0 B9R1.13 CC(=O)CC1=CSC=C1 DY787564 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.13 CC(=O)CN1C=NC=N1 NO13822 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.13 CC(C)CC1=NC=CN1 DY606921 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.13 CC(C)CC1=NC=CS1 NO10134 [0,0,0,0,0,0|2,1,1]=4 4 B9R1.13 C[C@@H](N)CC1=CNC=N1 DY570429 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.13 O=C(O)CC1=CC=CS1 NO23025 [0,0,0,0,0,0|1,1,0]=2 6 B9R1.13 O=C(O)CC1=CN=CN1 NO22764 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.13 O=C(O)CN1C=CC=C1 DY793113 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.13 O=C(O)CN1C=CN=C1 NO22762 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.13 OB(O)CC1=CC=CO1 DY706285 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.8 CCCC1=NC=CN1 NO14621 [1,0,0,0,0,0|2,0,1]=4 11 B8R1.8 CCCC1=NN=CO1 DY772845 [1,0,0,0,0,0|2,0,1]=4 12 B8R1.8 CSCC1=CC=CO1 DY523785 [1,0,0,0,0,0|1,0,0]=2 13 B8R1.8 N#CCC1=CC=CS1 NO22998 [1,0,0,0,0,0|1,1,1]=4 14 B8R1.8 NCCC1=CC=CN1 DY717219 [1,0,0,0,0,0|2,0,1]=4 15 B8R1.8 NNCC1=CC=CS1 DY607641 [1,0,0,0,0,0|2,1,0]=4 16 B8R1.8 O=CCC1=CC=CS1 NO17423 [1,0,0,0,0,0|0,1,0]=2 17 B8R1.8 OCCC1=CC=CS1 NO14939 [1,0,0,0,0,0|0,1,2]=4 18 B10R1.23 CC(C(N)=O)N1C=CC=N1 DY645745 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 DY510410 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.23 O=C(O)C(O)C1=CC=CS1 DY787054 [0,1,0,0,0,0|1,1,0]=3 21 B10R1.54 CC(=O)NC1=CC=C(Br)S1 NO11706 [0,1,0,0,0,0|1,1,0]=3 22 B10R1.54 CC(=O)NC1=CSC(C)=N1 DY785518 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.54 CC(=O)NC1=NC=C(Br)S1 NO18448 [0,1,0,0,0,0|2,1,0]=4 24 B10R1.54 CC1=CC=C(CC(=O)O)S1 DY786946 [0,1,0,0,0,0|1,1,0]=3 25 B10R1.54 CC1=CN(CC(=O)O)N=C1 DY582681 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.54 CC1=CN=C(CC(=O)O)S1 DY786340 [0,1,0,0,0,0|2,1,0]=4 27 B10R1.54 CC1=NC(CC(=O)O)=CO1 DY773145 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.54 CC1=NN=C(CC(=O)O)O1 DY581271 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.54 CN1C=NC(CC(=O)O)=C1 NO16463 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.54 NC(=O)CC1=CN=C(Br)S1 DY785950 [0,1,0,0,0,0|2,1,0]=4 31 B10R1.54 NC(=O)CC1=CSC(Br)=N1 DY785506 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.54 NC1=CC(CC(=O)O)=NN1 NO20216 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.54 NC1=NC(CC(=O)O)=CS1 NO17942 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.54 NC1=NC=C(CC(=O)O)S1 DY103505 [0,1,0,0,0,0|2,1,0]=4 35 B10R1.54 O=C(O)CC1=CSC(Br)=N1 DY785350 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.54 O=C(O)CC1=NC(Cl)=CS1 DY102205 [0,1,0,0,0,0|2,1,0]=4 37 B10R1.64 CC(=O)OC1=C(C)N=CS1 DY793575 [0,1,0,0,0,0|2,1,0]=4 38 B10R1.64 CN1C=CC=C1CC(=O)O DY20727 [0,1,0,0,0,0|2,0,0]=3 39 B10R1.64 CN1N=CC=C1CC(=O)O DY645707 [0,1,0,0,0,0|3,0,0]=4 40 B10R1.64 O=C(O)CC1=C(Cl)SC=C1 DY787774 [0,1,0,0,0,0|3,0,0]=4 41 B8R1.7 CC(=O)C1=CC=CO1 NO18634 [0,0,0,0,1,0|0,0,0]=1 42 B8R1.7 CC(=O)C1=CC=CS1 NO19387 [0,0,0,0,1,0|0,1,0]=2 43 B8R1.7 CC(=O)C1=CC=NO1 NO15344 [0,0,0,0,1,0|1,0,0]=2 44 B8R1.7 CC(=O)C1=CNC=N1 NO20378 [0,0,0,0,1,0|2,0,0]=3 45 B8R1.7 CC(=O)C1=CSC=N1 NO13244 [0,0,0,0,1,0|2,0,0]=3 46 B8R1.7 CC(=O)C1=NC=CO1 NO20443 [0,0,0,0,1,0|1,0,0]=2 47 B8R1.7 CC(=O)C1=NC=CS1 NO22755 [0,0,0,0,1,0|1,1,0]=3 48 B8R1.7 CC(=O)C1=NNC=C1 NO13441 [0,0,0,0,1,0|2,0,0]=3 49 B8R1.7 CC(=O)C1=NOC=C1 DY116141 [0,0,0,0,1,0|2,0,0]=3 50 B8R1.7 CC(N)C1=CC=CN1 DY717705 [0,0,0,0,1,0|2,0,1]=4 51 B8R1.7 CC(N)C1=CC=CS1 DY585951 [0,0,0,0,1,0|1,1,1]=4 52 B8R1.7 C[C@@H](O)C1=CC=CO1 DY621645 [0,0,0,0,1,0|0,0,2]=3 53 B8R1.7 C[C@@H](O)C1=CC=CS1 DY621687 [0,0,0,0,1,0|0,1,2]=4 54 B8R1.7 N=C(N)C1=CC=CO1 DY609169 [0,0,0,0,1,0|2,0,0]=3 55 B8R1.7 NC(=O)C1=CC=NO1 DY773817 [0,0,0,0,1,0|2,0,0]=3 56 B8R1.7 NC(=O)C1=CN=CS1 DY785098 [0,0,0,0,1,0|2,1,0]=4 57 B8R1.7 NC(=O)C1=NC=CN1 NO15603 [0,0,0,0,1,0|3,0,0]=4 58 B8R1.7 NC(=O)C1=NNC=C1 NO12173 [0,0,0,0,1,0|3,0,0]=4 59 B8R1.7 O=C(Cl)C1=CSC=C1 DY786748 [0,0,0,0,1,0|3,0,0]=4 60 B8R1.7 O=C(O)C1=CC=CN1 NO17766 [0,0,0,0,1,0|2,0,0]=3 61 B8R1.7 O=C(O)C1=CC=CO1 NO16202 [0,0,0,0,1,0|1,0,0]=2 62 B8R1.7 O=C(O)C1=CC=NO1 NO15566 [0,0,0,0,1,0|2,0,0]=3 63 B8R1.7 O=C(O)C1=CN=CS1 NO15551 [0,0,0,0,1,0|2,1,0]=4 64 B8R1.7 O=C(O)C1=CNC=C1 NO16294 [0,0,0,0,1,0|3,0,0]=4 65 B8R1.7 O=C(O)C1=CNC=N1 NO19657 [0,0,0,0,1,0|3,0,0]=4 66 B8R1.7 O=C(O)C1=COC=C1 NO14540 [0,0,0,0,1,0|3,0,0]=4 67 B8R1.7 O=C(O)C1=CSC=C1 NO22727 [0,0,0,0,1,0|3,0,0]=4 68 B8R1.7 O=C(O)C1=CSC=N1 NO10126 [0,0,0,0,1,0|3,0,0]=4 69 B8R1.7 O=C(O)C1=NC=CN1 NO19852 [0,0,0,0,1,0|3,0,0]=4 70 B8R1.7 O=C(O)C1=NC=CS1 DY425486 [0,0,0,0,1,0|2,1,0]=4 71 B8R1.7 O=C(O)C1=NNC=C1 NO18779 [0,0,0,0,1,0|3,0,0]=4 72 B8R1.7 O=C(O)C1=NOC=C1 NO18235 [0,0,0,0,1,0|3,0,0]=4 73 B8R1.7 O=C(O)C1=NSC=C1 DY113170 [0,0,0,0,1,0|3,0,0]=4 74 B8R1.7 O=C(O)C1C=CCO1 DY788385 [0,0,0,0,1,0|1,0,2]=4 75 B8R1.7 O=[N+]([O-])C1=CC=CN1 NO13256 [0,0,0,0,1,0|3,0,0]=4 76 B8R1.7 OB(O)C1=CC=CO1 NO22587 [0,0,0,0,1,0|2,0,1]=4 77 B10R1.18 CC(=O)CC1=CC=CN=C1 DY567891 [0,0,0,0,0,1|1,0,0]=2 78 B10R1.18 CC(=O)CC1=CC=NC=C1 NO20988 [0,0,0,0,0,1|1,0,0]=2 79 B10R1.18 CC(=O)CC1=NC=CC=C1 NO20802 [0,0,0,0,0,1|1,0,0]=2 80 B10R1.18 CC(N)CC1=NC=CC=C1 DY652737 [0,0,0,0,0,1|2,0,1]=4 81 B10R1.18 CC(O)CC1=NC=CN=C1 DY709807 [0,0,0,0,0,1|1,0,2]=4 82 B10R1.18 N=C(N)CC1=CC=CN=C1 DY610010 [0,0,0,0,0,1|3,0,0]=4 83 B10R1.18 NC(=O)CC1=NC=CC=N1 NO17323 [0,0,0,0,0,1|2,0,0]=3 84 B10R1.18 NC(=O)NC1=CC=CC=C1 NO10533 [0,0,0,0,0,1|3,0,0]=4 85 B10R1.18 O=C(Cl)OC1=CC=CC=C1 NO18823 [0,0,0,0,0,1|3,0,0]=4 86 B10R1.18 O=C(O)CC1=CC=CN=C1 NO20325 [0,0,0,0,0,1|2,0,0]=3 87 B10R1.18 O=C(O)CC1=CC=NC=C1 NO20327 [0,0,0,0,0,1|2,0,0]=3 88 B10R1.18 O=C(O)CC1=CN=CN=C1 NO10494 [0,0,0,0,0,1|3,0,0]=4 89 B10R1.18 O=C([O-])CC1=NC=CC=C1 DY716949 [0,0,0,0,0,1|2,0,0]=3 90 B10R1.18 O=C([O-])CC1=NC=CC=N1 DY564507 [0,0,0,0,0,1|2,0,0]=3 91 B10R1.18 O=S([O-])CC1=CC=CC=C1 DY745429 [0,0,0,0,0,1|3,0,0]=4 92 B10R1.66 CC(=O)\C=C\C1=CC=CS1 DY584490 [0,0,0,0,0,1|0,1,1]=3 93 B10R1.66 O=C(O)CCC1=CC=CN1 NO21786 [0,0,0,0,0,1|2,0,0]=3 94 B10R1.66 O=C(O)CCN1C=CC=N1 DY578343 [0,0,0,0,0,1|3,0,0]=4 95 B7R0.4 C\C=C\C=C\C(=O)[O-] NO11961 [1,0,1,0,0,0|2,0,0]=4 96 B7R1.1 CCC1=NC=CN1 NO21533 [2,0,0,0,0,0|2,0,0]=4 97 B7R1.1 CCN1C=CC=N1 NO20681 [2,0,0,0,0,0|2,0,0]=4 98 B7R1.1 CNC1=CC=CS1 DY786838 [2,0,0,0,0,0|1,1,0]=4 99 B7R1.1 COC1=CC=CO1 DY759896 [2,0,0,0,0,0|1,0,0]=3 100 B7R1.1 CSC1=NC=CO1 NO17723 [2,0,0,0,0,0|2,0,0]=4 101 B7R1.1 ClCC1=CC=CO1 NO13429 [2,0,0,0,0,0|1,0,0]=3 102 B7R1.1 ClCC1=CN=CO1 DY114644 [2,0,0,0,0,0|2,0,0]=4 103 B7R1.1 NCC1=CC=CN1 NO14874 [2,0,0,0,0,0|2,0,0]=4 104 B7R1.1 NCC1=CC=CS1 NO22783 [2,0,0,0,0,0|1,1,0]=4 105 B7R1.1 NCC1=CN=CO1 NO17502 [2,0,0,0,0,0|2,0,0]=4 106 B7R1.1 NCC1=CN=CO1 NO18508 [2,0,0,0,0,0|2,0,0]=4 107 B7R1.1 NCC1=NC=CO1 DY773829 [2,0,0,0,0,0|2,0,0]=4 108 B7R1.1 O=CC1=CC=CN1 NO17764 [2,0,0,0,0,0|1,0,0]=3 109 B7R1.1 O=CC1=CC=CS1 NO16400 [2,0,0,0,0,0|0,1,0]=3 110 B7R1.1 O=CC1=CN=CS1 NO15582 [2,0,0,0,0,0|1,1,0]=4 111 B7R1.1 O=CC1=CNC=C1 NO20728 [2,0,0,0,0,0|2,0,0]=4 112 B7R1.1 O=CC1=CNC=N1 NO14113 [2,0,0,0,0,0|2,0,0]=4 113 B7R1.1 O=CC1=CSC=C1 NO14553 [2,0,0,0,0,0|2,0,0]=4 114 B7R1.1 O=CC1=NC=CN1 NO15723 [2,0,0,0,0,0|2,0,0]=4 115 B7R1.1 O=CC1=NC=CO1 DY565689 [2,0,0,0,0,0|1,0,0]=3 116 B7R1.1 O=CC1=NNC=C1 NO18284 [2,0,0,0,0,0|2,0,0]=4 117 B7R1.1 OCC1=CC=NO1 NO15343 [2,0,0,0,0,0|1,0,1]=4 118 B9R0.1 C=CC(=O)OCCC(=O)O DY822567 [0,1,1,0,0,0|1,0,1]=4 119 B9R1.7 C=CCC1=CC=C(Cl)S1 DY787408 [1,1,0,0,0,0|0,1,1]=4 120 B9R1.11 CNC(C)C1=CC=CS1 DY609452 [1,1,0,0,0,0|1,1,0]=4 121 B9R1.11 COC(=O)C1=CC=CO1 NO11606 [1,1,0,0,0,0|1,0,1]=4 122 B9R1.11 O=CC(=O)C1=CC=CO1 DY759530 [1,1,0,0,0,0|0,0,1]=3 123 B9R1.11 O=CC(=O)C1=CC=CS1 DY447491 [1,1,0,0,0,0|0,1,1]=4 124 B9R1.12 CCOCC1=CC=CO1 NO17009 [1,1,0,0,0,0|0,0,1]=3 125 B9R1.12 CSSCC1=CC=CO1 DY759446 [1,1,0,0,0,0|1,0,0]=3 126 B9R1.35 CC(=O)C1=CC(Br)=CS1 NO20414 [0,1,0,0,1,0|0,1,0]=3 127 B9R1.35 CC(=O)C1=CC(C)=NS1 DY106270 [0,1,0,0,1,0|1,1,0]=4 128 B9R1.35 CC(=O)C1=CC(Cl)=CS1 NO21207 [0,1,0,0,1,0|0,1,0]=3 129 B9R1.35 CC(=O)C1=CC=C(Br)O1 NO20429 [0,1,0,0,1,0|0,0,0]=2 130 B9R1.35 CC(=O)C1=CC=C(C)S1 NO20396 [0,1,0,0,1,0|0,1,0]=3 131 B9R1.35 CC(=O)C1=CC=C(Cl)S1 NO21209 [0,1,0,0,1,0|0,1,0]=3 132 B9R1.35 CC(=O)C1=CN=C(Br)S1 NO17877 [0,1,0,0,1,0|1,1,0]=4 133 B9R1.35 CC(=O)C1=CN=C(N)S1 DY558789 [0,1,0,0,1,0|1,1,0]=4 134 B9R1.35 CC(=O)C1=CSC(C)=N1 DY542865 [0,1,0,0,1,0|2,0,0]=4 135 B9R1.35 CC(=O)C1=CSC(N)=N1 NO20386 [0,1,0,0,1,0|2,0,0]=4 136 B9R1.35 CC(=O)C1=NC(C)=CO1 NO16603 [0,1,0,0,1,0|1,0,0]=3 137 B9R1.35 CC(=O)C1=NC=C(Cl)S1 DY571377 [0,1,0,0,1,0|1,1,0]=4 138 B9R1.35 CC(=O)C1=NOC(C)=C1 NO20434 [0,1,0,0,1,0|2,0,0]=4 139 B9R1.35 CC1=CC=C(C(=O)O)O1 NO19440 [0,1,0,0,1,0|1,0,0]=3 140 B9R1.35 CC1=CC=C(C(=O)O)S1 NO23027 [0,1,0,0,1,0|1,1,0]=4 141 B9R1.35 CC1=COC(C(=O)O)=C1 DY104342 [0,1,0,0,1,0|1,0,0]=3 142 B9R1.35 CC1=NOC(C(=O)O)=C1 NO22370 [0,1,0,0,1,0|2,0,0]=4 143 B9R1.35 O=C(O)C1=CC(Br)=CN1 NO22700 [0,1,0,0,1,0|2,0,0]=4 144 B9R1.35 O=C(O)C1=CC(Br)=CO1 NO10558 [0,1,0,0,1,0|1,0,0]=3 145 B9R1.35 O=C(O)C1=CC(Br)=CS1 NO22681 [0,1,0,0,1,0|1,1,0]=4 146 B9R1.35 O=C(O)C1=CC(Br)=NO1 NO22178 [0,1,0,0,1,0|2,0,0]=4 147 B9R1.35 O=C(O)C1=CC=C(Br)N1 NO16375 [0,1,0,0,1,0|2,0,0]=4 148 B9R1.35 O=C(O)C1=CC=C(Br)O1 NO22685 [0,1,0,0,1,0|1,0,0]=3 149 B9R1.35 O=C(O)C1=CC=C(Br)S1 NO17287 [0,1,0,0,1,0|1,1,0]=4 150 B9R1.35 O=C(O)C1=CC=C(Cl)O1 NO10327 [0,1,0,0,1,0|1,0,0]=3 151 B9R1.35 O=C(O)C1=CC=C(Cl)S1 NO17350 [0,1,0,0,1,0|1,1,0]=4 152 B9R1.35 O=C(O)C1=CC=C(F)S1 DY456724 [0,1,0,0,1,0|1,1,0]=4 153 B9R1.35 O=C(O)C1=CN=C(Br)O1 NO17421 [0,1,0,0,1,0|2,0,0]=4 154 B9R1.35 O=C(O)c1cc(F)cs1 DY430853 [0,1,0,0,1,0|1,1,0]=4 155 B9R1.41 CC(=O)C1=CSC=C1Cl DY579531 [0,1,0,0,1,0|2,0,0]=4 156 B9R1.41 CC(=O)C1=NC=CN1C DY575049 [0,1,0,0,1,0|2,0,0]=4 157 B9R1.41 CC1=C(C(=O)O)NC=C1 DY106666 [0,1,0,0,1,0|2,0,0]=4 158 B9R1.41 CC1=C(C(=O)O)OC=N1 NO18905 [0,1,0,0,1,0|2,0,0]=4 159 B9R1.41 CC1=C(C(=O)O)SC=C1 NO23026 [0,1,0,0,1,0|1,1,0]=4 160 B9R1.41 NC(=O)C1=C(N)C=CS1 DY525033 [0,1,0,0,1,0|1,1,0]=4 161 B9R1.41 NC(=O)C1=CC=CN1N NO20727 [0,1,0,0,1,0|2,0,0]=4 162 B9R1.41 NC1=C(C(=O)O)SC=C1 DY787204 [0,1,0,0,1,0|1,1,0]=4 163 B9R1.41 O=C(O)C1=C(Br)C=CS1 NO17286 [0,1,0,0,1,0|1,1,0]=4 164 B9R1.41 O=C(O)C1=C(F)C=CS1 NO21775 [0,1,0,0,1,0|1,1,0]=4 165 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 DY10315 [0,1,0,0,0,1|1,0,0]=3 166 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 NO22844 [0,1,0,0,0,1|1,0,0]=3 167 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 NO19283 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.20 CC(=O)NC1=NC=C(Cl)C=N1 DY695981 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 DY20138 [0,1,0,0,0,1|2,0,0]=4 170 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 DY797913 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 NO21084 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 NO14692 [0,1,0,0,0,1|2,0,0]=4 173 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 NO21002 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 NO20812 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 NO10817 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 NO20852 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 NO13319 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 NO12143 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 NO14073 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 DY581931 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 NO14652 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.20 O=C(O)CC1=NC=C(O)C=C1 DY512037 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 DY713899 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 NO14544 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 NO10890 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 NO15488 [0,1,0,0,0,1|2,0,0]=4 187 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 NO14083 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 DY628683 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.36 N[C@@H](C(=O)Cl)C1=CC=CC=C1 NO15858 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 NO11192 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 NO15279 [0,1,0,0,0,1|2,0,0]=4 192 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 NO10862 [0,1,0,0,0,1|2,0,0]=4 193 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 NO10861 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.40 CCC(=O)OC1=CC=CC=C1 DY584283 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.40 CNC(=O)OC1=CC=CC=C1 DY584385 [0,1,0,0,0,1|2,0,0]=4 196 B11R1.40 COC(=O)CC1=NC=CN=C1 DY551613 [0,1,0,0,0,1|1,0,0]=3 197 B11R1.40 NNC(=O)CC1=CC=NC=C1 NO21751 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.40 O=C(CCl)NC1=NC=CC=N1 DY558507 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 DY10294 [0,1,0,0,0,1|1,0,0]=3 200 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 DY10318 [0,1,0,0,0,1|1,0,0]=3 201 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 DY427446 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 DY744961 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 DY539913 [0,1,0,0,0,1|2,0,0]=4 204 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 NO21203 [0,1,0,0,0,1|2,0,0]=4 205 B11R1.86 CC(=O)NC1=CC=CN=C1Cl DY614543 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 NO21083 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 NO20995 [0,1,0,0,0,1|2,0,0]=4 208 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 NO20809 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 NO20826 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 NO20849 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 NO20941 [0,1,0,0,0,1|2,0,0]=4 212 B11R1.86 O=C(O)CC1=NC=CC=C1Br DY567855 [0,1,0,0,0,1|2,0,0]=4 213 B11R1.86 O=C(O)CC1=NC=CC=C1Cl NO19561 [0,1,0,0,0,1|2,0,0]=4 214 B11R1.86 O=C(O)CC1=NC=CC=C1F DY431700 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 NO22187 [0,1,0,0,0,1|1,0,0]=3 216 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 NO11707 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 NO22093 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.157 CC(=O)NC1=CC(N)=CN=C1 DY663334 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 DY20703 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.157 CC(=O)NC1=NC(C)=CC=C1 DY558867 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 NO16776 [0,1,0,0,0,1|2,0,0]=4 222 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 NO11715 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.157 CC(=O)NC1=NC=NC(Cl)=C1 DY578265 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.157 CC(=O)NC1=NC=NC(N)=C1 DY115540 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.157 CC(=O)OC1=CC(Br)=CC=C1 DY40001 [0,1,0,0,0,1|2,0,0]=4 226 B11R1.157 NC(=O)CC1=CC(Cl)=CC=C1 DY799707 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 NO21911 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 DY653755 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 NO10775 [0,1,0,0,0,1|2,0,0]=4 230 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 NO21923 [0,1,0,0,0,1|2,0,0]=4 231 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 DY577827 [0,1,0,0,0,1|2,0,0]=4 232 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 DY431564 [0,1,0,0,0,1|2,0,0]=4 233 B11R1.157 O=C(O)CC1=CC(F)=NC=C1 DY430121 [0,1,0,0,0,1|2,0,0]=4 234 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 NO20851 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 NO20944 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.157 O=C(O)CC1=NC(Br)=NC=C1 DY692854 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 NO12801 [0,1,0,0,0,1|2,0,0]=4 238 B11R1.157 O=C(O)CC1=NC(Cl)=CN=C1 NO12495 [0,1,0,0,0,1|2,0,0]=4 239 B11R1.25 NCC(=O)NCC1=CC=CO1 DY509480 [0,1,0,0,0,1|0,0,0]=2 240 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O NO20416 [0,1,0,0,0,1|1,1,0]=4 241 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O NO13507 [0,1,0,0,0,1|1,0,0]=3 242 B11R1.75 O=C(O)CCC1=CC(Cl)=CO1 DY760016 [0,1,0,0,0,1|1,0,0]=3 243 B11R1.77 N[C@H](CC(=O)O)C1=CC=CO1 DY569493 [0,1,0,0,0,1|1,0,0]=3 244 B11R1.510 CC(C)(C)NCC1=CC=CO1 DY609924 [0,1,0,0,0,1|1,0,1]=4 245 B11R1.30 CCCC(=O)CC1=CC=CO1 DY604803 [0,2,0,0,0,0|0,0,0]=2 246 B11R1.30 CCOC(=O)CC1=NC=CS1 NO13253 [0,2,0,0,0,0|1,1,0]=4 247 B11R1.30 CCOC(=O)CC1=NNC=C1 DY573351 [0,2,0,0,0,0|2,0,0]=4 248 B11R1.39 CNC(=O)CN1C=C(Br)C=N1 DY606285 [0,2,0,0,0,0|2,0,0]=4 249 B11R1.39 COC(=O)CC1=CN=C(Cl)S1 DY785632 [0,2,0,0,0,0|1,1,0]=4 250 B11R1.39 COC(=O)CC1=NOC(C)=C1 DY773073 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.39 COC(=O)CN1C=C(Br)C=N1 NO16222 [0,2,0,0,0,0|2,0,0]=4 252 B11R1.39 COC(=O)CN1C=C(N)C=N1 DY649985 [0,2,0,0,0,0|2,0,0]=4 253 B9R1.6 CC(=O)C1=CC=CN=C1 NO18256 [0,0,1,1,0,0|1,0,1]=4 254 B9R1.6 CC(=O)C1=NC=CC=C1 NO18611 [0,0,1,1,0,0|1,0,1]=4 255 B9R2.3 C1=CC2=C(N=CS2)O1 DY544809 [1,0,0,1,0,0|1,1,0]=4 256 B11R2.10 O=C1CC2=C(C=CC=C2)O1 DY20944 [0,0,0,1,0,1|2,0,0]=4 257 B11R2.10 O=C1CC2=CC=CC=C2C1 NO16080 [0,0,0,1,0,1|1,0,0]=3 258 B11R2.10 O=C1CC2=CC=CC=C2N1 NO15184 [0,0,0,1,0,1|2,0,0]=4 259 B11R2.10 O=C1CC2=CC=CN=C2N1 DY523179 [0,0,0,1,0,1|2,0,0]=4 260 B11R2.36 CC1=CC2=C(C=C1)OC=C2 DY441161 [0,0,0,1,0,1|1,0,1]=4 261 B11R2.36 O=C1CCC2=C(C=NN2)C1 DY116171 [0,0,0,1,0,1|2,0,0]=4 262 B11R2.36 O=C1COC2=C(C=CS2)N1 DY822625 [0,0,0,1,0,1|1,1,0]=4 263 B9R1.8 CCCC1=CC=CN=C1 NO22402 [1,0,0,0,0,1|1,0,1]=4 264 B9R1.8 CNCC1=CC=CC=C1 DY10559 [1,0,0,0,0,1|2,0,0]=4 265 B9R1.8 CNCC1=CC=CC=C1 DY20323 [1,0,0,0,0,1|2,0,0]=4 266 B9R1.8 CNCC1=CC=CC=C1 DY21006 [1,0,0,0,0,1|2,0,0]=4 267 B9R1.8 CNCC1=CC=CN=C1 NO18846 [1,0,0,0,0,1|2,0,0]=4 268 B9R1.8 CNCC1=CC=NC=C1 DY712153 [1,0,0,0,0,1|2,0,0]=4 269 B9R1.8 CNCC1=NC=CC=C1 DY501242 [1,0,0,0,0,1|2,0,0]=4 270 B9R1.8 CNCC1=NC=CC=C1 DY663671 [1,0,0,0,0,1|2,0,0]=4 271 B9R1.8 COCC1=NC=CC=C1 NO20909 [1,0,0,0,0,1|2,0,0]=4 272 B9R1.8 CSCC1=NC=CN=C1 DY710935 [1,0,0,0,0,1|2,0,0]=4 273 B11R1.91 CC(=O)CCC1=CC=CN=C1 DY560043 [0,0,0,0,0,2|1,0,0]=3 274 B11R1.91 NC(=O)CCC1=NC=CC=C1 DY713935 [0,0,0,0,0,2|2,0,0]=4 275 B11R1.91 O=C(O)CCC1=CC=CC=C1 DY556977 [0,0,0,0,0,2|2,0,0]=4 276 B11R1.91 O=C(O)CNc1ccccc1 DY439073 [0,0,0,0,0,2|2,0,0]=4 277 B11R1.91 O=C(O)CSC1=CC=NC=C1 DY503439 [0,0,0,0,0,2|2,0,0]=4 278 B11R1.91 O=C(O)CSC1=NC=CC=C1 DY500080 [0,0,0,0,0,2|2,0,0]=4