS-W008083 [1,1,0,0,0,0|1,0,0]=3 907 B12R1.1703 COC(=O)C1=C(N)C=C(Cl)N=C1 CS-0044525 [1,1,0,0,0,0|2,0,0]=4 908 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 CS-W001513 [1,1,0,0,0,0|1,0,0]=3 909 B12R1.1703 COC(=O)C1=C(N)C=C(I)C=C1 CS-0041211 [1,1,0,0,0,0|1,0,0]=3 910 B12R1.1703 COC(=O)C1=C(N)N=C(Br)C=C1 CS-0198890 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.1703 COC(=O)C1=C(N)N=C(C)C=C1 CS-0161443 [1,1,0,0,0,0|1,0,0]=3 912 B12R1.1703 COC(=O)C1=C(N)N=C(Cl)C=C1 CS-0037235 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.1703 COC(=O)C1=C(O)C=C(Br)C=C1 CS-W004803 [1,1,0,0,0,0|1,0,0]=3 914 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 CS-W017871 [1,1,0,0,0,0|0,0,0]=2 915 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 CS-W002883 [1,1,0,0,0,0|1,0,0]=3 916 B12R1.1703 COC(=O)C1=C(O)C=C(I)C=C1 CS-W007286 [1,1,0,0,0,0|1,0,0]=3 917 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 CS-W017842 [1,1,0,0,0,0|1,0,0]=3 918 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 CS-W010792 [1,1,0,0,0,0|0,0,0]=2 919 B12R1.1703 COC(=O)C1=C(O)N=C(C)N=C1 CS-0061370 [1,1,0,0,0,0|2,0,0]=4 920 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Br CS-0037930 [1,1,0,0,0,0|1,0,0]=3 921 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1C CS-W003703 [1,1,0,0,0,0|1,0,0]=3 922 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1I CS-0101592 [1,1,0,0,0,0|1,0,0]=3 923 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1C CS-0139262 [1,1,0,0,0,0|2,0,0]=4 924 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1F CS-0527423 [1,1,0,0,0,0|2,0,0]=4 925 B12R1.1703 COC(=O)C1=CC=C(Br)NC1=O CS-0160538 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.1703 COC(=O)C1=CC=C(C)C=C1F CS-0012595 [1,1,0,0,0,0|0,0,0]=2 927 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N CS-0028743 [1,1,0,0,0,0|0,0,0]=2 928 B12R1.1703 COC(=O)C1=CC=C(C)NC1=O CS-0376621 [1,1,0,0,0,0|1,0,0]=3 929 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Br CS-W018703 [1,1,0,0,0,0|1,0,0]=3 930 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1C CS-0131376 [1,1,0,0,0,0|1,0,0]=3 931 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Cl CS-0040545 [1,1,0,0,0,0|1,0,0]=3 932 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1F CS-0065296 [1,1,0,0,0,0|1,0,0]=3 933 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1I CS-0041112 [1,1,0,0,0,0|1,0,0]=3 934 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1O CS-0037284 [1,1,0,0,0,0|1,0,0]=3 935 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1C CS-0139259 [1,1,0,0,0,0|2,0,0]=4 936 B12R1.1703 COC(=O)C1=CC=C(F)C=C1C CS-W019553 [1,1,0,0,0,0|1,0,0]=3 937 B12R1.1703 COC(=O)C1=CC=C(F)C=C1I CS-0062063 [1,1,0,0,0,0|1,0,0]=3 938 B12R1.1703 COC(=O)C1=CC=C(F)N=C1N CS-0568755 [1,1,0,0,0,0|2,0,0]=4 939 B12R1.1703 COC(=O)C1=CC=C(I)C=C1Br CS-0131362 [1,1,0,0,0,0|1,0,0]=3 940 B12R1.1703 COC(=O)C1=CC=C(I)C=C1Cl CS-0094435 [1,1,0,0,0,0|1,0,0]=3 941 B12R1.1703 COC(=O)C1=CC=C(I)C=C1F CS-0136617 [1,1,0,0,0,0|1,0,0]=3 942 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Br CS-0041853 [1,1,0,0,0,0|1,0,0]=3 943 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C CS-W003522 [1,1,0,0,0,0|1,0,0]=3 944 B12R1.1703 COC(=O)C1=CC=C(N)C=C1I CS-0131336 [1,1,0,0,0,0|1,0,0]=3 945 B12R1.1703 COC(=O)C1=CC=C(N)N=C1C CS-0061193 [1,1,0,0,0,0|2,0,0]=4 946 B12R1.1703 COC(=O)C1=CC=C(N)N=C1F CS-0438329 [1,1,0,0,0,0|2,0,0]=4 947 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Br CS-0133272 [1,1,0,0,0,0|0,0,0]=2 948 B12R1.1703 COC(=O)C1=CC=C(O)C=C1C CS-0038132 [1,1,0,0,0,0|0,0,0]=2 949 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Cl CS-W018652 [1,1,0,0,0,0|0,0,0]=2 950 B12R1.1703 COC(=O)C1=CC=C(O)C=C1N CS-0139554 [1,1,0,0,0,0|0,0,0]=2 951 B12R1.1703 COC(=O)C1=CC=C(O)N=C1C CS-0217859 [1,1,0,0,0,0|1,0,0]=3 952 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Br CS-W007188 [1,1,0,0,0,0|2,0,0]=4 953 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Cl CS-W022874 [1,1,0,0,0,0|2,0,0]=4 954 B12R1.1703 COC(=O)C1=CN=C(C)C=C1C CS-0153147 [1,1,0,0,0,0|1,0,0]=3 955 B12R1.1703 COC(=O)C1=CN=C(C)C=C1Cl CS-0081042 [1,1,0,0,0,0|1,0,0]=3 956 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl CS-W003200 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1I CS-0191901 [1,1,0,0,0,0|2,0,0]=4 958 B12R1.1703 COC(=O)C1=CN=C(O)C=C1O CS-0061857 [1,1,0,0,0,0|1,0,0]=3 959 B12R1.1703 COC(=O)C1=CNC(=O)C=C1C CS-0179478 [1,1,0,0,0,0|1,0,1]=4 960 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C CS-W004188 [1,1,0,0,0,0|2,0,0]=4 961 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl CS-W007073 [1,1,0,0,0,0|2,0,0]=4 962 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1N CS-0049130 [1,1,0,0,0,0|2,0,0]=4 963 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O CS-W022863 [1,1,0,0,0,0|2,0,0]=4 964 B12R1.1703 COC(=O)C1=NC=C(C)N=C1Cl CS-0107157 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Cl CS-0080811 [1,1,0,0,0,0|2,0,0]=4 966 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C CS-0153174 [1,1,0,0,0,0|2,0,0]=4 967 B12R1.1703 COC(=O)C1=NC=C(N)C=C1Cl CS-0054443 [1,1,0,0,0,0|2,0,0]=4 968 B12R1.1703 COC(=O)C1=NC=C(O)C=C1Cl CS-0067788 [1,1,0,0,0,0|1,0,0]=3 969 B12R1.1703 COC(=O)C1=NC=C(O)C=C1F CS-0049099 [1,1,0,0,0,0|1,0,0]=3 970 B12R1.1703 NNC(=O)C1=CC=C(O)C=C1O CS-0204866 [1,1,0,0,0,0|2,0,0]=4 971 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 CS-W002045 [1,1,0,0,0,0|1,0,1]=4 972 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 CS-0072050 [1,1,0,0,0,0|2,0,0]=4 973 B12R1.71 CCNCC1=CC=C(OC)C=C1 CS-D0539 [1,1,0,0,0,0|1,0,1]=4 974 B12R1.71 CCNCC1=CC=C(OC)C=C1 CS-D0586 [1,1,0,0,0,0|1,0,1]=4 975 B12R1.71 COC1=CC=C(CCCBr)C=C1 CS-0150357 [1,1,0,0,0,0|1,0,1]=4 976 B12R1.71 COC1=CC=C(CCCO)C=C1 CS-W010807 [1,1,0,0,0,0|1,0,1]=4 977 B12R1.71 COC1=CC=C(OCCN)C=C1 CS-0117201 [1,1,0,0,0,0|2,0,0]=4 978 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 CS-0144244 [1,1,0,0,0,0|1,0,1]=4 979 B12R1.116 CCOC1=CC=C(OCC)C=C1 CS-0105156 [1,1,0,0,0,0|2,0,0]=4 980 B12R1.288 CNCC1=CC(Cl)=C(OC)C=C1 CS-0242709 [1,1,0,0,0,0|1,0,1]=4 981 B12R1.288 CNCC1=CC(F)=C(OC)C=C1 CS-0301496 [1,1,0,0,0,0|1,0,1]=4 982 B12R1.63 CCC1=C(Br)C=C(C(=O)OC)S1 CS-0296548 [0,1,0,0,1,0|2,0,0]=4 983 B12R1.63 COC(=O)C1=CC(Br)=C(OC)S1 CS-0160802 [0,1,0,0,1,0|1,0,0]=3 984 B12R1.179 COC(=O)C1=CC=C(CCO)S1 CS-0150806 [0,1,0,0,1,0|2,0,0]=4 985 B12R1.359 COC(=O)C1=CC=C(C(C)=O)S1 CS-0452257 [0,1,0,0,1,0|2,0,0]=4 986 B12R1.608 COC(=O)C1=CC(OC)=NN1C CS-0059983 [0,1,0,0,1,0|2,0,0]=4 987 B14R1.3 COC1=CC=C(CC(=O)C(=O)O)C=C1 CS-0117029 [0,1,0,0,0,1|2,0,0]=4 988 B14R1.3 COC1=CC=C(NC(=O)C(=O)O)C=C1 CS-0452369 [0,1,0,0,0,1|2,0,0]=4 989 B14R1.7 COC(=O)C(Br)C1=CC=C(OC)C=C1 CS-0666304 [0,1,0,0,0,1|0,0,0]=2 990 B14R1.7 COC(=O)C(C)C1=CC=C(OC)C=C1 CS-0142922 [0,1,0,0,0,1|0,0,0]=2 991 B14R1.954 C#CC1=CC=C(CC(=O)OCC)C=C1 CS-0434273 [0,1,0,0,0,1|1,0,1]=4 992 B14R1.954 CCOC(=O)CC1=CC=C(C#N)C=C1 CS-W004161 [0,1,0,0,0,1|2,0,0]=4 993 B14R1.954 CCOC(=O)CC1=CC=C(C=O)C=C1 CS-0151601 [0,1,0,0,0,1|2,0,0]=4 994 B14R1.954 CCOC(=O)CC1=CC=C(CN)C=C1 CS-W006994 [0,1,0,0,0,1|2,0,0]=4 995 B14R1.954 CCOC(=O)CC1=CC=C(OC)C=C1 CS-0130376 [0,1,0,0,0,1|0,0,0]=2 996 B14R1.954 COC1=CC=C(NC(=O)CCN)C=C1 CS-0071798 [0,1,0,0,0,1|1,0,0]=3 997 B14R1.954 COC1=CC=C(NC(=O)\C=N/O)C=C1 CS-0314643 [0,1,0,0,0,1|2,0,0]=4 998 B14R1.2879 COC(=O)CC1=CC=C(B(O)O)C=C1 CS-0036604 [0,1,0,0,0,1|2,0,0]=4 999 B14R1.2879 COC(=O)CC1=CC=C(C(=O)O)C=C1 CS-0105464 [0,1,0,0,0,1|2,0,0]=4 1000 B14R1.2879 COC(=O)CC1=CC=C(C(C)=O)C=C1 CS-0254054 [0,1,0,0,0,1|1,0,0]=3 1001 B14R1.2879 COC(=O)CC1=CC=C([N+](=O)[O-])C=C1 CS-0038574 [0,1,0,0,0,1|2,0,0]=4 1002 B14R1.3276 COC(=O)CC1=CC=C(OC)C(Br)=C1 CS-0133112 [0,1,0,0,0,1|0,0,0]=2 1003 B14R1.212 COC1=CC=C(C(=O)C(F)(F)F)C=C1 CS-0028395 [0,2,0,0,0,0|2,0,0]=4 1004 B14R1.6402 CC(=O)C1=CC=C(C(=O)N(C)C)C=C1 CS-0155099 [0,2,0,0,0,0|2,0,0]=4 1005 B14R1.579 COC(=O)C1=C(Cl)C=C(C#N)C=C1Cl CS-0150877 [0,2,0,0,0,0|2,0,0]=4 1006 B14R1.579 COC(=O)C1=C(F)C=C(OC)C=C1F CS-0043182 [0,2,0,0,0,0|0,0,0]=2 1007 B14R1.1128 COC(=O)C1=C(Br)C=C(C(=O)O)C=C1 CS-0214954 [0,2,0,0,0,0|2,0,0]=4 1008 B14R1.1128 COC(=O)C1=C(C)C=C(B(O)O)C=C1 CS-0052984 [0,2,0,0,0,0|2,0,0]=4 1009 B14R1.1128 COC(=O)C1=C(Cl)C=C(B(O)O)C=C1 CS-W003327 [0,2,0,0,0,0|2,0,0]=4 1010 B14R1.1128 COC(=O)C1=C(F)C=C([N+](=O)[O-])C=C1 CS-W005079 [0,2,0,0,0,0|2,0,0]=4 1011 B14R1.1128 COC(=O)C1=CC=C(B(O)O)C=C1F CS-W010554 [0,2,0,0,0,0|2,0,0]=4 1012 B14R1.1128 COC(=O)C1=CC=C(C(=O)O)C=C1Cl CS-W019886 [0,2,0,0,0,0|2,0,0]=4 1013 B14R1.1128 COC(=O)C1=CC=C(C(=O)O)C=C1F CS-0132523 [0,2,0,0,0,0|2,0,0]=4 1014 B14R1.1128 COC(=O)C1=CC=C(N(=O)=O)C=C1N CS-0205109 [0,2,0,0,0,0|2,0,0]=4 1015 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1Br CS-D1683 [0,2,0,0,0,0|2,0,0]=4 1016 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1C CS-0044777 [0,2,0,0,0,0|2,0,0]=4 1017 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1Cl CS-0099155 [0,2,0,0,0,0|2,0,0]=4 1018 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1I CS-0131379 [0,2,0,0,0,0|2,0,0]=4 1019 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1O CS-0036685 [0,2,0,0,0,0|2,0,0]=4 1020 B14R1.2294 COC(=O)C1=CC(Br)=C(OC)C=C1C CS-0061241 [0,2,0,0,0,0|0,0,0]=2 1021 B14R1.2294 COC(=O)C1=CC(Br)=C(OC)C=C1N CS-0139472 [0,2,0,0,0,0|0,0,0]=2 1022 B14R1.2294 COC(=O)C1=CC(Br)=C(OC)C=C1O CS-0150600 [0,2,0,0,0,0|0,0,0]=2 1023 B14R1.2294 COC(=O)C1=CC(Cl)=C(OC)C=C1N CS-0140442 [0,2,0,0,0,0|0,0,0]=2 1024 B14R1.2294 COC(=O)C1=CC(F)=C(OC)N=C1Cl CS-0040077 [0,2,0,0,0,0|1,0,0]=3 1025 B14R1.2294 COC(=O)C1=CC(I)=C(OC)C=C1N CS-0140441 [0,2,0,0,0,0|0,0,0]=2 1026 B14R1.2294 COC(=O)C1=CC(N)=C(OC)C=C1F CS-0160731 [0,2,0,0,0,0|0,0,0]=2 1027 B14R1.2316 COC(=O)C1=CC=C(OC)C(Br)=C1C CS-0101998 [0,2,0,0,0,0|0,0,0]=2 1028 B14R1.2334 CCC(=O)C1=CC=C(OC)C=C1OC CS-0204890 [0,2,0,0,0,0|1,0,0]=3 1029 B14R1.2334 COC(=O)C1=C(OC)C=C(OC)C=C1 CS-0187462 [0,2,0,0,0,0|0,0,0]=2 1030 B14R1.2334 COC(=O)C1=C(OC)N=C(OC)C=C1 CS-0042650 [0,2,0,0,0,0|1,0,0]=3 1031 B14R1.2334 COC(=O)C1=CC=C(C#N)C=C1OC CS-0043191 [0,2,0,0,0,0|2,0,0]=4 1032 B14R1.2334 COC(=O)C1=CN=C(OC)N=C1OC CS-0037153 [0,2,0,0,0,0|2,0,0]=4 1033 B14R1.25 CCOC(=O)C1=CC=C(NC=O)C=C1 CS-0151544 [0,2,0,0,0,0|1,0,1]=4 1034 B14R1.25 CCOC(=O)C1=CC=C(OCC)C=C1 CS-W015740 [0,2,0,0,0,0|0,0,0]=2 1035 B14R1.65 COC(=O)C1=CC=C(C#CCO)C=C1 CS-0132162 [0,2,0,0,0,0|1,0,0]=3 1036 B14R1.65 COC(=O)C1=CC=C(CCCBr)C=C1 CS-0134480 [0,2,0,0,0,0|1,0,0]=3 1037 B14R1.65 COC(=O)C1=CC=C(OCCN)C=C1 CS-0301920 [0,2,0,0,0,0|0,0,0]=2 1038 B14R1.65 COC(=O)C1=CC=C(OCCO)C=C1 CS-W010601 [0,2,0,0,0,0|0,0,0]=2 1039 B14R1.717 CC(=O)OC1=CC=C(C(=O)CBr)C=C1 CS-0369810 [0,2,0,0,0,0|2,0,0]=4 1040 B14R1.717 COC(=O)C1=CC=C(CC(=O)O)C=C1 CS-W006135 [0,2,0,0,0,0|1,0,1]=4 1041 B14R1.717 COC(=O)C1=CC=C(NC(C)=O)C=C1 CS-0116677 [0,2,0,0,0,0|1,0,0]=3 1042 B14R1.717 COC(=O)C1=CC=C(OC(C)=O)C=C1 CS-0315018 [0,2,0,0,0,0|0,0,0]=2 1043 B14R1.717 COC(=O)C1=CC=C(OC(C)C)C=C1 CS-0154155 [0,2,0,0,0,0|0,0,0]=2 1044 B14R1.717 COC(=O)C1=CC=C(OC(F)F)C=C1 CS-0239580 [0,2,0,0,0,0|0,0,0]=2 1045 B14R1.717 NNC(=O)C1=CC=C(OC(F)F)C=C1 CS-0268396 [0,2,0,0,0,0|2,0,0]=4 1046 B14R1.718 C=CC(O)C1=CC=C(C(=O)OC)C=C1 CS-0759275 [0,2,0,0,0,0|1,0,1]=4 1047 B14R1.718 COC(=O)C1=CC=C(C(=O)CBr)C=C1 CS-0042189 [0,2,0,0,0,0|1,0,0]=3 1048 B14R1.718 COC(=O)C1=CC=C(C(=O)OC)C=C1 CS-0015109 [0,2,0,0,0,0|0,0,0]=2 1049 B14R1.718 COC(=O)C1=CC=C(C(=O)OC)C=C1 CS-0370532 [0,2,0,0,0,0|0,0,0]=2 1050 B14R1.718 COC(=O)C1=CN=C(C(=O)OC)C=C1 CS-W004879 [0,2,0,0,0,0|1,0,0]=3 1051 B14R1.6720 CCOC1=C(Br)C=C(C(=O)OC)C=C1 CS-0061638 [0,2,0,0,0,0|0,0,0]=2 1052 B14R1.6720 CCOC1=C(Cl)C=C(C(=O)OC)C=C1 CS-0091342 [0,2,0,0,0,0|0,0,0]=2 1053 B14R1.6720 COC(=O)C1=CC(F)=C(NC=O)C=C1 CS-M0955 [0,2,0,0,0,0|1,0,1]=4 1054 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 CS-0433975 [0,2,0,0,0,0|1,0,0]=3 1055 B14R1.610 CCOC(=O)C1=CC=C(B(O)O)C=C1 CS-W000930 [0,2,0,0,0,0|2,0,0]=4 1056 B14R1.610 CCOC(=O)C1=CC=C(C(=O)O)C=C1 CS-0061577 [0,2,0,0,0,0|2,0,0]=4 1057 B14R1.610 CCOC(=O)C1=CC=C(C(C)=O)C=C1 CS-M0167 [0,2,0,0,0,0|1,0,0]=3 1058 B14R1.610 CCOC(=O)C1=CC=C(N(C)C)C=C1 CS-0030547 [0,2,0,0,0,0|1,0,0]=3 1059 B14R1.610 CCOC(=O)C1=CC=C([N+](=O)[O-])C=C1 CS-0016919 [0,2,0,0,0,0|2,0,0]=4 1060 B14R1.610 CONC(=O)C1=CC=C(B(O)O)C=C1 CS-0176165 [0,2,0,0,0,0|2,0,0]=4 1061 B14R1.628 CCOC(=O)C1=CC(Br)=C(C#N)C=C1 CS-W003847 [0,2,0,0,0,0|2,0,0]=4 1062 B14R1.628 CCOC(=O)C1=CC(N)=C(C#N)C=C1 CS-0059792 [0,2,0,0,0,0|2,0,0]=4 1063 B14R1.628 CCOC(=O)C1=CC=C(C#N)C(F)=C1 CS-B1396 [0,2,0,0,0,0|2,0,0]=4 1064 B14R1.628 CCOC(=O)C1=CC=C(C=O)C(Cl)=C1 CS-0040643 [0,2,0,0,0,0|2,0,0]=4 1065 B14R1.628 CCOC(=O)C1=CC=C(NC)C(N)=C1 CS-0131959 [0,2,0,0,0,0|1,0,0]=3 1066 B14R1.628 CCOC(=O)C1=CC=C(OC)C(I)=C1 CS-0094429 [0,2,0,0,0,0|0,0,0]=2 1067 B14R1.628 CCOC(=O)C1=CC=C(OC)C(N)=C1 CS-0377812 [0,2,0,0,0,0|0,0,0]=2 1068 B14R1.719 COC(=O)C1=CC=C(C(C)(C)C)C=C1 CS-W015808 [0,2,0,0,0,0|1,0,0]=3 1069 B14R1.719 COC(=O)C1=CC=C(C(F)(F)F)C=C1 CS-W015431 [0,2,0,0,0,0|2,0,0]=4 1070 B14R1.719 COC(=O)C1=CC=C(S(=O)(=O)Cl)C=C1 CS-W002649 [0,2,0,0,0,0|1,1,0]=4 1071 B14R1.719 COC(=O)C1=CC=C(S(C)(=O)=O)C=C1 CS-0130067 [0,2,0,0,0,0|0,1,0]=3 1072 B14R1.719 COC(=O)C1=CC=C(S(C)(=O)=O)N=C1 CS-0469949 [0,2,0,0,0,0|1,1,0]=4 1073 B14R1.719 COC(=O)C1=CC=C([B-](F)(F)F)C=C1 CS-W009478 [0,2,0,0,0,0|2,0,0]=4 1074 B14R1.747 COC(=O)C1=CC(Br)=C([N+](=O)[O-])C=C1 CS-0035993 [0,2,0,0,0,0|2,0,0]=4 1075 B14R1.747 COC(=O)C1=CC(C)=C(B(O)O)C=C1 CS-0030805 [0,2,0,0,0,0|2,0,0]=4 1076 B14R1.747 COC(=O)C1=CC(C)=C([N+](=O)[O-])C=C1 CS-M0758 [0,2,0,0,0,0|2,0,0]=4 1077 B14R1.747 COC(=O)C1=CC(Cl)=C(B(O)O)C=C1 CS-W005393 [0,2,0,0,0,0|2,0,0]=4 1078 B14R1.747 COC(=O)C1=CC(Cl)=C(C(=O)O)C=C1 CS-W021645 [0,2,0,0,0,0|2,0,0]=4 1079 B14R1.747 COC(=O)C1=CC(F)=C(B(O)O)C=C1 CS-W000952 [0,2,0,0,0,0|2,0,0]=4 1080 B14R1.747 COC(=O)C1=CC(F)=C(C(=O)O)C=C1 CS-0186645 [0,2,0,0,0,0|2,0,0]=4 1081 B14R1.747 COC(=O)C1=CC(F)=C([N+](=O)[O-])C=C1 CS-M0953 [0,2,0,0,0,0|2,0,0]=4 1082 B14R1.747 COC(=O)C1=CC(N)=C(C(=O)O)C=C1 CS-W006509 [0,2,0,0,0,0|2,0,0]=4 1083 B14R1.747 COC(=O)C1=CC(O)=C([N+](=O)[O-])C=C1 CS-W008108 [0,2,0,0,0,0|2,0,0]=4 1084 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(N)=C1 CS-0041821 [0,2,0,0,0,0|2,0,0]=4 1085 B14R1.747 COC(=O)C1=CC=C(C(=O)O)C(O)=C1 CS-0148811 [0,2,0,0,0,0|2,0,0]=4 1086 B14R1.747 COC(=O)C1=CC=C(C(C)=O)C(Cl)=C1 CS-0160780 [0,2,0,0,0,0|1,0,0]=3 1087 B14R1.747 COC(=O)C1=CC=C([N+](=O)[O-])C(N)=C1 CS-0042784 [0,2,0,0,0,0|2,0,0]=4 1088 B14R1.1864 COC(=O)C1=CC(C#N)=C(OC)C=C1 CS-W015850 [0,2,0,0,0,0|0,0,0]=2 1089 B14R1.1864 COC(=O)C1=CC(OC)=C(CO)C=C1 CS-0049906 [0,2,0,0,0,0|2,0,0]=4 1090 B14R1.1864 COC(=O)C1=CC(OC)=C(OC)C=C1 CS-W010599 [0,2,0,0,0,0|0,0,0]=2 1091 B14R1.1864 COC(=O)C1=CC=C(C#N)C(CBr)=C1 CS-0649392 [0,2,0,0,0,0|2,0,0]=4 1092 B14R1.1864 COC(=O)C1=CC=C(C#N)C(OC)=C1 CS-0179892 [0,2,0,0,0,0|2,0,0]=4 1093 B14R1.1864 COC(=O)C1=CC=C(C=O)C(OC)=C1 CS-0038404 [0,2,0,0,0,0|2,0,0]=4 1094 B14R1.1864 COC(=O)C1=CC=C(OC)C(C=O)=C1 CS-0000057 [0,2,0,0,0,0|0,0,0]=2 1095 B14R1.1864 COC1=C(OC)C=C(C(=O)CBr)C=C1 CS-W001483 [0,2,0,0,0,0|2,0,0]=4 1096 B14R1.12512 COC(=O)C1=CC(Cl)=C(OC)C(Br)=C1 CS-0133279 [0,2,0,0,0,0|0,0,0]=2 1097 B14R1.12512 COC(=O)C1=CC(F)=C(C=O)C(F)=C1 CS-0137081 [0,2,0,0,0,0|2,0,0]=4 1098 B14R1.12512 COC(=O)C1=CC(O)=C(OC)C(O)=C1 CS-0181788 [0,2,0,0,0,0|0,0,0]=2 1099 B12R1.24 COC(=O)C1=CC=CC(C)=C1Br CS-W002430 [0,0,1,1,0,0|2,0,0]=4 1100 B12R1.24 COC(=O)C1=CC=CC(C)=C1C CS-W006309 [0,0,1,1,0,0|1,0,1]=4 1101 B12R1.24 COC(=O)C1=CC=CC(C)=C1Cl CS-0153705 [0,0,1,1,0,0|2,0,0]=4 1102 B12R1.24 COC(=O)C1=CC=CC(C)=C1F CS-W022807 [0,0,1,1,0,0|2,0,0]=4 1103 B12R1.24 COC(=O)C1=CC=CC(C)=C1I CS-0131374 [0,0,1,1,0,0|2,0,0]=4 1104 B12R1.24 COC(=O)C1=CC=CC(C)=C1O CS-0153704 [0,0,1,1,0,0|2,0,0]=4 1105 B12R1.78 COC1=CC=C(C=O)C(OC)=C1 CS-W020102 [0,0,1,1,0,0|2,0,0]=4 1106 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 CS-0091188 [0,0,1,1,0,0|2,0,0]=4 1107 B12R2.1384 O=C(O)C1=CC=C2CCC2=C1 CS-0155370 [1,0,0,1,0,0|1,0,0]=3 1108 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 CS-W004332 [1,0,0,1,0,0|1,0,0]=3 1109 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 CS-B1579 [1,0,0,1,0,0|2,0,0]=4 1110 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 CS-0187163 [1,0,0,1,0,0|0,0,0]=2 1111 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 CS-W008688 [1,0,0,1,0,0|2,0,0]=4 1112 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 CS-0059293 [1,0,0,1,0,0|1,0,0]=3 1113 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 CS-W008687 [1,0,0,1,0,0|2,0,0]=4 1114 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 CS-D0685 [1,0,0,1,0,0|2,0,0]=4 1115 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 CS-W008930 [1,0,0,1,0,0|2,0,0]=4 1116 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 CS-0001932 [1,0,0,1,0,0|2,0,0]=4 1117 B12R2.612 O=C1CCC2=CC(O)=CC=C12 CS-W007563 [1,0,0,1,0,0|1,0,0]=3 1118 B12R2.612 O=C1COC2=CC(O)=CC=C12 CS-M3296 [1,0,0,1,0,0|2,0,0]=4 1119 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 CS-D1613 [1,0,0,1,0,0|2,0,0]=4 1120 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 CS-D0305 [1,0,0,1,0,0|2,0,0]=4 1121 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 CS-0018905 [1,0,0,1,0,0|2,0,0]=4 1122 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 CS-WAA0329 [1,0,0,1,0,0|2,0,0]=4 1123 B12R2.612 O=C1NCC2=CC(O)=CC=C12 CS-W006098 [1,0,0,1,0,0|1,0,0]=3 1124 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 CS-0142441 [1,0,0,1,0,0|1,0,0]=3 1125 B12R2.612 O=C1OCC2=C1C=CC(O)=C2 CS-0028396 [1,0,0,1,0,0|0,0,0]=2 1126 B12R2.612 O=C1OCC2=C1C=NC(Cl)=C2 CS-0057575 [1,0,0,1,0,0|2,0,0]=4 1127 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 CS-W007667 [1,0,0,1,0,0|1,0,0]=3 1128 B12R2.612 O=C1OCC2=CC(F)=CC=C12 CS-0043979 [1,0,0,1,0,0|1,0,0]=3 1129 B12R2.612 OB1OCC2=C1C=CC(O)=C2 CS-0052741 [1,0,0,1,0,0|1,0,1]=4 1130 B12R2.44 COC1=CC2=C(C=C1)C=NN2 CS-D1536 [1,0,0,1,0,0|2,0,0]=4 1131 B12R2.44 COC1=CC2=C(C=C1)NCC2 CS-W022403 [1,0,0,1,0,0|2,0,0]=4 1132 B12R2.44 COC1=CC2=C(C=CN2)C=C1 CS-D1149 [1,0,0,1,0,0|2,0,0]=4 1133 B12R2.44 COC1=CC2=C(C=CO2)C=C1 CS-0150275 [1,0,0,1,0,0|2,0,0]=4 1134 B12R2.44 COC1=CC=C2C=CSC2=C1 CS-B0373 [1,0,0,1,0,0|2,0,0]=4 1135 B12R2.44 COC1=CC=C2CNCC2=C1 CS-W006624 [1,0,0,1,0,0|1,0,1]=4 1136 B14R2.2332 COC1=CC2=C(C=C1)CC(=O)CC2 CS-0000111 [0,0,0,1,0,1|1,0,0]=3 1137 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CC2 CS-0059162 [0,0,0,1,0,1|1,0,0]=3 1138 B14R2.2332 COC1=CC=C2NC(=O)C=CC2=C1 CS-0216739 [0,0,0,1,0,1|1,0,1]=4 1139 B14R2.2332 COC1=CC=C2NC(=O)COC2=C1 CS-0087992 [0,0,0,1,0,1|2,0,0]=4 1140 B14R2.2332 COC1=CC=C2NC(=O)CSC2=C1 CS-0046231 [0,0,0,1,0,1|2,0,0]=4 1141 B14R2.2332 COC1=CC=C2OC(=O)CCC2=C1 CS-0150350 [0,0,0,1,0,1|1,0,0]=3 1142 B14R2.3274 COC1=CC2=C(C=C1)N=C(N)N2C CS-0467332 [0,0,0,1,0,1|2,0,0]=4 1143 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O CS-W001176 [0,0,0,1,0,1|2,0,0]=4 1144 B14R2.329 COC1=CC=C(C(=O)C2CC2)C=C1 CS-0204532 [0,1,0,1,0,0|1,0,0]=3 1145 B14R2.1815 COC1=CC2=C(C=C1)C(=O)C(=O)N2 CS-W001182 [0,1,0,1,0,0|2,0,0]=4 1146 B14R2.152 COC1=CC2=C(C=C1)C(C=O)=CN2 CS-B1235 [0,1,0,1,0,0|2,0,0]=4 1147 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCC2 CS-D1691 [0,1,0,1,0,0|1,0,0]=3 1148 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCN2 CS-0160493 [0,1,0,1,0,0|1,0,0]=3 1149 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCO2 CS-W006964 [0,1,0,1,0,0|1,0,0]=3 1150 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=N2 CS-0085445 [0,1,0,1,0,0|1,0,1]=4 1151 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NCC2 CS-0018999 [0,1,0,1,0,0|1,0,0]=3 1152 B14R2.1801 COC1=CC=C2C(=O)C=COC2=C1 CS-W022548 [0,1,0,1,0,0|1,0,1]=4 1153 B14R2.1801 COC1=CC=C2C(=O)COCC2=C1 CS-W022549 [0,1,0,1,0,0|0,0,0]=2 1154 B14R2.1801 COC1=CC=C2C(=O)NC=CC2=C1 CS-W005589 [0,1,0,1,0,0|1,0,1]=4 1155 B14R2.36882 COC1=CC(O)=C2C(=O)CCC2=C1 CS-0150477 [0,1,0,1,0,0|1,0,0]=3 1156 B14R2.36882 COC1=CC2=C(C(=O)CC2)C(Br)=C1 CS-0531953 [0,1,0,1,0,0|1,0,0]=3 1157 B14R2.964 COC(=O)C1=CC=C(C2CC2)C=C1 CS-0130039 [0,1,0,1,0,0|1,0,0]=3 1158 B14R2.966 CCC(=O)C1=CC2=C(C=C1)OCC2 CS-0249458 [0,1,0,1,0,0|1,0,0]=3 1159 B14R2.966 COC(=O)C1=CC2=C(C=C1)C=NN2 CS-D0838 [0,1,0,1,0,0|2,0,0]=4 1160 B14R2.966 COC(=O)C1=CC2=C(C=C1)CCN2 CS-0019056 [0,1,0,1,0,0|1,0,0]=3 1161 B14R2.966 COC(=O)C1=CC2=C(C=C1)CNC2 CS-0049192 [0,1,0,1,0,0|1,0,0]=3 1162 B14R2.966 COC(=O)C1=CC2=C(C=C1)N=CN2 CS-W022885 [0,1,0,1,0,0|1,0,1]=4 1163 B14R2.966 COC(=O)C1=CC2=C(C=C1)N=CS2 CS-0187525 [0,1,0,1,0,0|1,0,1]=4 1164 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 CS-D1099 [0,1,0,1,0,0|1,0,1]=4 1165 B14R2.966 COC(=O)C1=CC2=C(C=C1)NN=C2 CS-D0826 [0,1,0,1,0,0|1,0,1]=4 1166 B14R2.966 COC(=O)C1=CC2=C(C=C1)SC=N2 CS-0197243 [0,1,0,1,0,0|0,1,1]=4 1167 B14R2.966 COC(=O)C1=CC2=C(C=CN2)C=C1 CS-W017455 [0,1,0,1,0,0|1,0,1]=4 1168 B14R2.966 COC(=O)C1=CC=C2C=COC2=C1 CS-0044331 [0,1,0,1,0,0|1,0,1]=4 1169 B14R2.966 COC(=O)C1=CC=C2CCNC2=C1 CS-0075722 [0,1,0,1,0,0|1,0,0]=3 1170 B14R2.966 COC(=O)C1=CC=C2NCCC2=C1 CS-W003397 [0,1,0,1,0,0|1,0,0]=3 1171 B14R2.966 COC(=O)C1=CC=C2NN=NC2=C1 CS-0127296 [0,1,0,1,0,0|2,0,0]=4 1172 B14R2.966 COC(=O)C1=CC=C2OC=CC2=C1 CS-0150800 [0,1,0,1,0,0|0,0,1]=3 1173 B14R2.966 COC(=O)C1=CC=C2OC=NC2=C1 CS-0028769 [0,1,0,1,0,0|0,0,1]=3 1174 B14R2.966 COC(=O)C1=CC=C2OCCC2=C1 CS-0130427 [0,1,0,1,0,0|0,0,0]=2 1175 B14R2.966 COC(=O)C1=CC=C2OCOC2=C1 CS-0134599 [0,1,0,1,0,0|0,0,0]=2 1176 B14R2.966 COC(=O)C1=CC=C2SC=CC2=C1 CS-0056757 [0,1,0,1,0,0|0,1,1]=4 1177 B14R2.966 COC(=O)C1=CC=C2SN=NC2=C1 CS-0042576 [0,1,0,1,0,0|1,1,0]=4 1178 B14R2.966 NNC(=O)C1=CC=C2OCOC2=C1 CS-W017215 [0,1,0,1,0,0|2,0,0]=4 1179 B14R2.966 O=C(CBr)C1=CC2=C(C=C1)OCO2 CS-0072362 [0,1,0,1,0,0|2,0,0]=4 1180 B14R2.966 O=C(CCl)C1=CC=C2OCCC2=C1 CS-M0904 [0,1,0,1,0,0|2,0,0]=4 1181 B14R2.1812 COC1=CC2=C(C=C1)C(=O)NC2=O CS-0038558 [0,1,0,1,0,0|1,0,1]=4 1182 B14R2.1812 COC1=CC2=C(C=C1)C(=O)OC2=O CS-W019718 [0,1,0,1,0,0|0,0,1]=3 1183 B14R2.1812 COC1=CC2=C(C=C1)C(I)=NN2C CS-0151133 [0,1,0,1,0,0|2,0,0]=4 1184 B14R2.1812 COC1=CC2=C(C=C1)C(N)=NN2C CS-0321491 [0,1,0,1,0,0|2,0,0]=4 1185 B14R2.5719 CC(C)C1=CC2=C(C=C1)C(=O)CC2 CS-0160620 [0,1,0,1,0,0|2,0,0]=4 1186 B14R2.5719 O=C(O)C1=CC=C2C(=O)OCC2=C1 CS-0050454 [0,1,0,1,0,0|2,0,0]=4 1187 B14R2.1416 COC1=CC2=C(C=C1Br)C(=O)CC2 CS-0160526 [0,1,0,1,0,0|1,0,0]=3 1188 B14R2.1416 COC1=CC2=C(C=C1Cl)C(=O)CC2 CS-0162590 [0,1,0,1,0,0|1,0,0]=3 1189 B14R2.1416 COC1=CC2=C(C=C1F)C(=O)CC2 CS-0101689 [0,1,0,1,0,0|1,0,0]=3 1190 B14R2.1802 COC1=C(Br)C2=C(C=C1)C(=O)CC2 CS-0101661 [0,1,0,1,0,0|1,0,0]=3 1191 B14R2.1802 COC1=C(C)C2=C(C=C1)C(=O)CC2 CS-0201413 [0,1,0,1,0,0|1,0,0]=3 1192 B14R2.1802 COC1=C(Cl)C2=C(C=C1)C(=O)CC2 CS-W000046 [0,1,0,1,0,0|1,0,0]=3 1193 B10R0.46 C=C(CC(=O)OC)C(=O)OC CS-W022632 [0,0,1,0,1,0|1,0,1]=4 1194 B10R0.46 COC(=O)\C=C(\C)C(=O)OC CS-0149232 [0,0,1,0,1,0|1,0,1]=4 1195 B10R1.31 CCC1=CC=C(C(=O)O)S1 CS-0099725 [1,0,0,0,1,0|2,0,0]=4 1196 B10R1.31 COC1=CC=C(C(=O)O)S1 CS-0113050 [1,0,0,0,1,0|1,0,0]=3 1197 B10R1.31 COC1=NC=C(C(=O)O)S1 CS-0225143 [1,0,0,0,1,0|2,0,0]=4 1198 B10R1.31 COC1=NOC(C(=O)O)=C1 CS-0036212 [1,0,0,0,1,0|2,0,0]=4 1199 B10R1.31 CSC1=CC=C(C(=O)O)S1 CS-W017496 [1,0,0,0,1,0|1,1,0]=4 1200 B10R1.14 CCC(=O)C1=CC=C(C)O1 CS-0132447 [1,0,0,0,1,0|2,0,0]=4 1201 B10R1.14 COC(=O)C1=CC(Br)=CN1 CS-W007392 [1,0,0,0,1,0|2,0,0]=4 1202 B10R1.14 COC(=O)C1=CC(Br)=CO1 CS-M2917 [1,0,0,0,1,0|2,0,0]=4 1203 B10R1.14 COC(=O)C1=CC(Br)=CS1 CS-W022849 [1,0,0,0,1,0|2,0,0]=4 1204 B10R1.14 COC(=O)C1=CC(C)=NO1 CS-0035753 [1,0,0,0,1,0|2,0,0]=4 1205 B10R1.14 COC(=O)C1=CC(Cl)=CN1 CS-0207712 [1,0,0,0,1,0|2,0,0]=4 1206 B10R1.14 COC(=O)C1=CC(F)=CN1 CS-0061832 [1,0,0,0,1,0|2,0,0]=4 1207 B10R1.14 COC(=O)C1=CC(F)=CS1 CS-0084812 [1,0,0,0,1,0|2,0,0]=4 1208 B10R1.14 COC(=O)C1=CC(I)=CN1 CS-0007661 [1,0,0,0,1,0|2,0,0]=4 1209 B10R1.14 COC(=O)C1=CC(N)=CS1 CS-W003378 [1,0,0,0,1,0|2,0,0]=4 1210 B10R1.14 COC(=O)C1=CC(O)=NO1 CS-W000792 [1,0,0,0,1,0|2,0,0]=4 1211 B10R1.14 COC(=O)C1=CC=C(Br)N1 CS-W006646 [1,0,0,0,1,0|2,0,0]=4 1212 B10R1.14 COC(=O)C1=CC=C(Br)O1 CS-W002362 [1,0,0,0,1,0|2,0,0]=4 1213 B10R1.14 COC(=O)C1=CC=C(Br)S1 CS-B0140 [1,0,0,0,1,0|2,0,0]=4 1214 B10R1.14 COC(=O)C1=CC=C(C)N1 CS-0153100 [1,0,0,0,1,0|1,0,0]=3 1215 B10R1.14 COC(=O)C1=CC=C(C)O1 CS-W005869 [1,0,0,0,1,0|1,0,0]=3 1216 B10R1.14 COC(=O)C1=CC=C(C)S1 CS-0133007 [1,0,0,0,1,0|1,0,0]=3 1217 B10R1.14 COC(=O)C1=CC=C(Cl)O1 CS-0150805 [1,0,0,0,1,0|2,0,0]=4 1218 B10R1.14 COC(=O)C1=CC=C(Cl)S1 CS-M2941 [1,0,0,0,1,0|2,0,0]=4 1219 B10R1.14 COC(=O)C1=CC=C(I)S1 CS-0150803 [1,0,0,0,1,0|2,0,0]=4 1220 B10R1.14 COC(=O)C1=CC=C(N)O1 CS-0049008 [1,0,0,0,1,0|2,0,0]=4 1221 B10R1.14 COC(=O)C1=CC=C(N)S1 CS-W005967 [1,0,0,0,1,0|2,0,0]=4 1222 B10R1.14 COC(=O)C1=CN(C)C=C1 CS-0151175 [1,0,0,0,1,0|1,0,0]=3 1223 B10R1.14 COC(=O)C1=CN(C)C=N1 CS-W023129 [1,0,0,0,1,0|2,0,0]=4 1224 B10R1.14 COC(=O)C1=CN(C)N=C1 CS-0061744 [1,0,0,0,1,0|2,0,0]=4 1225 B10R1.14 COC(=O)C1=CN=C(C)N1 CS-0139284 [1,0,0,0,1,0|2,0,0]=4 1226 B10R1.14 COC(=O)C1=CNC(Br)=C1 CS-W006282 [1,0,0,0,1,0|2,0,0]=4 1227 B10R1.14 COC(=O)C1=CNC(C)=C1 CS-0072350 [1,0,0,0,1,0|1,0,0]=3 1228 B10R1.14 COC(=O)C1=COC(C)=C1 CS-W022870 [1,0,0,0,1,0|1,0,0]=3 1229 B10R1.14 COC(=O)C1=COC(C)=N1 CS-W003035 [1,0,0,0,1,0|2,0,0]=4 1230 B10R1.14 COC(=O)C1=CSC(Br)=C1 CS-W006344 [1,0,0,0,1,0|2,0,0]=4 1231 B10R1.14 COC(=O)C1=CSC(C)=C1 CS-0138581 [1,0,0,0,1,0|1,0,0]=3 1232 B10R1.14 COC(=O)C1=CSC(Cl)=C1 CS-0048983 [1,0,0,0,1,0|2,0,0]=4 1233 B10R1.14 COC(=O)C1=NC(C)=CS1 CS-W003491 [1,0,0,0,1,0|2,0,0]=4 1234 B10R1.14 COC(=O)C1=NC=C(C)S1 CS-W019330 [1,0,0,0,1,0|2,0,0]=4 1235 B10R1.14 COC(=O)C1=NN(C)C=C1 CS-0044505 [1,0,0,0,1,0|2,0,0]=4 1236 B10R1.14 COC(=O)C1=NNC(C)=C1 CS-W008500 [1,0,0,0,1,0|2,0,0]=4 1237 B10R1.14 COC(=O)C1=NNC(O)=C1 CS-0035734 [1,0,0,0,1,0|2,0,0]=4 1238 B10R1.14 COC(=O)C1=NOC(C)=C1 CS-W018305 [1,0,0,0,1,0|2,0,0]=4 1239 B12R1.49 C=CC(=O)NC1=CC=C(O)C=C1 CS-0504470 [1,0,0,0,0,1|1,0,1]=4 1240 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 CS-0111414 [1,0,0,0,0,1|1,0,0]=3 1241 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 CS-0208381 [1,0,0,0,0,1|2,0,0]=4 1242 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 CS-M1488 [1,0,0,0,0,1|1,0,0]=3 1243 B12R1.49 COC(=O)CC1=CC=C(Br)N=C1 CS-0185154 [1,0,0,0,0,1|2,0,0]=4 1244 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 CS-0099715 [1,0,0,0,0,1|0,0,0]=2 1245 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 CS-W022850 [1,0,0,0,0,1|1,0,0]=3 1246 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 CS-W008065 [1,0,0,0,0,1|1,0,0]=3 1247 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 CS-0094448 [1,0,0,0,0,1|1,0,0]=3 1248 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 CS-0028736 [1,0,0,0,0,1|1,0,0]=3 1249 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 CS-W001084 [1,0,0,0,0,1|0,0,0]=2 1250 B12R1.49 COC(=O)CC1=CN=C(Cl)C=C1 CS-W005153 [1,0,0,0,0,1|2,0,0]=4 1251 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 CS-0036244 [1,0,0,0,0,1|2,0,0]=4 1252 B12R1.49 COC(=O)NC1=CC=C(O)C=C1 CS-0249290 [1,0,0,0,0,1|0,0,0]=2 1253 B12R1.435 C#CC1=CC(C(=O)OC)=CC=C1 CS-W005738 [0,0,0,0,1,1|1,0,1]=4 1254 B12R1.435 C#CC1=CN=CC(C(=O)OC)=C1 CS-0609252 [0,0,0,0,1,1|1,0,1]=4 1255 B12R1.435 C#CC1=NC=CC(C(=O)OC)=C1 CS-0043881 [0,0,0,0,1,1|1,0,1]=4 1256 B12R1.435 C=CC1=CC(C(=O)OC)=CC=C1 CS-0161074 [0,0,0,0,1,1|1,0,1]=4 1257 B12R1.435 CCC(=O)C1=CC=CC(OC)=C1 CS-0005775 [0,0,0,0,1,1|1,0,0]=3 1258 B12R1.435 CNC(=O)C1=NC=CC(OC)=C1 CS-0772371 [0,0,0,0,1,1|1,0,0]=3 1259 B12R1.435 COC(=O)C1=CC(C#N)=CC=C1 CS-W022828 [0,0,0,0,1,1|2,0,0]=4 1260 B12R1.435 COC(=O)C1=CC(C#N)=NC=C1 CS-W006243 [0,0,0,0,1,1|2,0,0]=4 1261 B12R1.435 COC(=O)C1=CC(C=O)=NC=C1 CS-W006156 [0,0,0,0,1,1|2,0,0]=4 1262 B12R1.435 COC(=O)C1=CC(CCl)=NC=C1 CS-0527191 [0,0,0,0,1,1|2,0,0]=4 1263 B12R1.435 COC(=O)C1=CC(CN)=NC=C1 CS-W022789 [0,0,0,0,1,1|2,0,0]=4 1264 B12R1.435 COC(=O)C1=CC(CO)=CN=C1 CS-W019713 [0,0,0,0,1,1|2,0,0]=4 1265 B12R1.435 COC(=O)C1=CC(CO)=NC=C1 CS-W006249 [0,0,0,0,1,1|2,0,0]=4 1266 B12R1.435 COC(=O)C1=CC(OC)=CC=C1 CS-W001586 [0,0,0,0,1,1|0,0,0]=2 1267 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 CS-0053893 [0,0,0,0,1,1|0,0,0]=2 1268 B12R1.435 COC(=O)C1=CC=CC(C=O)=C1 CS-W002489 [0,0,0,0,1,1|2,0,0]=4 1269 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 CS-W001862 [0,0,0,0,1,1|2,0,0]=4 1270 B12R1.435 COC(=O)C1=CC=CC(CO)=C1 CS-0096392 [0,0,0,0,1,1|2,0,0]=4 1271 B12R1.435 COC(=O)C1=CC=CC(NN)=C1 CS-0161106 [0,0,0,0,1,1|2,0,0]=4 1272 B12R1.435 COC(=O)C1=CN=CC(C#N)=C1 CS-W022868 [0,0,0,0,1,1|2,0,0]=4 1273 B12R1.435 COC(=O)C1=CN=CC(OC)=C1 CS-0046214 [0,0,0,0,1,1|0,0,0]=2 1274 B12R1.435 COC(=O)C1=NC(OC)=CC=C1 CS-W005843 [0,0,0,0,1,1|1,0,0]=3 1275 B12R1.435 COC(=O)C1=NC(OC)=CN=C1 CS-0035570 [0,0,0,0,1,1|1,0,0]=3 1276 B12R1.435 COC(=O)C1=NC(SC)=NC=C1 CS-0454520 [0,0,0,0,1,1|1,1,0]=4 1277 B12R1.435 COC(=O)C1=NC=CC(C=O)=C1 CS-W006936 [0,0,0,0,1,1|2,0,0]=4 1278 B12R1.435 COC(=O)C1=NC=CC(CO)=C1 CS-W005573 [0,0,0,0,1,1|2,0,0]=4 1279 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 CS-0005486 [0,0,0,0,1,1|0,0,0]=2 1280 B12R1.435 COC(=O)C1=NC=NC(OC)=C1 CS-0181296 [0,0,0,0,1,1|1,0,0]=3 1281 B12R1.435 COC1=CC(C(=O)C=O)=CC=C1 CS-0042611 [0,0,0,0,1,1|2,0,0]=4 1282 B12R1.435 COC1=CC(C(=O)NN)=CC=C1 CS-0033852 [0,0,0,0,1,1|2,0,0]=4 1283 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 CS-W004800 [0,0,0,0,1,1|2,0,0]=4 1284 B12R1.435 COC1=CC=CC(C(=O)CCl)=C1 CS-0249392 [0,0,0,0,1,1|2,0,0]=4 1285 B14R1.5 C#CC1=CC=C(CCC(=O)OC)C=C1 CS-0158562 [0,0,0,0,0,2|1,0,1]=4 1286 B14R1.5 C(C(=O)OC)=CC1=CC=C(C=O)C=C1 CS-W008046 [0,0,0,0,0,2|2,0,0]=4 1287 B14R1.5 COC(=O)C#CC1=CC=C(OC)C=C1 CS-0150428 [0,0,0,0,0,2|0,0,0]=2 1288 B14R1.5 COC(=O)CCC1=CC=C(C#N)C=C1 CS-0227163 [0,0,0,0,0,2|2,0,0]=4 1289 B14R1.5 COC(=O)CCC1=CC=C(OC)C=C1 CS-0023821 [0,0,0,0,0,2|0,0,0]=2 1290 B14R1.5 COC(=O)COC1=CC=C(C#N)C=C1 CS-0102091 [0,0,0,0,0,2|2,0,0]=4 1291 B14R1.5 COC(=O)\C=C\C1=CC=C(C#N)C=C1 CS-0913898 [0,0,0,0,0,2|2,0,0]=4 1292 B14R1.5 COC(=O)\C=C\C1=CC=C(C=O)C=C1 CS-0198152 [0,0,0,0,0,2|2,0,0]=4 1293 B14R1.5 COC(=O)\C=C\C1=CC=C(CBr)C=C1 CS-0886877 [0,0,0,0,0,2|2,0,0]=4 1294 B14R1.5 COC(=O)\C=C\C1=CC=C(OC)C=C1 CS-0099561 [0,0,0,0,0,2|0,0,0]=2 1295 B14R1.5 COC1=CC=C(NCC(=O)NN)C=C1 CS-0206732 [0,0,0,0,0,2|2,0,0]=4 1296 B14R1.5 COC1=CC=C(OCC(=O)NN)C=C1 CS-0197023 [0,0,0,0,0,2|2,0,0]=4