0 B10R1.18 CC(=O)CC1=CC=NC=C1 32302 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.18 CC(=O)CC1=CC=NC=C1 65526 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.18 CC(=O)CC1=NC=CC=C1 65544 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 D88335 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.18 CC(=O)NC1=CC=NC=C1 D88476 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.18 CC(=O)NC1=CN=CC=C1 D76087 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.18 CC(=O)NC1=NC=CC=C1 H10380 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.18 CC(=O)NC1=NC=CC=N1 D97299 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.18 CC(=O)OC1=CC=CC=C1 D88203 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.18 CC(=O)OC1=CN=CC=C1 D88394 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.18 CC(=O)SC1=CC=CC=C1 H12050 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.18 CC(=S)NC1=CC=CC=C1 81311 [0,0,0,0,0,0|2,1,0]=3 12 B10R1.18 CC(C)=CC1=CC=CC=C1 W16227 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.18 CC(C)NC1=CC=CC=C1 D70367 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.18 CC(C)OC1=CC=CC=C1 I10258 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.18 C[C@H](O)CC1=CC=CC=C1 D71014 [0,0,0,0,0,0|1,0,1]=2 16 B10R1.18 C[Si](C)CC1=CC=CC=C1 D89172 [0,0,0,0,0,0|2,1,0]=3 17 B10R1.18 ClC(Cl)[SiH2]C1=CC=CC=C1 D97657 [0,0,0,0,0,0|2,1,1]=4 18 B10R1.18 FC(F)OC1=CC=CC=C1 I10218 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.18 N=C(N)NC1=CC=CC=C1 71104 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.18 N=C(N)NC1=CC=CC=C1 A11453 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.18 NC(=O)CC1=CC=CC=C1 20020 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.18 NC(=O)CC1=CN=CC=C1 F30204 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 D87783 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.18 NC(=O)NC1=CC=CC=C1 C11241 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.18 NC(=O)OC1=CC=CC=C1 81483 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.18 NC(=S)NC1=CC=NC=C1 S12372 [0,0,0,0,0,0|3,1,0]=4 27 B10R1.18 NC(=S)NC1=NC=CC=C1 S12067 [0,0,0,0,0,0|3,1,0]=4 28 B10R1.18 O=C(Cl)CC1=CC=CC=C1 S11991 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.18 O=C(O)CC1=CC=CC=C1 A12791 [0,0,0,0,0,0|0,0,0]=0 30 B10R1.18 O=C(O)CC1=CC=NC=C1 65460 [0,0,0,0,0,0|1,0,0]=1 31 B10R1.18 O=C(O)CC1=CC=NC=C1 65461 [0,0,0,0,0,0|1,0,0]=1 32 B10R1.18 O=C(O)CC1=CCCCC1 D70526 [0,0,0,0,0,0|0,0,4]=4 33 B10R1.18 O=C(O)CC1=CN=CC=C1 23119 [0,0,0,0,0,0|1,0,0]=1 34 B10R1.18 O=C(O)CC1=CN=CC=C1 28500 [0,0,0,0,0,0|1,0,0]=1 35 B10R1.18 O=C(O)CC1=NC=CC=C1 31161 [0,0,0,0,0,0|1,0,0]=1 36 B10R1.18 O=C(O)CC1=NC=CC=N1 29338 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.18 O=C(O)CC1=NC=CN=C1 69865 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.18 O=C(O)C[N+]1=CC=CC=C1 D85775 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.18 O=C([O-])CC1=NC=CC=N1 P14674 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.18 S=C(Cl)OC1=CC=CC=C1 C10635 [0,0,0,0,0,0|2,1,0]=3 41 B10R1.18 S=C(Cl)SC1=CC=CC=C1 D92096 [0,0,0,0,0,0|2,1,0]=3 42 B9R1.8 BrCCC1=CC=CC=C1 S12296 [1,0,0,0,0,0|1,0,1]=3 43 B9R1.8 BrCCC1=NC=CC=C1 54525 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.8 Br\C=C\C1=CC=CC=C1 D70190 [1,0,0,0,0,0|1,0,1]=3 45 B9R1.8 C#CCC1=CC=CC=C1 A11825 [1,0,0,0,0,0|1,0,1]=3 46 B9R1.8 C=CCC1=CC=CC=C1 FD14063 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.8 C=CSC1=CC=CC=C1 D92100 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.8 CC#CC1=CC=CC=C1 D71012 [1,0,0,0,0,0|1,0,2]=4 49 B9R1.8 CCCC1=CC=CC=C1 F10002 [1,0,0,0,0,0|1,0,1]=3 50 B9R1.8 CCCC1=CC=NC=C1 D86491 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.8 CCCC1=NC=CC=C1 A10924 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.8 CCOC1=CC=CC=C1 D78866 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.8 CCSC1=CC=CC=C1 H10383 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.8 CNCC1=CC=CC=C1 AR1001 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.8 CNCC1=CC=CN=C1 28981 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.8 CNCC1=CC=CN=C1 AR1268 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.8 CNCC1=CC=NC=C1 30756 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.8 CNCC1=NC=CC=C1 29930 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.8 CNCC1=NC=CC=C1 AR1010 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.8 COCC1=CC=CC=C1 D88644 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.8 COCC1=NC=CC=C1 23564 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.8 C\N=C\C1=CC=CC=C1 D94771 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.8 ClCCC1=CC=CC=C1 D70839 [1,0,0,0,0,0|1,0,1]=3 64 B9R1.8 ClCSC1=CC=CC=C1 D89325 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.8 ICCC1=CC=CC=C1 D70924 [1,0,0,0,0,0|1,0,1]=3 66 B9R1.8 N#CCC1=CC=NC=C1 74034 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.8 N#CCC1=CC=NC=C1 81779 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.8 N#CCC1=CN=CC=C1 24086 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.8 N#CCC1=NC=CC=C1 73694 [1,0,0,0,0,0|2,0,1]=4 70 B9R1.8 N#CC[N+]1=CC=CC=C1 D89308 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.8 N#COC1=CC=CC=C1 AB8955 [1,0,0,0,0,0|2,0,1]=4 72 B9R1.8 NCCC1=CC=CC=C1 D78532 [1,0,0,0,0,0|1,0,1]=3 73 B9R1.8 NCCC1=CC=CN=C1 51507 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.8 NCCC1=CC=CN=C1 51508 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.8 NCCC1=CC=NC=C1 51916 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.8 NCCC1=CC=NC=C1 N12034 [1,0,0,0,0,0|2,0,1]=4 77 B9R1.8 NCCC1=NC=CC=C1 AB1583 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.8 NNCC1=CC=CC=C1 53542 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.8 NNCC1=CC=CC=C1 53594 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.8 NNCC1=CC=CC=C1 78678 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.8 NNCC1=CC=CN=C1 37010 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.8 NNCC1=CC=CN=C1 71680 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.8 NNCC1=NC=CC=C1 37011 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.8 NOCC1=CC=CC=C1 54239 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.8 NOCC1=CC=CC=C1 N10409 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.8 O=C=NC1=NC=CC=C1 P20838 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.8 O=CCC1=CC=CC=C1 D78329 [1,0,0,0,0,0|0,0,0]=1 88 B9R1.8 O=CNC1=CC=CC=C1 D70279 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.8 O=CNC1=NC=CC=C1 AB9953 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.8 O=COC1=CC=CC=C1 F20974 [1,0,0,0,0,0|1,0,0]=2 91 B9R1.8 O=S=NC1=CC=CC=C1 H11314 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.8 OCCC1=CC=CC=C1 D70868 [1,0,0,0,0,0|0,0,1]=2 93 B9R1.8 OCCC1=CC=NC=C1 27360 [1,0,0,0,0,0|1,0,1]=3 94 B9R1.8 OCCC1=CN=CC=C1 29643 [1,0,0,0,0,0|1,0,1]=3 95 B9R1.8 OCCC1=NC=CC=C1 D70485 [1,0,0,0,0,0|1,0,1]=3 96 B9R1.8 OCCC1=NC=CN=C1 26585 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.8 ONCC1=CC=CC=C1 23229 [1,0,0,0,0,0|1,0,0]=2 98 B9R1.8 ONCC1=CC=CC=C1 70488 [1,0,0,0,0,0|1,0,0]=2 99 B9R1.8 O\N=C\C1=CC=CC=C1 53644 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.8 O\N=C\C1=CC=CC=C1 D78196 [1,0,0,0,0,0|1,0,1]=3 101 B9R1.8 O\N=C\C1=NC=CC=C1 AC8526 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.8 S=C=NC1=CC=CC=C1 D77304 [1,0,0,0,0,0|1,1,1]=4 103 B9R1.8 SCCC1=CC=CC=C1 AC9387 [1,0,0,0,0,0|0,1,1]=3 104 B9R1.8 SCCC1=CC=NC=C1 H11399 [1,0,0,0,0,0|1,1,1]=4 105 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 CL9059 [0,1,0,0,0,0|1,0,0]=2 106 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 N11980 [0,1,0,0,0,0|1,0,0]=2 107 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 S10960 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CL9158 [0,1,0,0,0,0|1,0,0]=2 109 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 D71238 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 11780 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 TD1001 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 20004 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 F21272 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 AC8790 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 46002 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 22249 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 I10246 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 F19619 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 A51155 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 34627 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.20 CC(=O)OC1=CC=C(I)C=C1 H11537 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 AC1885 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 W10553 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 34723 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.20 CC(C)CC1=CC=C(I)C=C1 D94791 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.20 CC(C)CC1=CC=C(N)C=C1 N12506 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 73716 [0,1,0,0,0,0|0,0,0]=1 128 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 28823 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 D92325 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 78765 [0,1,0,0,0,0|2,1,0]=4 131 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 RB3375 [0,1,0,0,0,0|1,0,0]=2 132 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 76381 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.20 CN(C)CC1=CC=C(Br)C=C1 D97623 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.20 CN(C)CC1=CC=C(N)C=C1 34677 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.20 CN(C)CC1=CC=C(O)C=C1 C80067 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.20 C[C@H](N)CC1=CC=C(F)C=C1 BL000373 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.20 FC(F)=CC1=CC=C(Br)C=C1 T71386 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 25414 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 D97484 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 84998 [0,1,0,0,0,0|1,0,0]=2 141 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 S12297 [0,1,0,0,0,0|1,0,0]=2 142 B11R1.20 NC(=O)NC1=CC=C(Br)C=C1 F20475 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 D84244 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 D90690 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 F14899 [0,1,0,0,0,0|2,1,0]=4 146 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 D85854 [0,1,0,0,0,0|2,1,0]=4 147 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 S11966 [0,1,0,0,0,0|2,1,0]=4 148 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 AB7339 [0,1,0,0,0,0|2,1,0]=4 149 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 AC7503 [0,1,0,0,0,0|0,0,0]=1 150 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 D81755 [0,1,0,0,0,0|1,0,0]=2 151 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 P16509 [0,1,0,0,0,0|0,0,0]=1 152 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 D70527 [0,1,0,0,0,0|0,0,0]=1 153 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 25500 [0,1,0,0,0,0|0,0,0]=1 154 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 33451 [0,1,0,0,0,0|0,0,0]=1 155 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 AC7824 [0,1,0,0,0,0|0,0,0]=1 156 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 57816 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 36095 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 26781 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.36 C=C(B(O)O)C1=CC=CC=C1 S12165 [0,1,0,0,0,0|1,0,2]=4 160 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 54790 [0,1,0,0,0,0|0,0,1]=2 161 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 F11432 [0,1,0,0,0,0|1,0,1]=3 162 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 AC9550 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.36 CC(=O)[C@H](Br)C1=CC=CC=C1 21510 [0,1,0,0,0,0|1,0,0]=2 164 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 20155 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 74149 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 F14802 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.36 CN(C(N)=S)C1=CC=CC=C1 D85864 [0,1,0,0,0,0|2,1,0]=4 168 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 65110 [0,1,0,0,0,0|0,0,0]=1 169 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 65112 [0,1,0,0,0,0|0,0,0]=1 170 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 F13477 [0,1,0,0,0,0|0,0,0]=1 171 B11R1.36 C[C@@H](C(=O)[O-])C1=NC=CC=C1 D80873 [0,1,0,0,0,0|1,0,1]=3 172 B11R1.36 C[C@@H](C1=CC=CC=C1)N(C)C D86057 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 30968 [0,1,0,0,0,0|1,0,0]=2 174 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 O10163 [0,1,0,0,0,0|1,0,0]=2 175 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 S10736 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.36 NC(=O)[C@H](O)C1=CC=CC=C1 F17453 [0,1,0,0,0,0|1,0,0]=2 177 B11R1.36 N[C@@H](C(=O)Cl)C1=CC=CC=C1 F10879 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 73306 [0,1,0,0,0,0|0,0,0]=1 179 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 D70539 [0,1,0,0,0,0|0,0,0]=1 180 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 O10164 [0,1,0,0,0,0|0,0,0]=1 181 B11R1.36 N[C@@H](C(=O)O)C1=CCC=CC1 S10036 [0,1,0,0,0,0|0,0,2]=3 182 B11R1.36 N[C@@H](C(=O)O)C1=NC=CC=C1 65592 [0,1,0,0,0,0|1,0,0]=2 183 B11R1.36 O=C(C1=CC=CC=C1)C(O)O D70386 [0,1,0,0,0,0|0,0,3]=4 184 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 S11007 [0,1,0,0,0,0|0,0,1]=2 185 B11R1.36 O=C(O)[C@H](Br)C1=CC=CC=C1 54490 [0,1,0,0,0,0|0,0,0]=1 186 B11R1.36 O=C(O)[C@H](Cl)C1=CC=CC=C1 S11957 [0,1,0,0,0,0|0,0,0]=1 187 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 24604 [0,1,0,0,0,0|0,0,0]=1 188 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 D70151 [0,1,0,0,0,0|0,0,0]=1 189 B11R1.40 C=CC(=O)NC1=CC=CC=C1 C10642 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.40 C=CC(=O)NC1=NC=CC=C1 D80876 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.40 C=CC(=O)OC1=CC=CC=C1 AC8636 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.40 CCC(=O)CC1=CC=CC=C1 75226 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.40 CCC(=O)OC1=CC=CC=C1 C13913 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 D94692 [0,1,0,0,0,0|1,0,1]=3 195 B11R1.40 COC(=O)CC1=CC=CC=C1 D77850 [0,1,0,0,0,0|0,0,0]=1 196 B11R1.40 COC(=O)CC1=CC=NC=C1 28936 [0,1,0,0,0,0|1,0,0]=2 197 B11R1.40 COC(=O)CC1=CN=CC=C1 AB11862 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.40 COC(=O)CC1=NC=CC=C1 63412 [0,1,0,0,0,0|1,0,0]=2 199 B11R1.40 COC(=O)CC1=NC=CC=N1 30382 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.40 COC(=O)CC1=NC=CN=C1 50758 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.40 COC(=O)NC1=CC=CC=C1 D70137 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.40 COC(=O)OC1=CC=CC=C1 D71100 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.40 C[C@@H](CO)OC1=CC=CC=C1 F17120 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.40 C[C@H](CO)CC1=CC=CC=C1 D86956 [0,1,0,0,0,0|1,0,1]=3 205 B11R1.40 C\C(=C/C1=CC=CC=C1)CO W13161 [0,1,0,0,0,0|1,0,1]=3 206 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 47226 [0,1,0,0,0,0|1,0,1]=3 207 B11R1.40 N=C(CC1=CC=CC=C1)NO S10392 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.40 NC[C@@H](O)CC1=CC=CC=C1 AR3947 [0,1,0,0,0,0|1,0,1]=3 209 B11R1.40 NNC(=O)CC1=CC=CC=C1 AC1644 [0,1,0,0,0,0|1,0,0]=2 210 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 D81925 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.40 NNC(=O)NC1=CC=CC=C1 D91930 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.40 NNC(=S)NC1=CC=CC=C1 D91931 [0,1,0,0,0,0|2,1,0]=4 213 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 26243 [0,1,0,0,0,0|1,0,1]=3 214 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 26245 [0,1,0,0,0,0|1,0,1]=3 215 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 F10667 [0,1,0,0,0,0|1,0,1]=3 216 B11R1.40 N\C(CC1=CC=CC=C1)=N\O W10704 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.40 O=C(CBr)NC1=CC=CC=C1 27931 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.40 O=C(CBr)OC1=CC=CC=C1 F14277 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.40 O=C(CCl)NC1=CC=CC=C1 W18660 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.40 O=C(CCl)NC1=CC=NC=C1 AC6855 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.40 O=C(CCl)NC1=NC=CC=C1 C15918 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.40 O=C(CI)NC1=CC=CC=C1 F53134 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.40 O=C\C(Br)=C/C1=CC=CC=C1 D88774 [0,1,0,0,0,0|1,0,1]=3 224 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 29393 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 I10164 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 N11952 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 H10022 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.86 CC(=O)NC1=C(C)C=CC=C1 A51039 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.86 CC(=O)NC1=C(C)C=CN=C1 11671 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 AC7922 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.86 CC(=O)NC1=C(F)C=CC=C1 AB11465 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 N10407 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 O11987 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.86 CC(=O)NC1=NC=CC=C1C L10169 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.86 CC(=O)NC1=NC=CC=C1O Y10621 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.86 CC(=O)OC1=C(Cl)C=CC=C1 D89493 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.86 CC(=O)OC1=CC=CN=C1Br P17659 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.86 CC(C)CC1=C(N)C=CC=C1 AC1619 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 D71087 [0,1,0,0,0,0|0,0,0]=1 240 B11R1.86 CC1=C(NC(N)=O)C=CC=C1 D92396 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.86 CC1=C(NC(N)=S)C=CC=C1 D85861 [0,1,0,0,0,0|2,1,0]=4 242 B11R1.86 CN(C)CC1=C(Br)C=CC=C1 N10120 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.86 N=C(N)CC1=C(Cl)C=CC=C1 H10662 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.86 N=C(N)NC1=C(Cl)C=CC=C1 D80498 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.86 NC(=O)CC1=C(Cl)C=CC=C1 31430 [0,1,0,0,0,0|1,0,0]=2 246 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 F19866 [0,1,0,0,0,0|2,1,0]=4 247 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 D82299 [0,1,0,0,0,0|2,1,0]=4 248 B11R1.86 NC(=S)NC1=C(F)C=CC=C1 75067 [0,1,0,0,0,0|2,1,0]=4 249 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 33477 [0,1,0,0,0,0|0,0,0]=1 250 B11R1.86 NC1=C(CC(=O)O)C=CC=N1 77879 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 21738 [0,1,0,0,0,0|0,0,0]=1 252 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 D87878 [0,1,0,0,0,0|0,0,0]=1 253 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 36874 [0,1,0,0,0,0|0,0,0]=1 254 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 33450 [0,1,0,0,0,0|0,0,0]=1 255 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 28901 [0,1,0,0,0,0|0,0,0]=1 256 B11R1.86 O=C(O)CC1=CC=CN=C1Cl 57253 [0,1,0,0,0,0|1,0,0]=2 257 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 CL8856 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 O10275 [0,1,0,0,0,0|1,0,0]=2 259 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F21360 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.157 CC(=O)NC1=CC(Br)=CN=C1 96546 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 D88205 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 35817 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 P19657 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.157 CC(=O)NC1=CC(O)=CC=C1 11871 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.157 CC(=O)NC1=CC=CC(Br)=C1 C10957 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.157 CC(=O)NC1=CC=CC(Br)=N1 F18258 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 D84622 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 AB11466 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.157 CC(=O)NC1=NC(C)=CC=C1 F16701 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 22892 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.157 CC(=O)NC1=NC=CC(C)=C1 F16668 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 23803 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 I10260 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 76450 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 A10247 [0,1,0,0,0,0|0,0,0]=1 276 B11R1.157 CN(C)CC1=CC(N)=CC=C1 71047 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 O10271 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 77822 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 D95102 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.157 NC(=O)NC1=CC(O)=CC=C1 D90870 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.157 NC(=S)NC1=CC(F)=CC=C1 D85867 [0,1,0,0,0,0|2,1,0]=4 282 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 D85857 [0,1,0,0,0,0|2,1,0]=4 283 B11R1.157 NC(=S)NC1=CC=CC(Br)=C1 28351 [0,1,0,0,0,0|2,1,0]=4 284 B11R1.157 NC(=S)NC1=CC=CC(Cl)=C1 D89545 [0,1,0,0,0,0|2,1,0]=4 285 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 CL8768 [0,1,0,0,0,0|0,0,0]=1 286 B11R1.157 O=C(O)CC1=CC(Br)=NC=C1 F53120 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 F17279 [0,1,0,0,0,0|1,0,0]=2 288 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 AB3840 [0,1,0,0,0,0|0,0,0]=1 289 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 67683 [0,1,0,0,0,0|0,0,0]=1 290 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 67684 [0,1,0,0,0,0|0,0,0]=1 291 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 22029 [0,1,0,0,0,0|0,0,0]=1 292 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 CK2077 [0,1,0,0,0,0|0,0,0]=1 293 B11R1.509 CC(C)(O)CC1=CC=CC=C1 C11039 [0,1,0,0,0,0|1,0,1]=3 294 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 D82030 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.509 CS(=O)(=O)OC1=CC=CC=C1 AB10306 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 20561 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 AB10280 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 D72513 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 D72531 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 D94731 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.509 C[Si](C)(C)CC1=CC=CC=C1 D78099 [0,1,0,0,0,0|2,1,0]=4 302 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 D88928 [0,1,0,0,0,0|2,1,0]=4 303 B11R1.509 F[B-](F)(F)CC1=CC=CC=C1 I11238 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 33371 [0,1,0,0,0,0|1,0,1]=3 305 B11R1.509 O=P(Cl)(Cl)OC1=CC=CC=C1 67662 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 D88591 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.509 O=P([O-])([O-])OC1=CC=CC=C1 D91924 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.509 O=P([O-])([O-])OC1=CC=CC=C1 D97709 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 AR2915 [0,1,0,0,0,0|1,0,1]=3 310 B11R1.509 O=S(=O)([O-])OC1=CC=CC=C1 T71922 [0,1,0,0,0,0|2,0,1]=4 311 B11R2.4 NC1CC1C2=CC=CC=C2 74589 [0,0,0,1,0,0|2,0,1]=4 312 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 D81815 [0,0,0,1,0,0|2,0,1]=4 313 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 FD9050 [0,0,0,1,0,0|2,0,1]=4 314 B11R2.10 BrB1OC2=C(C=CC=C2)O1 F14949 [0,0,0,1,0,0|3,0,0]=4 315 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 33531 [0,0,0,1,0,0|2,0,0]=3 316 B11R2.10 BrC1=CC2=C(C=CC=C2)S1 D83873 [0,0,0,1,0,0|1,1,1]=4 317 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 CL3458 [0,0,0,1,0,0|3,0,0]=4 318 B11R2.10 BrC1=NC2=C(C=CC=C2)S1 54566 [0,0,0,1,0,0|2,1,0]=4 319 B11R2.10 BrC1CC2=C(C=CC=C2)C1 55651 [0,0,0,1,0,0|2,0,1]=4 320 B11R2.10 CC1=CC2=C(C=CC=C2)C1 AC7927 [0,0,0,1,0,0|2,0,0]=3 321 B11R2.10 CC1=CC2=C(C=CC=C2)N1 63872 [0,0,0,1,0,0|2,0,1]=4 322 B11R2.10 CC1=CC2=C(C=CC=C2)S1 54483 [0,0,0,1,0,0|1,1,1]=4 323 B11R2.10 CC1=NC2=C(C=CC=C2)N1 AC7835 [0,0,0,1,0,0|3,0,0]=4 324 B11R2.10 CC1=NC2=C(C=CC=C2)O1 AC1636 [0,0,0,1,0,0|2,0,0]=3 325 B11R2.10 CC1=NC2=C(C=CC=C2)S1 F14837 [0,0,0,1,0,0|2,1,0]=4 326 B11R2.10 CC1=NC2=C(C=CC=N2)O1 W17510 [0,0,0,1,0,0|3,0,0]=4 327 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 D71186 [0,0,0,1,0,0|2,0,1]=4 328 B11R2.10 C[C@H]1CC2=C(C=CC=C2)O1 D89877 [0,0,0,1,0,0|1,0,1]=3 329 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 78944 [0,0,0,1,0,0|3,0,0]=4 330 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 78896 [0,0,0,1,0,0|2,0,0]=3 331 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 D70903 [0,0,0,1,0,0|2,1,0]=4 332 B11R2.10 ClC1=NC2=C(N=CC=C2)O1 27558 [0,0,0,1,0,0|3,0,0]=4 333 B11R2.10 FC1=CC2=C(C=CC=C2)N1 D80504 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.10 IC1=NC2=C(C=CC=C2)S1 54376 [0,0,0,1,0,0|2,1,0]=4 335 B11R2.10 NC1=NC2=C(C=CC=C2)N1 W10172 [0,0,0,1,0,0|3,0,0]=4 336 B11R2.10 NC1=NC2=C(C=CC=C2)O1 52983 [0,0,0,1,0,0|2,0,0]=3 337 B11R2.10 NC1=NC2=C(C=CC=C2)S1 CL4537 [0,0,0,1,0,0|2,1,0]=4 338 B11R2.10 NC1=NC2=C(C=CC=C2)S1 D88395 [0,0,0,1,0,0|2,1,0]=4 339 B11R2.10 NC1=NC2=C(C=CC=N2)O1 52987 [0,0,0,1,0,0|3,0,0]=4 340 B11R2.10 NC1CC2=C(C=CC=C2)C1 62714 [0,0,0,1,0,0|2,0,1]=4 341 B11R2.10 O=C1CC2=C(C=CC=C2)C1 F10966 [0,0,0,1,0,0|1,0,0]=2 342 B11R2.10 O=C1CC2=C(C=CC=C2)N1 AB7349 [0,0,0,1,0,0|1,0,0]=2 343 B11R2.10 O=C1CC2=C(C=CC=C2)O1 L10016 [0,0,0,1,0,0|0,0,0]=1 344 B11R2.10 O=C1CC2=C(C=CC=N2)N1 SC3121 [0,0,0,1,0,0|2,0,0]=3 345 B11R2.10 O=C1CC2=C(C=NC=C2)N1 37301 [0,0,0,1,0,0|2,0,0]=3 346 B11R2.10 O=C1CC2=C(N=CC=C2)N1 36978 [0,0,0,1,0,0|2,0,0]=3 347 B11R2.10 O=C1CC2=C(N=CC=C2)N1 68461 [0,0,0,1,0,0|2,0,0]=3 348 B11R2.10 O=C1CN2C=CC=CC2=N1 W17195 [0,0,0,1,0,0|2,0,0]=3 349 B11R2.10 O=C1NC2=C(C=CC=C2)N1 F12393 [0,0,0,1,0,0|2,0,0]=3 350 B11R2.10 O=C1NC2=C(C=CC=C2)O1 AC8520 [0,0,0,1,0,0|1,0,0]=2 351 B11R2.10 O=C1NC2=C(C=CC=N2)O1 37400 [0,0,0,1,0,0|2,0,0]=3 352 B11R2.10 O=C1NC2=C(N=CC=C2)N1 24783 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.10 O=C1OC2=C(C=CC=C2)O1 O11687 [0,0,0,1,0,0|1,0,0]=2 354 B11R2.10 OC1=CC2=C(N=CC=C2)N1 F18527 [0,0,0,1,0,0|2,0,1]=4 355 B11R2.10 OC1=NC2=C(C=CC=C2)S1 F14867 [0,0,0,1,0,0|1,1,0]=3 356 B11R2.10 OC1=NC2=C(C=NC=C2)N1 CS1977 [0,0,0,1,0,0|3,0,0]=4 357 B11R2.10 OC1CC2=C(C=CC=C2)C1 O10574 [0,0,0,1,0,0|1,0,1]=3 358 B11R2.10 S=C1CC2=C(C=CC=C2)N1 F30120 [0,0,0,1,0,0|1,1,0]=3 359 B11R2.10 S=C1NC2=C(C=CC=C2)S1 D70518 [0,0,0,1,0,0|1,2,0]=4 360 B11R2.10 S=C1[N-]C2=C(C=CC=C2)S1 D76944 [0,0,0,1,0,0|1,2,0]=4 361 B11R2.10 SC1=NC2=C(C=CC=C2)N1 W11093 [0,0,0,1,0,0|2,1,0]=4 362 B11R2.10 SC1=NC2=C(C=CC=C2)O1 52804 [0,0,0,1,0,0|1,1,0]=3 363 B11R2.10 SC1=NC2=C(C=CC=N2)O1 S12151 [0,0,0,1,0,0|2,1,0]=4 364 B9R1.6 BrC(Br)C1=CC=CC=C1 N11924 [0,0,0,0,1,0|2,0,1]=4 365 B9R1.6 C=C(Br)C1=CC=CC=C1 D95919 [0,0,0,0,1,0|2,0,0]=3 366 B9R1.6 C=C(C)C1=CC=CN=C1 P19051 [0,0,0,0,1,0|3,0,0]=4 367 B9R1.6 CC(=O)C1=CC=CC=C1 D71016 [0,0,0,0,1,0|1,0,0]=2 368 B9R1.6 CC(=O)C1=CC=NC=C1 67667 [0,0,0,0,1,0|2,0,0]=3 369 B9R1.6 CC(=O)C1=CN=CC=C1 67603 [0,0,0,0,1,0|2,0,0]=3 370 B9R1.6 CC(=O)C1=CN=CN=C1 82951 [0,0,0,0,1,0|3,0,0]=4 371 B9R1.6 CC(=O)C1=CN=NC=C1 RB3221 [0,0,0,0,1,0|3,0,0]=4 372 B9R1.6 CC(=O)C1=NC=CC=C1 P19605 [0,0,0,0,1,0|2,0,0]=3 373 B9R1.6 CC(=O)C1=NC=CC=N1 50312 [0,0,0,0,1,0|3,0,0]=4 374 B9R1.6 CC(=O)C1=NC=CN=C1 AC7524 [0,0,0,0,1,0|3,0,0]=4 375 B9R1.6 CC(=O)C1=NC=NC=C1 20354 [0,0,0,0,1,0|3,0,0]=4 376 B9R1.6 CN(N)C1=CC=CC=C1 S11053 [0,0,0,0,1,0|3,0,0]=4 377 B9R1.6 CP(C)C1=CC=CC=C1 D97453 [0,0,0,0,1,0|3,0,0]=4 378 B9R1.6 C[C@H](Br)C1=CC=CC=C1 F20928 [0,0,0,0,1,0|2,0,1]=4 379 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77692 [0,0,0,0,1,0|2,0,1]=4 380 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77861 [0,0,0,0,1,0|2,0,1]=4 381 B9R1.6 C[C@H](O)C1=CC=CC=C1 F13058 [0,0,0,0,1,0|1,0,1]=3 382 B9R1.6 C[C@H](O)C1=CC=CC=C1 F13077 [0,0,0,0,1,0|1,0,1]=3 383 B9R1.6 C[C@H](O)C1=CC=NC=C1 29330 [0,0,0,0,1,0|2,0,1]=4 384 B9R1.6 C[C@H](O)C1=CC=NC=C1 52702 [0,0,0,0,1,0|2,0,1]=4 385 B9R1.6 C[C@H](O)C1=CC=NC=C1 W18270 [0,0,0,0,1,0|2,0,1]=4 386 B9R1.6 C[C@H](O)C1=CN=CC=C1 28468 [0,0,0,0,1,0|2,0,1]=4 387 B9R1.6 C[C@H](O)C1=CN=CC=C1 31273 [0,0,0,0,1,0|2,0,1]=4 388 B9R1.6 C[C@H](O)C1=CN=CC=C1 31307 [0,0,0,0,1,0|2,0,1]=4 389 B9R1.6 C[C@H](O)C1=NC=CC=C1 35186 [0,0,0,0,1,0|2,0,1]=4 390 B9R1.6 C[S@](=O)C1=CC=CC=C1 W16288 [0,0,0,0,1,0|2,0,0]=3 391 B9R1.6 C[SiH](C)C1=CC=CC=C1 I11449 [0,0,0,0,1,0|2,1,0]=4 392 B9R1.6 ClB(Cl)C1=CC=CC=C1 D90280 [0,0,0,0,1,0|3,0,0]=4 393 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 F15104 [0,0,0,0,1,0|3,0,0]=4 394 B9R1.6 FC(F)C1=CC=CC=C1 I10230 [0,0,0,0,1,0|2,0,1]=4 395 B9R1.6 N=C(N)C1=CC=CC=C1 30306 [0,0,0,0,1,0|2,0,0]=3 396 B9R1.6 N=C(N)C1=CC=CC=C1 73720 [0,0,0,0,1,0|2,0,0]=3 397 B9R1.6 N=C(N)C1=CC=CC=C1 AC2200 [0,0,0,0,1,0|2,0,0]=3 398 B9R1.6 N=C(N)C1=CC=CN=C1 CL0140 [0,0,0,0,1,0|3,0,0]=4 399 B9R1.6 N=C(N)C1=CC=NC=C1 74142 [0,0,0,0,1,0|3,0,0]=4 400 B9R1.6 N=C(N)C1=CC=NC=C1 F14810 [0,0,0,0,1,0|3,0,0]=4 401 B9R1.6 N=C(N)C1=NC=CC=C1 67969 [0,0,0,0,1,0|3,0,0]=4 402 B9R1.6 NC(=O)C1=CC=CC=C1 D70176 [0,0,0,0,1,0|1,0,0]=2 403 B9R1.6 NC(=O)C1=CC=NC=C1 D70516 [0,0,0,0,1,0|2,0,0]=3 404 B9R1.6 NC(=O)C1=CN=CC=C1 11886 [0,0,0,0,1,0|2,0,0]=3 405 B9R1.6 NC(=O)C1=NC=CC=C1 70831 [0,0,0,0,1,0|2,0,0]=3 406 B9R1.6 NC(=O)C1=NC=CN=C1 D70481 [0,0,0,0,1,0|3,0,0]=4 407 B9R1.6 NC(=S)C1=CC=CC=C1 29507 [0,0,0,0,1,0|1,1,0]=3 408 B9R1.6 NC(=S)C1=CC=NC=C1 31337 [0,0,0,0,1,0|2,1,0]=4 409 B9R1.6 NC(=S)C1=CN=CC=C1 31339 [0,0,0,0,1,0|2,1,0]=4 410 B9R1.6 NC(=S)C1=NC=CC=C1 31338 [0,0,0,0,1,0|2,1,0]=4 411 B9R1.6 O=C(Br)C1=CC=CC=C1 F20923 [0,0,0,0,1,0|1,0,0]=2 412 B9R1.6 O=C(Cl)C1=CC=NC=C1 H11306 [0,0,0,0,1,0|2,0,0]=3 413 B9R1.6 O=C(Cl)C1=CN=CC=C1 F16330 [0,0,0,0,1,0|2,0,0]=3 414 B9R1.6 O=C(Cl)C1=NC=CC=C1 35856 [0,0,0,0,1,0|2,0,0]=3 415 B9R1.6 O=C(F)C1=CC=CC=C1 D88754 [0,0,0,0,1,0|1,0,0]=2 416 B9R1.6 O=C(O)C1=CC=CC=C1 D85168 [0,0,0,0,1,0|0,0,0]=1 417 B9R1.6 O=C(O)C1=CC=CC=C1 P19750 [0,0,0,0,1,0|0,0,0]=1 418 B9R1.6 O=C(O)C1=CC=NC=C1 AC8088 [0,0,0,0,1,0|1,0,0]=2 419 B9R1.6 O=C(O)C1=CN=CC=C1 AC8691 [0,0,0,0,1,0|1,0,0]=2 420 B9R1.6 O=C(O)C1=CN=CN=C1 CL1919 [0,0,0,0,1,0|2,0,0]=3 421 B9R1.6 O=C(O)C1=CN=NC=C1 23325 [0,0,0,0,1,0|2,0,0]=3 422 B9R1.6 O=C(O)C1=NC=CC=C1 11826 [0,0,0,0,1,0|1,0,0]=2 423 B9R1.6 O=C(O)C1=NC=CC=C1 CK2602 [0,0,0,0,1,0|1,0,0]=2 424 B9R1.6 O=C(O)C1=NC=CC=N1 65420 [0,0,0,0,1,0|2,0,0]=3 425 B9R1.6 O=C(O)C1=NC=CN=C1 CX1040 [0,0,0,0,1,0|2,0,0]=3 426 B9R1.6 O=C(O)C1=NC=NC=C1 52386 [0,0,0,0,1,0|2,0,0]=3 427 B9R1.6 O=C(O)C1=NN=CC=C1 24415 [0,0,0,0,1,0|2,0,0]=3 428 B9R1.6 O=C([O-])C1=CC=CC=C1 H11333 [0,0,0,0,1,0|0,0,1]=2 429 B9R1.6 O=C([O-])C1=CC=NC=C1 D92052 [0,0,0,0,1,0|1,0,1]=3 430 B9R1.6 O=C([O-])C1=CN=CC=C1 D97712 [0,0,0,0,1,0|1,0,1]=3 431 B9R1.6 O=C([O-])C1=NC=CC=C1 H10837 [0,0,0,0,1,0|1,0,1]=3 432 B9R1.6 O=S([O-])C1=CC=CC=C1 D82105 [0,0,0,0,1,0|1,0,1]=3 433 B9R1.6 O=[N+]([O-])C1=CC=NC=C1 51712 [0,0,0,0,1,0|2,0,1]=4 434 B9R1.6 O=[N+]([O-])C1=CN=CC=C1 CL0277 [0,0,0,0,1,0|2,0,1]=4 435 B9R1.6 O=[P@H](O)C1=CC=CC=C1 H12022 [0,0,0,0,1,0|1,0,0]=2 436 B9R1.6 O=[S@](O)C1=CC=CC=C1 D70177 [0,0,0,0,1,0|1,0,0]=2 437 B9R1.6 O=[S@]([O-])C1=CC=CC=C1 D77766 [0,0,0,0,1,0|1,0,1]=3 438 B9R1.6 OB(O)C1=CC=CC=C1 20060 [0,0,0,0,1,0|1,0,1]=3 439 B9R1.6 OB(O)C1=CC=NC=C1 59594 [0,0,0,0,1,0|2,0,1]=4 440 B9R1.6 OB(O)C1=CC=NC=C1 D82057 [0,0,0,0,1,0|2,0,1]=4 441 B9R1.6 OB(O)C1=CN=CC=C1 59593 [0,0,0,0,1,0|2,0,1]=4 442 B9R1.6 OB(O)C1=NC=CC=C1 65504 [0,0,0,0,1,0|2,0,1]=4 443 B9R1.6 OC(=S)C1=CC=CC=C1 D78412 [0,0,0,0,1,0|0,1,0]=2 444 B9R1.13 CC(=O)NC1=CSC=C1 30787 [0,0,0,0,1,0|3,0,0]=4 445 B9R1.13 C[C@H](O)CC1=CC=CO1 31846 [0,0,0,0,1,0|2,0,1]=4 446 B9R1.13 NC(=O)CC1=CC=CS1 D85917 [0,0,0,0,1,0|2,0,0]=3 447 B9R1.13 O=C(Cl)CC1=CC=CS1 D78176 [0,0,0,0,1,0|2,0,0]=3 448 B9R1.13 O=C(O)CC1=CC=CS1 P10011 [0,0,0,0,1,0|1,0,0]=2 449 B9R1.13 O=C(O)CC1=CN=CN1 76838 [0,0,0,0,1,0|2,0,0]=3 450 B9R1.13 O=C(O)CC1=CNC=N1 62600 [0,0,0,0,1,0|2,0,0]=3 451 B9R1.13 O=C(O)CC1=CSC=C1 23025 [0,0,0,0,1,0|1,0,0]=2 452 B9R1.13 O=C(O)CC1=CSC=N1 30725 [0,0,0,0,1,0|2,0,0]=3 453 B9R1.13 O=C(O)CC1=NNC=C1 82858 [0,0,0,0,1,0|2,0,0]=3 454 B9R1.13 O=C(O)CN1C=CC=N1 CL3510 [0,0,0,0,1,0|2,0,0]=3 455 B9R1.13 O=C(O)CN1C=CN=C1 39400 [0,0,0,0,1,0|2,0,0]=3 456 B9R1.13 O=C(O)CN1C=CN=N1 I11576 [0,0,0,0,1,0|3,0,0]=4 457 B9R1.13 O=C(O)CN1C=NC=N1 78721 [0,0,0,0,1,0|3,0,0]=4 458 B9R1.13 O=C(O)CN1N=CC=N1 25165 [0,0,0,0,1,0|3,0,0]=4 459 B11R1.91 CC(=N)SCC1=CC=CC=C1 77568 [0,0,0,0,0,1|2,0,0]=3 460 B11R1.91 CC(=O)CCC1=CC=CC=C1 P17497 [0,0,0,0,0,1|1,0,0]=2 461 B11R1.91 CC(=O)COC1=CC=CC=C1 34157 [0,0,0,0,0,1|1,0,0]=2 462 B11R1.91 CC(=O)NCC1=CC=CC=C1 D70359 [0,0,0,0,0,1|1,0,0]=2 463 B11R1.91 CC(=O)NNC1=CC=CC=C1 F11205 [0,0,0,0,0,1|2,0,0]=3 464 B11R1.91 CC(=O)OCC1=NC=CC=C1 C13980 [0,0,0,0,0,1|2,0,0]=3 465 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 D70186 [0,0,0,0,0,1|1,0,1]=3 466 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 D70528 [0,0,0,0,0,1|1,0,1]=3 467 B11R1.91 CC(C)NCC1=CC=CC=C1 C11247 [0,0,0,0,0,1|2,0,1]=4 468 B11R1.91 CN(C)CCC1=CC=CC=C1 F12470 [0,0,0,0,0,1|3,0,0]=4 469 B11R1.91 C[C@H](Cl)COC1=CC=CC=C1 D91900 [0,0,0,0,0,1|2,0,1]=4 470 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 28916 [0,0,0,0,0,1|1,0,1]=3 471 B11R1.91 C[C@H](O)COC1=CC=CC=C1 D77637 [0,0,0,0,0,1|1,0,1]=3 472 B11R1.91 N=C(N)CCC1=CC=CC=C1 C15393 [0,0,0,0,0,1|2,0,0]=3 473 B11R1.91 N=C(N)NCC1=CC=CC=C1 D81805 [0,0,0,0,0,1|2,0,0]=3 474 B11R1.91 N=C(N)SCC1=CC=CC=C1 D88650 [0,0,0,0,0,1|2,0,0]=3 475 B11R1.91 NC(=O)C#CC1=CC=CC=C1 83537 [0,0,0,0,0,1|1,0,1]=3 476 B11R1.91 NC(=O)CCC1=CC=CC=C1 S11404 [0,0,0,0,0,1|1,0,0]=2 477 B11R1.91 NC(=O)CNC1=CC=CC=C1 71765 [0,0,0,0,0,1|1,0,0]=2 478 B11R1.91 NC(=O)NCC1=CC=CC=C1 67608 [0,0,0,0,0,1|1,0,0]=2 479 B11R1.91 NC(=O)NNC1=CC=CC=C1 D91929 [0,0,0,0,0,1|2,0,0]=3 480 B11R1.91 NC(=O)OCC1=CC=CC=C1 11833 [0,0,0,0,0,1|1,0,0]=2 481 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 29382 [0,0,0,0,0,1|1,0,1]=3 482 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 AC7815 [0,0,0,0,0,1|1,0,1]=3 483 B11R1.91 NC(=S)NCC1=CC=CC=C1 D85863 [0,0,0,0,0,1|1,1,0]=3 484 B11R1.91 NC(=S)NNC1=CC=CC=C1 W18308 [0,0,0,0,0,1|2,1,0]=4 485 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 78923 [0,0,0,0,0,1|1,0,0]=2 486 B11R1.91 O=C(O)C#CC1=CC=CC=C1 33950 [0,0,0,0,0,1|0,0,1]=2 487 B11R1.91 O=C(O)CCC1=CC=CC=C1 65006 [0,0,0,0,0,1|0,0,0]=1 488 B11R1.91 O=C(O)CCC1=CC=NC=C1 78791 [0,0,0,0,0,1|1,0,0]=2 489 B11R1.91 O=C(O)CCC1=CN=CC=C1 A10240 [0,0,0,0,0,1|1,0,0]=2 490 B11R1.91 O=C(O)CCC1=NC=CC=C1 S11406 [0,0,0,0,0,1|1,0,0]=2 491 B11R1.91 O=C(O)CNC1=CC=CC=C1 29550 [0,0,0,0,0,1|0,0,0]=1 492 B11R1.91 O=C(O)COC1=CC=CC=C1 D70383 [0,0,0,0,0,1|0,0,0]=1 493 B11R1.91 O=C(O)COC1=CN=CC=C1 D82223 [0,0,0,0,0,1|1,0,0]=2 494 B11R1.91 O=C(O)COC1=NC=CC=C1 P18645 [0,0,0,0,0,1|1,0,0]=2 495 B11R1.91 O=C(O)CSC1=CC=CC=C1 D70930 [0,0,0,0,0,1|0,0,0]=1 496 B11R1.91 O=C(O)CSC1=CC=NC=C1 F15983 [0,0,0,0,0,1|1,0,0]=2 497 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 D70605 [0,0,0,0,0,1|0,0,1]=2 498 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 A10227 [0,0,0,0,0,1|1,0,1]=3 499 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 65474 [0,0,0,0,0,1|1,0,1]=3 500 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 28919 [0,0,0,0,0,1|1,0,1]=3 501 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 C90173 [0,0,0,0,0,1|1,0,1]=3 502 B11R1.91 O=C([O-])C=CC1=CC=CC=C1 D82494 [0,0,0,0,0,1|0,0,2]=3 503 B11R1.91 O=C([O-])CNC1=CC=CC=C1 D91919 [0,0,0,0,0,1|0,0,1]=2 504 B11R1.91 O=C([O-])COC1=CC=CC=C1 D70384 [0,0,0,0,0,1|0,0,1]=2 505 B11R1.91 O=C([O-])COC1=CC=CC=C1 D79781 [0,0,0,0,0,1|0,0,1]=2 506 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 77768 [0,0,0,0,0,1|1,0,2]=4 507 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 D72576 [0,0,0,0,0,1|1,0,2]=4 508 B11R1.91 OB(O)CCC1=CC=CC=C1 28933 [0,0,0,0,0,1|1,0,1]=3 509 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 66480 [0,0,0,0,0,1|1,0,2]=4 510 B8R1.2 BrCC1=CC=NC=C1 30281 [2,0,0,0,0,0|2,0,0]=4 511 B8R1.2 BrCC1=CN=CC=C1 30280 [2,0,0,0,0,0|2,0,0]=4 512 B8R1.2 BrCC1=NC=CC=C1 77889 [2,0,0,0,0,0|2,0,0]=4 513 B8R1.2 Br[Se]C1=CC=CC=C1 D92107 [2,0,0,0,0,0|2,0,0]=4 514 B8R1.2 CC[N+]1=CC=CC=C1 C93440 [2,0,0,0,0,0|1,0,1]=4 515 B8R1.2 CC[N+]1=CC=CC=C1 D83482 [2,0,0,0,0,0|1,0,1]=4 516 B8R1.2 CNC1=CC=CC=C1 D91386 [2,0,0,0,0,0|1,0,1]=4 517 B8R1.2 CSC1=CC=CC=C1 D72508 [2,0,0,0,0,0|1,0,1]=4 518 B8R1.2 ClCC1=CC=NC=C1 82047 [2,0,0,0,0,0|2,0,0]=4 519 B8R1.2 ClCC1=CN=CC=C1 83428 [2,0,0,0,0,0|2,0,0]=4 520 B8R1.2 ClCC1=NC=CC=C1 75521 [2,0,0,0,0,0|2,0,0]=4 521 B8R1.2 Cl[Se]C1=CC=CC=C1 D78353 [2,0,0,0,0,0|2,0,0]=4 522 B8R1.2 FCC1=CC=NC=C1 76121 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.2 ICC1=CC=CC=C1 27443 [2,0,0,0,0,0|1,0,0]=3 524 B8R1.2 N#CC1=CC=CC=C1 P19035 [2,0,0,0,0,0|1,0,1]=4 525 B8R1.2 NCC1=CC=CC=C1 D70185 [2,0,0,0,0,0|1,0,0]=3 526 B8R1.2 NCC1=CC=CN=C1 D70555 [2,0,0,0,0,0|2,0,0]=4 527 B8R1.2 NCC1=CC=NC=C1 F11237 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.2 NCC1=NC=CC=C1 F11236 [2,0,0,0,0,0|2,0,0]=4 529 B8R1.2 NNC1=CC=CC=C1 D77767 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.2 NNC1=CC=CC=C1 D91921 [2,0,0,0,0,0|2,0,0]=4 531 B8R1.2 NOC1=CC=CC=C1 74130 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.2 O=CC1=CC=NC=C1 20088 [2,0,0,0,0,0|1,0,0]=3 533 B8R1.2 O=CC1=CN=CC=C1 65498 [2,0,0,0,0,0|1,0,0]=3 534 B8R1.2 O=CC1=CN=CN=C1 67525 [2,0,0,0,0,0|2,0,0]=4 535 B8R1.2 O=CC1=CN=NC=C1 37051 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.2 O=CC1=NC=CC=C1 D77679 [2,0,0,0,0,0|1,0,0]=3 537 B8R1.2 O=CC1=NC=CC=N1 29684 [2,0,0,0,0,0|2,0,0]=4 538 B8R1.2 O=CC1=NC=CN=C1 24785 [2,0,0,0,0,0|2,0,0]=4 539 B8R1.2 O=CC1=NN=CC=C1 37062 [2,0,0,0,0,0|2,0,0]=4 540 B8R1.2 O=NC1=CC=CC=C1 I10262 [2,0,0,0,0,0|1,0,0]=3 541 B8R1.2 O=[As]C1=CC=CC=C1 D91908 [2,0,0,0,0,0|1,0,0]=3 542 B8R1.2 O=[IH2]C1=CC=CC=C1 A11021 [2,0,0,0,0,0|1,0,0]=3 543 B8R1.2 OCC1=CC=CC=C1 D70182 [2,0,0,0,0,0|0,0,0]=2 544 B8R1.2 OCC1=CC=NC=C1 20084 [2,0,0,0,0,0|1,0,0]=3 545 B8R1.2 OCC1=CN=CC=C1 P16746 [2,0,0,0,0,0|1,0,0]=3 546 B8R1.2 OCC1=CN=CN=C1 BL000247 [2,0,0,0,0,0|2,0,0]=4 547 B8R1.2 OCC1=NC=CC=C1 AC7883 [2,0,0,0,0,0|1,0,0]=3 548 B8R1.2 OCC1=NC=CC=N1 27582 [2,0,0,0,0,0|2,0,0]=4 549 B8R1.2 OCC1=NC=CN=C1 BL002777 [2,0,0,0,0,0|2,0,0]=4 550 B8R1.2 OCC1=NC=NC=C1 25637 [2,0,0,0,0,0|2,0,0]=4 551 B8R1.2 OCC1=NN=CC=C1 25292 [2,0,0,0,0,0|2,0,0]=4 552 B8R1.2 ONC1=CC=CC=C1 C10630 [2,0,0,0,0,0|1,0,0]=3 553 B10R1.1 BrC1=CC=C(CCI)C=C1 68585 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.1 BrCCC1=CC=C(Br)C=C1 68581 [1,1,0,0,0,0|1,0,1]=4 555 B10R1.1 CC1=CC=C(CC#N)C=C1 67688 [1,1,0,0,0,0|1,0,1]=4 556 B10R1.1 CC1=CC=C(CC=O)C=C1 W16820 [1,1,0,0,0,0|0,0,0]=2 557 B10R1.1 CC1=CC=C(CCBr)C=C1 64231 [1,1,0,0,0,0|1,0,1]=4 558 B10R1.1 CC1=CC=C(CCN)C=C1 66611 [1,1,0,0,0,0|1,0,1]=4 559 B10R1.1 CC1=CC=C(CCN)C=C1 66612 [1,1,0,0,0,0|1,0,1]=4 560 B10R1.1 CC1=CC=C(CCO)C=C1 CK2469 [1,1,0,0,0,0|0,0,1]=3 561 B10R1.1 CC1=CC=C(N=C=O)C=C1 D92322 [1,1,0,0,0,0|1,0,1]=4 562 B10R1.1 CC1=CC=C(NC=O)C=C1 D85912 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.1 CCCC1=CC=C(Br)C=C1 36843 [1,1,0,0,0,0|1,0,1]=4 564 B10R1.1 CCCC1=CC=C(Cl)C=C1 D89488 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.1 CCCC1=CC=C(N)C=C1 F11809 [1,1,0,0,0,0|1,0,1]=4 566 B10R1.1 CCCC1=CC=C(O)C=C1 F16572 [1,1,0,0,0,0|1,0,1]=4 567 B10R1.1 CNCC1=CC=C(Br)C=C1 30718 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.1 CNCC1=CC=C(Br)C=C1 34885 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.1 CNCC1=CC=C(C)C=C1 31931 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.1 CNCC1=CC=C(C)C=C1 35837 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.1 CNCC1=CC=C(Cl)C=C1 23650 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.1 CNCC1=CC=C(Cl)C=C1 32294 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.1 CNCC1=CC=C(F)C=C1 48475 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.1 CNCC1=CC=C(N)C=C1 28703 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.1 COCC1=CC=C(Br)C=C1 N10190 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.1 COCC1=CC=C(Cl)C=C1 N10137 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.1 COCC1=CC=C(N)C=C1 29846 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.1 ClC1=CC=C(CCBr)C=C1 CL8864 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.1 ClCCC1=CC=C(Cl)C=C1 35628 [1,1,0,0,0,0|1,0,1]=4 580 B10R1.1 FC1=CC=C(CCBr)C=C1 23623 [1,1,0,0,0,0|1,0,1]=4 581 B10R1.1 N#CCC1=CC=C(Br)C=C1 P16510 [1,1,0,0,0,0|1,0,1]=4 582 B10R1.1 N#CCC1=CC=C(Cl)C=C1 D70879 [1,1,0,0,0,0|1,0,1]=4 583 B10R1.1 N#CCC1=CC=C(F)C=C1 S12395 [1,1,0,0,0,0|1,0,1]=4 584 B10R1.1 N#CCC1=CC=C(I)C=C1 CK1021 [1,1,0,0,0,0|1,0,1]=4 585 B10R1.1 N#CCC1=CC=C(N)C=C1 51112 [1,1,0,0,0,0|1,0,1]=4 586 B10R1.1 N#CCC1=CC=C(O)C=C1 74178 [1,1,0,0,0,0|1,0,1]=4 587 B10R1.1 NC1=CC=C(CCBr)C=C1 D92972 [1,1,0,0,0,0|1,0,1]=4 588 B10R1.1 NC1=CC=C(CCO)C=C1 20136 [1,1,0,0,0,0|0,0,1]=3 589 B10R1.1 NCCC1=CC=C(Br)C=C1 56022 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.1 NCCC1=CC=C(Br)C=C1 56042 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.1 NCCC1=CC=C(Cl)C=C1 57784 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.1 NCCC1=CC=C(Cl)C=C1 57785 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.1 NCCC1=CC=C(F)C=C1 61110 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.1 NCCC1=CC=C(F)C=C1 D97693 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.1 NCCC1=CC=C(N)C=C1 51454 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.1 NCCC1=CC=C(N)C=C1 51455 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.1 NCCC1=CC=C(O)C=C1 AC1814 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.1 NCCC1=CC=C(O)C=C1 S12325 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.1 NNCC1=CC=C(Br)C=C1 37004 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.1 NNCC1=CC=C(Cl)C=C1 37007 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.1 NNCC1=CC=C(F)C=C1 25259 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.1 NOCC1=CC=C(F)C=C1 C10796 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 D78335 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.1 O=CCC1=CC=C(Br)C=C1 68586 [1,1,0,0,0,0|0,0,0]=2 605 B10R1.1 O=CCC1=CC=C(F)C=C1 H10605 [1,1,0,0,0,0|0,0,0]=2 606 B10R1.1 O=CNC1=CC=C(Cl)C=C1 57440 [1,1,0,0,0,0|1,0,0]=3 607 B10R1.1 OC1=CC=C(CCBr)C=C1 C10633 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.1 OCCC1=CC=C(Br)C=C1 56096 [1,1,0,0,0,0|0,0,1]=3 609 B10R1.1 OCCC1=CC=C(Cl)C=C1 CK2459 [1,1,0,0,0,0|0,0,1]=3 610 B10R1.1 OCCC1=CC=C(F)C=C1 67685 [1,1,0,0,0,0|0,0,1]=3 611 B10R1.1 OCCC1=CC=C(I)C=C1 23437 [1,1,0,0,0,0|0,0,1]=3 612 B10R1.1 OCCC1=CC=C(O)C=C1 36252 [1,1,0,0,0,0|0,0,1]=3 613 B10R1.1 OCCC1=CN=C(Cl)C=C1 11172 [1,1,0,0,0,0|1,0,1]=4 614 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 W10410 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.1 O\N=C\C1=CC=C(F)C=C1 W11834 [1,1,0,0,0,0|1,0,1]=4 616 B10R1.1 O\N=C\C1=CC=C(O)C=C1 D82235 [1,1,0,0,0,0|1,0,1]=4 617 B10R1.4 BrCCC1=C(Br)C=CC=C1 AB10028 [1,1,0,0,0,0|1,0,1]=4 618 B10R1.4 C=CCC1=C(Br)C=CC=C1 A10076 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.4 C=CCC1=C(O)C=CC=C1 F18833 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.4 CC1=C(CC#N)C=CC=C1 CK2042 [1,1,0,0,0,0|1,0,1]=4 621 B10R1.4 CC1=C(CCBr)C=CC=C1 F19986 [1,1,0,0,0,0|1,0,1]=4 622 B10R1.4 CC1=C(CCO)C=CC=C1 58187 [1,1,0,0,0,0|0,0,1]=3 623 B10R1.4 CC1=C(N=C=O)C=CC=C1 D78369 [1,1,0,0,0,0|1,0,1]=4 624 B10R1.4 CC1=C(NC=O)C=CC=C1 W11048 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.4 CCCC1=C(N)C=CC=C1 65648 [1,1,0,0,0,0|1,0,1]=4 626 B10R1.4 CNCC1=C(Br)C=CC=C1 29110 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.4 CNCC1=C(C)C=CC=C1 I12011 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.4 CNCC1=C(Cl)C=CC=C1 30117 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.4 CNCC1=C(F)C=CC=C1 29111 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.4 CNCC1=C(O)C=CC=C1 D91425 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.4 CSCC1=C(Br)C=CC=C1 W18565 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.4 CSCC1=C(F)C=CC=C1 W18462 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.4 ClC1=C(CCBr)C=CC=C1 CL8847 [1,1,0,0,0,0|1,0,1]=4 634 B10R1.4 FC1=C(CCBr)C=CC=C1 61062 [1,1,0,0,0,0|1,0,1]=4 635 B10R1.4 FC1=C(CCCl)C=CC=C1 AC1210 [1,1,0,0,0,0|1,0,1]=4 636 B10R1.4 N#CCC1=C(Br)C=CC=C1 AB10428 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.4 N#CCC1=C(Cl)C=CC=C1 S12394 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.4 N#CCC1=C(F)C=CC=C1 S12370 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.4 N#CCC1=C(I)C=CC=C1 CK2046 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.4 N#CCC1=C(N)C=CC=C1 CL8752 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.4 NC1=C(CCO)C=CC=C1 28778 [1,1,0,0,0,0|0,0,1]=3 642 B10R1.4 NCCC1=C(Br)C=CC=C1 36255 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.4 NCCC1=C(Cl)C=CC=C1 57778 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.4 NCCC1=C(Cl)C=CC=C1 57779 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.4 NCCC1=C(F)C=CC=C1 28446 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.4 NCCC1=C(N)C=CC=C1 51437 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.4 NNCC1=C(Cl)C=CC=C1 37008 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.4 NNCC1=C(F)C=CC=C1 24533 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.4 NNCC1=C(F)C=CC=C1 37003 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.4 NNCC1=C(F)C=CC=C1 H10997 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.4 NOCC1=C(F)C=CC=C1 F19860 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.4 O=C1C=CC=CN1CCO AT19225 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.4 O=C=NC1=C(Cl)C=CC=C1 C13353 [1,1,0,0,0,0|1,0,1]=4 654 B10R1.4 O=C=NC1=C(F)C=CC=C1 D91128 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.4 OCCC1=C(Br)C=CC=C1 35280 [1,1,0,0,0,0|0,0,1]=3 656 B10R1.4 OCCC1=C(Cl)C=CC=C1 29869 [1,1,0,0,0,0|0,0,1]=3 657 B10R1.4 OCCC1=C(F)C=CC=C1 67766 [1,1,0,0,0,0|0,0,1]=3 658 B10R1.4 OCCC1=C(I)C=CC=C1 I12014 [1,1,0,0,0,0|0,0,1]=3 659 B10R1.4 OCCC1=C(O)C=CC=C1 AB17761 [1,1,0,0,0,0|0,0,1]=3 660 B10R1.4 O\N=C\C1=C(Br)C=CC=C1 71085 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.4 O\N=C\C1=C(F)C=CC=C1 20326 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.4 O\N=C\C1=C(O)C=CC=C1 20497 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.10 BrCCC1=CC=CC(Br)=C1 20780 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.10 CC1=CC=CC(CC#N)=C1 CK2045 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.10 CC1=CC=CC(CCBr)=C1 F20015 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.10 CC1=CC=CC(CCN)=C1 66804 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.10 CC1=CC=CC(CCN)=C1 79173 [1,1,0,0,0,0|1,0,1]=4 668 B10R1.10 CC1=CC=CC(CCO)=C1 CK1130 [1,1,0,0,0,0|0,0,1]=3 669 B10R1.10 CC1=CC=CC(CCO)=N1 H11169 [1,1,0,0,0,0|1,0,1]=4 670 B10R1.10 CC1=CC=CC(CNN)=C1 W16033 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.10 CNCC1=CC(N)=CC=C1 D84175 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.10 CNCC1=CC=CC(Br)=C1 31843 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.10 CNCC1=CC=CC(Br)=C1 55408 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.10 CNCC1=CC=CC(Cl)=C1 F16150 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.10 CNCC1=CC=CC(F)=C1 36788 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.10 CNCC1=CC=CC(F)=C1 FD7354 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.10 CNCC1=CC=CC(O)=C1 30625 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.10 COCC1=CC=CC(Br)=C1 N10086 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.10 ClC1=CC=CC(CCBr)=C1 31191 [1,1,0,0,0,0|1,0,1]=4 680 B10R1.10 FC1=CC=CC(CCBr)=C1 CL8842 [1,1,0,0,0,0|1,0,1]=4 681 B10R1.10 N#CCC1=CC(N)=CC=C1 26201 [1,1,0,0,0,0|1,0,1]=4 682 B10R1.10 N#CCC1=CC=CC(Br)=C1 67771 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.10 N#CCC1=CC=CC(F)=C1 67625 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.10 N#CCC1=CC=CC(I)=C1 CK2047 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.10 N#CCC1=CC=CC(O)=C1 C74311 [1,1,0,0,0,0|1,0,1]=4 686 B10R1.10 NC1=CC=CC(CCO)=C1 AB8062 [1,1,0,0,0,0|0,0,1]=3 687 B10R1.10 NCCC1=CC=CC(Br)=C1 11061 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.10 NCCC1=CC=CC(Br)=C1 56020 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.10 NCCC1=CC=CC(Cl)=C1 57780 [1,1,0,0,0,0|1,0,1]=4 690 B10R1.10 NCCC1=CC=CC(F)=C1 61108 [1,1,0,0,0,0|1,0,1]=4 691 B10R1.10 NCCC1=CC=CC(N)=C1 51930 [1,1,0,0,0,0|1,0,1]=4 692 B10R1.10 NCCC1=CC=CC(O)=C1 51439 [1,1,0,0,0,0|1,0,1]=4 693 B10R1.10 NCCC1=CC=CC(O)=C1 51440 [1,1,0,0,0,0|1,0,1]=4 694 B10R1.10 NNCC1=CC=CC(Cl)=C1 74964 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.10 NNCC1=CC=CC(F)=C1 37002 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.10 NNCC1=CC=CC(O)=C1 62430 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.10 O=C=NC1=CC=CC(Br)=C1 D91180 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.10 OC1=CC=CC(CCBr)=C1 D84479 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.10 OCCC1=CC=CC(Br)=C1 AB3194 [1,1,0,0,0,0|0,0,1]=3 700 B10R1.10 OCCC1=CC=CC(Cl)=C1 35417 [1,1,0,0,0,0|0,0,1]=3 701 B10R1.10 OCCC1=CC=CC(F)=C1 AB7288 [1,1,0,0,0,0|0,0,1]=3 702 B10R1.10 OCCC1=CC=CC(O)=C1 52366 [1,1,0,0,0,0|0,0,1]=3 703 B10R1.10 O\N=C\C1=CC=CC(F)=C1 36961 [1,1,0,0,0,0|1,0,1]=4 704 B10R1.15 BrC[C@H](Br)C1=CC=CC=C1 D89942 [1,1,0,0,0,0|1,0,1]=4 705 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 AC1347 [1,1,0,0,0,0|1,0,1]=4 706 B10R1.15 C=C[S@](=O)C1=CC=CC=C1 D74327 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.15 CC[C@H](N)C1=CC=CC=C1 A11524 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.15 CC[C@H](N)C1=CC=CC=C1 F11436 [1,1,0,0,0,0|1,0,1]=4 709 B10R1.15 CC[C@H](O)C1=CC=CC=C1 S11247 [1,1,0,0,0,0|1,0,1]=4 710 B10R1.15 CN(N=O)C1=CC=CC=C1 F16699 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 30941 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 D82152 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 N12133 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 H11244 [1,1,0,0,0,0|0,0,0]=2 715 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 23817 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 28511 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 65652 [1,1,0,0,0,0|1,0,1]=4 718 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AC1145 [1,1,0,0,0,0|1,0,1]=4 719 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 F13480 [1,1,0,0,0,0|1,0,1]=4 720 B10R1.15 C[C@H](C#N)C1=CC=CC=C1 F13479 [1,1,0,0,0,0|1,0,1]=4 721 B10R1.15 C\C(=N/O)C1=CC=CC=C1 D81769 [1,1,0,0,0,0|1,0,1]=4 722 B10R1.15 N#C[C@@H](Br)C1=CC=CC=C1 26499 [1,1,0,0,0,0|1,0,1]=4 723 B10R1.15 N#C[C@@H](N)C1=CC=CC=C1 N11982 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.15 N#C[C@@H](O)C1=CC=CC=C1 A11559 [1,1,0,0,0,0|1,0,1]=4 725 B10R1.15 NC[C@H](O)C1=CC=CC=C1 52103 [1,1,0,0,0,0|1,0,1]=4 726 B10R1.15 NC[C@H](O)C1=CC=CC=C1 66448 [1,1,0,0,0,0|1,0,1]=4 727 B10R1.15 NC[C@H](O)C1=CC=CC=C1 FD1187 [1,1,0,0,0,0|1,0,1]=4 728 B10R1.15 NC[C@H](O)C1=CC=CC=C1 FD1190 [1,1,0,0,0,0|1,0,1]=4 729 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 29543 [1,1,0,0,0,0|0,0,1]=3 730 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 29545 [1,1,0,0,0,0|0,0,1]=3 731 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 39463 [1,1,0,0,0,0|0,0,1]=3 732 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 O10643 [1,1,0,0,0,0|0,0,1]=3 733 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 S11997 [1,1,0,0,0,0|1,0,1]=4 734 B10R1.15 N\C(=N/O)C1=CC=CC=C1 62454 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.15 O=C(CO)C1=CC=CC=C1 11027 [1,1,0,0,0,0|0,0,2]=4 736 B10R1.15 O=C(NO)C1=CC=CC=C1 D70179 [1,1,0,0,0,0|1,0,1]=4 737 B10R1.15 O=CC(=O)C1=CC=CC=C1 O10845 [1,1,0,0,0,0|0,0,1]=3 738 B10R1.15 OC[C@H](O)C1=CC=CC=C1 FD10472 [1,1,0,0,0,0|0,0,1]=3 739 B10R1.15 OC[C@H](O)C1=CC=CC=C1 FD1181 [1,1,0,0,0,0|0,0,1]=3 740 B10R1.15 OC[C@H](O)C1=CC=CC=C1 FD1184 [1,1,0,0,0,0|0,0,1]=3 741 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 34752 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 D83182 [1,1,0,0,0,0|1,0,1]=4 743 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 D89568 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.15 O\N=C(\Cl)C1=CC=CC=C1 C58137 [1,1,0,0,0,0|1,0,1]=4 745 B10R1.17 BrCCCC1=CC=CC=C1 D78162 [1,1,0,0,0,0|1,0,1]=4 746 B10R1.17 BrCCOC1=CC=CC=C1 73688 [1,1,0,0,0,0|1,0,1]=4 747 B10R1.17 BrCCSC1=CC=CC=C1 D88892 [1,1,0,0,0,0|1,0,1]=4 748 B10R1.17 BrC\C=C\C1=CC=CC=C1 F14018 [1,1,0,0,0,0|1,0,1]=4 749 B10R1.17 C#CCCC1=CC=CC=C1 D74342 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.17 C#CCOC1=CC=CC=C1 F21383 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.17 C=CCNC1=CC=CC=C1 D88344 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.17 C=CCOC1=CC=CC=C1 D77750 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.17 C=CCSC1=CC=CC=C1 S12094 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.17 C=COCC1=CC=CC=C1 P11489 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.17 CCCCC1=CC=CC=C1 H11923 [1,1,0,0,0,0|1,0,1]=4 756 B10R1.17 CCCNC1=CC=CC=C1 D91987 [1,1,0,0,0,0|1,0,1]=4 757 B10R1.17 CCOCC1=CC=CC=C1 F30115 [1,1,0,0,0,0|1,0,1]=4 758 B10R1.17 CNCCC1=CC=CC=C1 AR1058 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.17 COCSC1=CC=CC=C1 D91464 [1,1,0,0,0,0|1,0,1]=4 760 B10R1.17 ClCCCC1=CC=CC=C1 S12344 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.17 ClCCOC1=CC=CC=C1 74955 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.17 ClCCSC1=CC=CC=C1 C10874 [1,1,0,0,0,0|1,0,1]=4 763 B10R1.17 ClCOCC1=CC=CC=C1 76478 [1,1,0,0,0,0|1,0,1]=4 764 B10R1.17 ClCSCC1=CC=CC=C1 D88878 [1,1,0,0,0,0|1,0,1]=4 765 B10R1.17 ClC\C=C\C1=CC=CC=C1 76491 [1,1,0,0,0,0|1,0,1]=4 766 B10R1.17 ClC\C=C\C1=CC=CC=C1 D91905 [1,1,0,0,0,0|1,0,1]=4 767 B10R1.17 N#CCCC1=CC=CC=C1 D91984 [1,1,0,0,0,0|1,0,1]=4 768 B10R1.17 N#CCNC1=CC=CC=C1 H12014 [1,1,0,0,0,0|1,0,1]=4 769 B10R1.17 N#CCOC1=CC=CC=C1 29593 [1,1,0,0,0,0|1,0,1]=4 770 B10R1.17 N#CCSC1=CC=CC=C1 D92138 [1,1,0,0,0,0|1,0,1]=4 771 B10R1.17 N#C\C=C\C1=CC=CC=C1 27206 [1,1,0,0,0,0|1,0,1]=4 772 B10R1.17 NCCCC1=CC=CC=C1 S10208 [1,1,0,0,0,0|1,0,1]=4 773 B10R1.17 NCCNC1=CC=CC=C1 AC8789 [1,1,0,0,0,0|1,0,1]=4 774 B10R1.17 NCCOC1=CC=CC=C1 33388 [1,1,0,0,0,0|1,0,1]=4 775 B10R1.17 NC\C=C\C1=CC=CC=C1 W12746 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.17 O=C=NCC1=CC=CC=C1 D91149 [1,1,0,0,0,0|0,0,1]=3 777 B10R1.17 O=CC#CC1=CC=CC=C1 TD1326 [1,1,0,0,0,0|0,0,1]=3 778 B10R1.17 O=CCCC1=CC=CC=C1 C10629 [1,1,0,0,0,0|0,0,0]=2 779 B10R1.17 O=CNCC1=CC=CC=C1 D72481 [1,1,0,0,0,0|0,0,0]=2 780 B10R1.17 O=COCC1=CC=CC=C1 D70183 [1,1,0,0,0,0|0,0,0]=2 781 B10R1.17 O=C\C=C\C1=CC=CC=C1 D72477 [1,1,0,0,0,0|0,0,1]=3 782 B10R1.17 OCC#CC1=CC=CC=C1 O11048 [1,1,0,0,0,0|0,0,2]=4 783 B10R1.17 OCCCC1=CC=CC=C1 AC1807 [1,1,0,0,0,0|0,0,1]=3 784 B10R1.17 OCCCC1=CC=NC=C1 65430 [1,1,0,0,0,0|1,0,1]=4 785 B10R1.17 OCCCC1=CN=CC=C1 D84150 [1,1,0,0,0,0|1,0,1]=4 786 B10R1.17 OCCCC1=NC=CC=C1 31622 [1,1,0,0,0,0|1,0,1]=4 787 B10R1.17 OCCCC1=NC=CC=C1 38162 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.17 OCCNC1=CC=CC=C1 D70504 [1,1,0,0,0,0|0,0,1]=3 789 B10R1.17 OCCNC1=NC=CC=C1 D82807 [1,1,0,0,0,0|1,0,1]=4 790 B10R1.17 OCCSC1=CC=CC=C1 D83749 [1,1,0,0,0,0|0,0,1]=3 791 B10R1.17 OCCSC1=NC=CC=C1 D83595 [1,1,0,0,0,0|1,0,1]=4 792 B10R1.17 OC\C=C/C1=CC=CC=C1 AC1182 [1,1,0,0,0,0|0,0,1]=3 793 B10R1.17 OC\C=C\C1=CC=CC=C1 D95443 [1,1,0,0,0,0|0,0,1]=3 794 B10R1.17 OC\C=C\C1=CN=CC=C1 31299 [1,1,0,0,0,0|1,0,1]=4 795 B10R1.17 S=C=NCC1=CC=CC=C1 F16583 [1,1,0,0,0,0|0,1,1]=4 796 B10R1.13 C=C(C)C1=CC=C(C)C=C1 F17145 [0,1,0,0,1,0|2,0,0]=4 797 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 D89216 [0,1,0,0,1,0|2,0,0]=4 798 B10R1.13 C=C(C)C1=CC=C(F)C=C1 CK2305 [0,1,0,0,1,0|2,0,0]=4 799 B10R1.13 C=C(C)C1=CC=C(O)C=C1 A11171 [0,1,0,0,1,0|2,0,0]=4 800 B10R1.13 CC(=O)C1=CC=C(C)C=C1 D70502 [0,1,0,0,1,0|1,0,0]=3 801 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 N10056 [0,1,0,0,1,0|1,0,0]=3 802 B10R1.13 CC(=O)C1=CC=C(F)C=C1 D70558 [0,1,0,0,1,0|1,0,0]=3 803 B10R1.13 CC(=O)C1=CC=C(I)C=C1 34152 [0,1,0,0,1,0|1,0,0]=3 804 B10R1.13 CC(=O)C1=CC=C(N)C=C1 D88235 [0,1,0,0,1,0|1,0,0]=3 805 B10R1.13 CC(=O)C1=CC=C(N)C=C1 F11286 [0,1,0,0,1,0|1,0,0]=3 806 B10R1.13 CC(=O)C1=CC=C(O)C=C1 44466 [0,1,0,0,1,0|1,0,0]=3 807 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 34646 [0,1,0,0,1,0|2,0,0]=4 808 B10R1.13 CC(=O)C1=CN=C(C)C=C1 24573 [0,1,0,0,1,0|2,0,0]=4 809 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 57255 [0,1,0,0,1,0|2,0,0]=4 810 B10R1.13 CC(=O)C1=CN=C(F)C=C1 26492 [0,1,0,0,1,0|2,0,0]=4 811 B10R1.13 CC(=O)C1=CN=C(N)C=C1 AB8078 [0,1,0,0,1,0|2,0,0]=4 812 B10R1.13 CC(=O)C1=CN=C(O)C=C1 36014 [0,1,0,0,1,0|2,0,0]=4 813 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 56961 [0,1,0,0,1,0|2,0,0]=4 814 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AB1019 [0,1,0,0,1,0|2,0,0]=4 815 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 80291 [0,1,0,0,1,0|2,0,0]=4 816 B10R1.13 CC(=O)C1=NC=C(F)C=C1 D82396 [0,1,0,0,1,0|2,0,0]=4 817 B10R1.13 CC1=CC=C(B(O)O)C=C1 26016 [0,1,0,0,1,0|1,0,1]=4 818 B10R1.13 CC1=CC=C(C(=N)N)C=C1 F11800 [0,1,0,0,1,0|2,0,0]=4 819 B10R1.13 CC1=CC=C(C(=O)O)C=C1 D70680 [0,1,0,0,1,0|0,0,0]=2 820 B10R1.13 CC1=CC=C(C(N)=O)C=C1 35410 [0,1,0,0,1,0|1,0,0]=3 821 B10R1.13 CC1=CC=C(C(N)=S)C=C1 H10917 [0,1,0,0,1,0|1,1,0]=4 822 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 AC1243 [0,1,0,0,1,0|1,0,1]=4 823 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97007 [0,1,0,0,1,0|2,0,0]=4 824 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 AC8095 [0,1,0,0,1,0|1,0,1]=4 825 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 D80624 [0,1,0,0,1,0|1,0,1]=4 826 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 95016 [0,1,0,0,1,0|2,0,0]=4 827 B10R1.13 CC1=CN=C(C(=O)O)C=C1 23515 [0,1,0,0,1,0|1,0,0]=3 828 B10R1.13 CC1=CN=C(C(=O)O)C=C1 C13862 [0,1,0,0,1,0|1,0,0]=3 829 B10R1.13 CC1=CN=C(C(=O)O)C=N1 89310 [0,1,0,0,1,0|2,0,0]=4 830 B10R1.13 CC1=NC=C(C(=O)O)C=C1 78731 [0,1,0,0,1,0|1,0,0]=3 831 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CL1902 [0,1,0,0,1,0|2,0,0]=4 832 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AB2935 [0,1,0,0,1,0|2,0,0]=4 833 B10R1.13 CC1=NN=C(C(=O)O)C=C1 51799 [0,1,0,0,1,0|2,0,0]=4 834 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 80043 [0,1,0,0,1,0|1,0,1]=4 835 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 80044 [0,1,0,0,1,0|1,0,1]=4 836 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 F16011 [0,1,0,0,1,0|1,0,1]=4 837 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 S10649 [0,1,0,0,1,0|1,0,1]=4 838 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 75094 [0,1,0,0,1,0|1,0,1]=4 839 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 SC1236 [0,1,0,0,1,0|1,0,1]=4 840 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 SC1239 [0,1,0,0,1,0|1,0,1]=4 841 B10R1.13 C[C@H](O)C1=CC=C(N)C=C1 N10377 [0,1,0,0,1,0|1,0,1]=4 842 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 A12944 [0,1,0,0,1,0|2,0,0]=4 843 B10R1.13 C[S@](=O)C1=CC=C(F)C=C1 W16289 [0,1,0,0,1,0|2,0,0]=4 844 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 31132 [0,1,0,0,1,0|2,0,0]=4 845 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 71513 [0,1,0,0,1,0|2,0,0]=4 846 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 24228 [0,1,0,0,1,0|2,0,0]=4 847 B10R1.13 N=C(N)C1=CC=C(F)C=C1 BL000527 [0,1,0,0,1,0|2,0,0]=4 848 B10R1.13 N=C(N)C1=CC=C(F)C=C1 H11398 [0,1,0,0,1,0|2,0,0]=4 849 B10R1.13 N=C(N)C1=CC=C(N)C=C1 51908 [0,1,0,0,1,0|2,0,0]=4 850 B10R1.13 N=C(N)C1=CC=C(O)C=C1 28469 [0,1,0,0,1,0|2,0,0]=4 851 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 F10314 [0,1,0,0,1,0|1,0,0]=3 852 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 78552 [0,1,0,0,1,0|1,0,0]=3 853 B10R1.13 NC(=O)C1=CC=C(F)C=C1 W18647 [0,1,0,0,1,0|1,0,0]=3 854 B10R1.13 NC(=O)C1=CC=C(I)C=C1 D94716 [0,1,0,0,1,0|1,0,0]=3 855 B10R1.13 NC(=O)C1=CC=C(N)C=C1 26019 [0,1,0,0,1,0|1,0,0]=3 856 B10R1.13 NC(=O)C1=CC=C(O)C=C1 D90813 [0,1,0,0,1,0|1,0,0]=3 857 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 O11563 [0,1,0,0,1,0|2,0,0]=4 858 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AB8937 [0,1,0,0,1,0|2,0,0]=4 859 B10R1.13 NC(=O)C1=CN=C(N)C=C1 32965 [0,1,0,0,1,0|2,0,0]=4 860 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 BL003043 [0,1,0,0,1,0|2,0,0]=4 861 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 F51214 [0,1,0,0,1,0|2,0,0]=4 862 B10R1.13 NC(=O)C1=NC=C(F)C=C1 H10045 [0,1,0,0,1,0|2,0,0]=4 863 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P11310 [0,1,0,0,1,0|2,0,0]=4 864 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 57870 [0,1,0,0,1,0|1,1,0]=4 865 B10R1.13 NC(=S)C1=CC=C(F)C=C1 W11783 [0,1,0,0,1,0|1,1,0]=4 866 B10R1.13 NC(=S)C1=CC=C(N)C=C1 A10496 [0,1,0,0,1,0|1,1,0]=4 867 B10R1.13 NC(=S)C1=CC=C(O)C=C1 33351 [0,1,0,0,1,0|1,1,0]=4 868 B10R1.13 NC1=CC=C(B(O)O)C=C1 RB3072 [0,1,0,0,1,0|1,0,1]=4 869 B10R1.13 NC1=CC=C(C(=O)O)C=C1 20052 [0,1,0,0,1,0|0,0,0]=2 870 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 O12079 [0,1,0,0,1,0|0,0,1]=3 871 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 D91641 [0,1,0,0,1,0|1,0,1]=4 872 B10R1.13 NC1=CN=C(C(=O)O)C=C1 20196 [0,1,0,0,1,0|1,0,0]=3 873 B10R1.13 NC1=CN=C(C(=O)O)C=N1 RB3194 [0,1,0,0,1,0|2,0,0]=4 874 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CL1029 [0,1,0,0,1,0|1,0,0]=3 875 B10R1.13 NC1=NC=C(C(=O)O)C=N1 20118 [0,1,0,0,1,0|2,0,0]=4 876 B10R1.13 NC1=NN=C(C(=O)O)C=C1 20191 [0,1,0,0,1,0|2,0,0]=4 877 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 CK1093 [0,1,0,0,1,0|1,0,0]=3 878 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 35169 [0,1,0,0,1,0|1,0,0]=3 879 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 D78310 [0,1,0,0,1,0|2,0,0]=4 880 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 78380 [0,1,0,0,1,0|2,0,0]=4 881 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 AB10302 [0,1,0,0,1,0|0,0,0]=2 882 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 D77513 [0,1,0,0,1,0|0,0,0]=2 883 B10R1.13 O=C(O)C1=CC=C(F)C=C1 D70922 [0,1,0,0,1,0|0,0,0]=2 884 B10R1.13 O=C(O)C1=CC=C(I)C=C1 D70923 [0,1,0,0,1,0|0,0,0]=2 885 B10R1.13 O=C(O)C1=CC=C(O)C=C1 D86505 [0,1,0,0,1,0|0,0,0]=2 886 B10R1.13 O=C(O)C1=CC=C(S)C=C1 22131 [0,1,0,0,1,0|0,0,0]=2 887 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 AC9176 [0,1,0,0,1,0|1,0,0]=3 888 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 56134 [0,1,0,0,1,0|1,0,0]=3 889 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 RB3133 [0,1,0,0,1,0|2,0,0]=4 890 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CX1097 [0,1,0,0,1,0|1,0,0]=3 891 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 RB3034 [0,1,0,0,1,0|2,0,0]=4 892 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 57263 [0,1,0,0,1,0|2,0,0]=4 893 B10R1.13 O=C(O)C1=CN=C(F)C=C1 11221 [0,1,0,0,1,0|1,0,0]=3 894 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CX1100 [0,1,0,0,1,0|1,0,0]=3 895 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 56132 [0,1,0,0,1,0|1,0,0]=3 896 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 23833 [0,1,0,0,1,0|2,0,0]=4 897 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 FD17030 [0,1,0,0,1,0|1,0,0]=3 898 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 27137 [0,1,0,0,1,0|2,0,0]=4 899 B10R1.13 O=C(O)C1=NC=C(F)C=C1 22539 [0,1,0,0,1,0|1,0,0]=3 900 B10R1.13 O=C(O)C1=NC=C(O)C=C1 32448 [0,1,0,0,1,0|1,0,0]=3 901 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CX1286 [0,1,0,0,1,0|1,0,0]=3 902 B10R1.13 O=C(O)C1=NC=C(O)C=C1 W10240 [0,1,0,0,1,0|1,0,0]=3 903 B10R1.13 O=C(O)C1=NC=C(O)N=C1 62307 [0,1,0,0,1,0|2,0,0]=4 904 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 57277 [0,1,0,0,1,0|2,0,0]=4 905 B10R1.13 O=C(O)C1=NN=C(O)C=C1 20193 [0,1,0,0,1,0|2,0,0]=4 906 B10R1.13 O=C(O)C1=NN=C(O)C=C1 23421 [0,1,0,0,1,0|2,0,0]=4 907 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 D83108 [0,1,0,0,1,0|0,0,1]=3 908 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 D71249 [0,1,0,0,1,0|0,0,1]=3 909 B10R1.13 O=C1C=CC(C(=O)O)=CO1 38123 [0,1,0,0,1,0|1,0,0]=3 910 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 28852 [0,1,0,0,1,0|1,0,1]=4 911 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 36929 [0,1,0,0,1,0|1,0,1]=4 912 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 74214 [0,1,0,0,1,0|1,0,1]=4 913 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 H10808 [0,1,0,0,1,0|1,0,1]=4 914 B10R1.13 O=[S@]([O-])C1=CC=C(Br)C=C1 D97339 [0,1,0,0,1,0|1,0,1]=4 915 B10R1.13 O=[S@]([O-])C1=CC=C(Cl)C=C1 H10836 [0,1,0,0,1,0|1,0,1]=4 916 B10R1.13 O=[S@]([O-])C1=CC=C(F)C=C1 H11887 [0,1,0,0,1,0|1,0,1]=4 917 B10R1.13 OB(O)C1=CC=C(Br)C=C1 RB3087 [0,1,0,0,1,0|1,0,1]=4 918 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 57246 [0,1,0,0,1,0|1,0,1]=4 919 B10R1.13 OB(O)C1=CC=C(F)C=C1 58565 [0,1,0,0,1,0|1,0,1]=4 920 B10R1.13 OB(O)C1=CC=C(I)C=C1 33614 [0,1,0,0,1,0|1,0,1]=4 921 B10R1.13 OB(O)C1=CC=C(O)C=C1 25826 [0,1,0,0,1,0|1,0,1]=4 922 B10R1.28 CC(C)(O)C1=CC=CC=C1 P15346 [0,1,0,0,1,0|1,0,1]=4 923 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 76686 [0,1,0,0,1,0|1,0,1]=4 924 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 43856 [0,1,0,0,1,0|1,0,1]=4 925 B10R1.28 O=P(O)(O)C1=CC=CC=C1 A10850 [0,1,0,0,1,0|1,0,0]=3 926 B10R1.28 O=P([O-])([O-])C1=CC=CC=C1 D91923 [0,1,0,0,1,0|1,0,1]=4 927 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 34961 [0,1,0,0,1,0|1,0,0]=3 928 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 D77990 [0,1,0,0,1,0|1,0,0]=3 929 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 D89012 [0,1,0,0,1,0|1,0,0]=3 930 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 76754 [0,1,0,0,1,0|2,0,0]=4 931 B10R1.28 O=S(=O)(O)C1=NC=CC=C1 H10598 [0,1,0,0,1,0|2,0,0]=4 932 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 61382 [0,1,0,0,1,0|1,0,1]=4 933 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 AC2550 [0,1,0,0,1,0|1,0,1]=4 934 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 D88589 [0,1,0,0,1,0|1,0,0]=3 935 B10R1.61 C=C(C)C1=C(N)C=CC=C1 I11393 [0,1,0,0,1,0|2,0,0]=4 936 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 34094 [0,1,0,0,1,0|1,0,0]=3 937 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 37493 [0,1,0,0,1,0|2,0,0]=4 938 B10R1.61 CC(=O)C1=C(C)C=CC=C1 AC7820 [0,1,0,0,1,0|1,0,0]=3 939 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 P20606 [0,1,0,0,1,0|1,0,0]=3 940 B10R1.61 CC(=O)C1=C(F)C=CC=C1 44593 [0,1,0,0,1,0|1,0,0]=3 941 B10R1.61 CC(=O)C1=C(F)C=CC=N1 P10386 [0,1,0,0,1,0|2,0,0]=4 942 B10R1.61 CC(=O)C1=C(F)C=NC=C1 26874 [0,1,0,0,1,0|2,0,0]=4 943 B10R1.61 CC(=O)C1=C(I)C=CC=C1 34151 [0,1,0,0,1,0|1,0,0]=3 944 B10R1.61 CC(=O)C1=C(N)C=CC=C1 36683 [0,1,0,0,1,0|1,0,0]=3 945 B10R1.61 CC(=O)C1=C(N)C=CC=C1 D83209 [0,1,0,0,1,0|1,0,0]=3 946 B10R1.61 CC(=O)C1=C(N)C=NC=C1 50374 [0,1,0,0,1,0|2,0,0]=4 947 B10R1.61 CC(=O)C1=C(N)N=CC=C1 F13139 [0,1,0,0,1,0|2,0,0]=4 948 B10R1.61 CC(=O)C1=C(O)C=CC=C1 D70588 [0,1,0,0,1,0|1,0,0]=3 949 B10R1.61 CC(=O)C1=CC=CN=C1Br 20200 [0,1,0,0,1,0|2,0,0]=4 950 B10R1.61 CC(=O)C1=CC=CN=C1Cl 59616 [0,1,0,0,1,0|2,0,0]=4 951 B10R1.61 CC(=O)C1=NC=CC=C1C 29931 [0,1,0,0,1,0|2,0,0]=4 952 B10R1.61 CC1=C(B(O)O)C=CC=C1 26086 [0,1,0,0,1,0|1,0,1]=4 953 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 40013 [0,1,0,0,1,0|1,0,0]=3 954 B10R1.61 CC1=C(C(=O)O)C=CC=C1 D77873 [0,1,0,0,1,0|0,0,0]=2 955 B10R1.61 CC1=C(C(=O)O)C=CC=N1 63182 [0,1,0,0,1,0|1,0,0]=3 956 B10R1.61 CC1=C(C(=O)O)C=CN=C1 63805 [0,1,0,0,1,0|1,0,0]=3 957 B10R1.61 CC1=C(C(=O)O)C=NC=C1 64774 [0,1,0,0,1,0|1,0,0]=3 958 B10R1.61 CC1=C(C(=O)O)C=NC=N1 29903 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.61 CC1=C(C(N)=O)C=CC=C1 D97423 [0,1,0,0,1,0|1,0,0]=3 960 B10R1.61 CC1=C(C(N)=O)C=CC=N1 83112 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.61 CC1=C(C(N)=S)C=CC=C1 A10488 [0,1,0,0,1,0|1,1,0]=4 962 B10R1.61 CC1=C([C@H](C)O)C=CC=C1 29797 [0,1,0,0,1,0|1,0,1]=4 963 B10R1.61 CC1=CC=CN=C1C(=O)O 23371 [0,1,0,0,1,0|1,0,0]=3 964 B10R1.61 CC1=CC=CN=C1C(=O)O 30047 [0,1,0,0,1,0|1,0,0]=3 965 B10R1.61 CC1=CC=CN=C1C(N)=O 30041 [0,1,0,0,1,0|2,0,0]=4 966 B10R1.61 CC1=NC=CN=C1C(=O)O CL3443 [0,1,0,0,1,0|2,0,0]=4 967 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 28884 [0,1,0,0,1,0|1,0,1]=4 968 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 80042 [0,1,0,0,1,0|1,0,1]=4 969 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 28736 [0,1,0,0,1,0|1,0,1]=4 970 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 30842 [0,1,0,0,1,0|1,0,1]=4 971 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 SC1242 [0,1,0,0,1,0|1,0,1]=4 972 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 SC1254 [0,1,0,0,1,0|1,0,1]=4 973 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 29875 [0,1,0,0,1,0|1,0,1]=4 974 B10R1.61 C[S@](=O)C1=C(Br)C=CC=C1 T71275 [0,1,0,0,1,0|2,0,0]=4 975 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 BL001539 [0,1,0,0,1,0|2,0,0]=4 976 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 24232 [0,1,0,0,1,0|2,0,0]=4 977 B10R1.61 N=C(N)C1=C(F)C=CC=C1 75549 [0,1,0,0,1,0|2,0,0]=4 978 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 F11343 [0,1,0,0,1,0|1,0,0]=3 979 B10R1.61 NC(=O)C1=C(Br)C=CC=N1 D83286 [0,1,0,0,1,0|2,0,0]=4 980 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 25505 [0,1,0,0,1,0|2,0,0]=4 981 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 78527 [0,1,0,0,1,0|1,0,0]=3 982 B10R1.61 NC(=O)C1=C(Cl)C=CC=N1 CL0289 [0,1,0,0,1,0|2,0,0]=4 983 B10R1.61 NC(=O)C1=C(Cl)C=CN=C1 52346 [0,1,0,0,1,0|2,0,0]=4 984 B10R1.61 NC(=O)C1=C(F)C=CC=C1 75548 [0,1,0,0,1,0|1,0,0]=3 985 B10R1.61 NC(=O)C1=C(I)C=CC=C1 TD1375 [0,1,0,0,1,0|1,0,0]=3 986 B10R1.61 NC(=O)C1=C(N)C=CC=C1 D71115 [0,1,0,0,1,0|1,0,0]=3 987 B10R1.61 NC(=O)C1=C(N)C=CN=C1 24282 [0,1,0,0,1,0|2,0,0]=4 988 B10R1.61 NC(=O)C1=C(N)C=CN=C1 38057 [0,1,0,0,1,0|2,0,0]=4 989 B10R1.61 NC(=O)C1=C(N)C=NC=C1 31593 [0,1,0,0,1,0|2,0,0]=4 990 B10R1.61 NC(=O)C1=C(N)C=NC=C1 CL0131 [0,1,0,0,1,0|2,0,0]=4 991 B10R1.61 NC(=O)C1=C(N)N=CC=C1 CL0049 [0,1,0,0,1,0|2,0,0]=4 992 B10R1.61 NC(=O)C1=CC=CN=C1Br 80213 [0,1,0,0,1,0|2,0,0]=4 993 B10R1.61 NC(=O)C1=CC=CN=C1Cl O10758 [0,1,0,0,1,0|2,0,0]=4 994 B10R1.61 NC(=O)C1=NC=CC=C1N 20232 [0,1,0,0,1,0|2,0,0]=4 995 B10R1.61 NC(=S)C1=C(N)C=CC=C1 89863 [0,1,0,0,1,0|1,1,0]=4 996 B10R1.61 NC1=C(B(O)O)C=CC=C1 51892 [0,1,0,0,1,0|1,0,1]=4 997 B10R1.61 NC1=C(B(O)O)C=CC=C1 BL009306 [0,1,0,0,1,0|1,0,1]=4 998 B10R1.61 NC1=C(C(=O)O)C=CC=N1 CX1070 [0,1,0,0,1,0|1,0,0]=3 999 B10R1.61 NC1=C(C(=O)O)C=CN=C1 20104 [0,1,0,0,1,0|1,0,0]=3 1000 B10R1.61 NC1=C(C(=O)O)C=CN=N1 25424 [0,1,0,0,1,0|2,0,0]=4 1001 B10R1.61 NC1=C(C(=O)O)C=NC=C1 CL0180 [0,1,0,0,1,0|1,0,0]=3 1002 B10R1.61 NC1=C(C(=O)O)C=NC=N1 F13676 [0,1,0,0,1,0|2,0,0]=4 1003 B10R1.61 NC1=C([N+](=O)[O-])C=CC=C1 D97708 [0,1,0,0,1,0|1,0,1]=4 1004 B10R1.61 NC1=CC=CN=C1C(=O)O CL0127 [0,1,0,0,1,0|1,0,0]=3 1005 B10R1.61 NC1=NC=CN=C1C(=O)O 20504 [0,1,0,0,1,0|2,0,0]=4 1006 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 D70825 [0,1,0,0,1,0|1,0,0]=3 1007 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 F11409 [0,1,0,0,1,0|1,0,0]=3 1008 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl F10901 [0,1,0,0,1,0|2,0,0]=4 1009 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 AB10300 [0,1,0,0,1,0|0,0,0]=2 1010 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 54639 [0,1,0,0,1,0|1,0,0]=3 1011 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 21001 [0,1,0,0,1,0|1,0,0]=3 1012 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 22146 [0,1,0,0,1,0|1,0,0]=3 1013 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 D77315 [0,1,0,0,1,0|0,0,0]=2 1014 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 CL0142 [0,1,0,0,1,0|1,0,0]=3 1015 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 57485 [0,1,0,0,1,0|1,0,0]=3 1016 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 CL0148 [0,1,0,0,1,0|1,0,0]=3 1017 B10R1.61 O=C(O)C1=C(F)C=CC=C1 D70123 [0,1,0,0,1,0|0,0,0]=2 1018 B10R1.61 O=C(O)C1=C(F)C=CC=N1 22521 [0,1,0,0,1,0|1,0,0]=3 1019 B10R1.61 O=C(O)C1=C(F)C=NC=C1 61242 [0,1,0,0,1,0|1,0,0]=3 1020 B10R1.61 O=C(O)C1=C(I)C=CC=C1 36681 [0,1,0,0,1,0|0,0,0]=2 1021 B10R1.61 O=C(O)C1=C(I)C=CC=N1 25750 [0,1,0,0,1,0|1,0,0]=3 1022 B10R1.61 O=C(O)C1=C(I)C=NC=C1 62710 [0,1,0,0,1,0|1,0,0]=3 1023 B10R1.61 O=C(O)C1=C(O)C=CC=C1 AC1613 [0,1,0,0,1,0|0,0,0]=2 1024 B10R1.61 O=C(O)C1=C(O)C=CC=C1 D70842 [0,1,0,0,1,0|0,0,0]=2 1025 B10R1.61 O=C(O)C1=C(O)C=CC=C1 D81871 [0,1,0,0,1,0|0,0,0]=2 1026 B10R1.61 O=C(O)C1=C(O)C=CN=C1 BL001825 [0,1,0,0,1,0|1,0,0]=3 1027 B10R1.61 O=C(O)C1=C(O)C=NC=C1 CL0149 [0,1,0,0,1,0|1,0,0]=3 1028 B10R1.61 O=C(O)C1=C(O)N=CN=C1 25207 [0,1,0,0,1,0|2,0,0]=4 1029 B10R1.61 O=C(O)C1=C(S)C=CC=C1 AT20777 [0,1,0,0,1,0|0,0,0]=2 1030 B10R1.61 O=C(O)C1=CC=CN=C1Br 54586 [0,1,0,0,1,0|1,0,0]=3 1031 B10R1.61 O=C(O)C1=CC=CN=C1Cl P16536 [0,1,0,0,1,0|1,0,0]=3 1032 B10R1.61 O=C(O)C1=CC=CN=C1F 22142 [0,1,0,0,1,0|1,0,0]=3 1033 B10R1.61 O=C(O)C1=CC=CNC1=O AB7337 [0,1,0,0,1,0|1,0,0]=3 1034 B10R1.61 O=C(O)C1=CC=CNC1=S 78639 [0,1,0,0,1,0|1,0,0]=3 1035 B10R1.61 O=C(O)C1=CC=NNC1=O 27541 [0,1,0,0,1,0|2,0,0]=4 1036 B10R1.61 O=C(O)C1=CN=CNC1=O FD7408 [0,1,0,0,1,0|2,0,0]=4 1037 B10R1.61 O=C(O)C1=NC=CC=C1O 33773 [0,1,0,0,1,0|1,0,0]=3 1038 B10R1.61 O=C(O)C1=NC=CN=C1Cl 58252 [0,1,0,0,1,0|2,0,0]=4 1039 B10R1.61 O=C(O)C1=NC=CN=C1O AB2876 [0,1,0,0,1,0|2,0,0]=4 1040 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 CK1072 [0,1,0,0,1,0|0,0,1]=3 1041 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 A11496 [0,1,0,0,1,0|0,0,1]=3 1042 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 D83111 [0,1,0,0,1,0|0,0,1]=3 1043 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 D95369 [0,1,0,0,1,0|0,0,1]=3 1044 B10R1.61 O=C([O-])C1=C(S)C=CC=C1 D92321 [0,1,0,0,1,0|0,0,1]=3 1045 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 SC5002 [0,1,0,0,1,0|1,0,1]=4 1046 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 D87558 [0,1,0,0,1,0|1,0,1]=4 1047 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 36930 [0,1,0,0,1,0|1,0,1]=4 1048 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 67616 [0,1,0,0,1,0|1,0,1]=4 1049 B10R1.61 O=[N+]([O-])C1=C([O-])C=CC=C1 D84131 [0,1,0,0,1,0|1,0,1]=4 1050 B10R1.61 OB(O)C1=C(Br)C=CC=C1 RB2088 [0,1,0,0,1,0|1,0,1]=4 1051 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 57245 [0,1,0,0,1,0|1,0,1]=4 1052 B10R1.61 OB(O)C1=C(F)C=CC=C1 32981 [0,1,0,0,1,0|1,0,1]=4 1053 B10R1.61 OB(O)C1=C(I)C=CC=C1 I12680 [0,1,0,0,1,0|1,0,1]=4 1054 B10R1.61 OB(O)C1=C(O)C=CC=C1 62896 [0,1,0,0,1,0|1,0,1]=4 1055 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 71412 [0,1,0,0,1,0|2,0,0]=4 1056 B10R1.113 CC(=O)C1=CC(C)=CC=C1 28342 [0,1,0,0,1,0|1,0,0]=3 1057 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 80227 [0,1,0,0,1,0|2,0,0]=4 1058 B10R1.113 CC(=O)C1=CC(N)=CC=C1 D70852 [0,1,0,0,1,0|1,0,0]=3 1059 B10R1.113 CC(=O)C1=CC(O)=CC=C1 44505 [0,1,0,0,1,0|1,0,0]=3 1060 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 D70815 [0,1,0,0,1,0|1,0,0]=3 1061 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 34635 [0,1,0,0,1,0|2,0,0]=4 1062 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 AB8941 [0,1,0,0,1,0|2,0,0]=4 1063 B10R1.113 CC(=O)C1=CC=CC(F)=C1 34142 [0,1,0,0,1,0|1,0,0]=3 1064 B10R1.113 CC(=O)C1=CC=CC(I)=C1 CK2572 [0,1,0,0,1,0|1,0,0]=3 1065 B10R1.113 CC(=O)C1=CN=CC(C)=C1 I11175 [0,1,0,0,1,0|2,0,0]=4 1066 B10R1.113 CC(=O)C1=NC(C)=CC=C1 34681 [0,1,0,0,1,0|2,0,0]=4 1067 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AB1018 [0,1,0,0,1,0|2,0,0]=4 1068 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 72047 [0,1,0,0,1,0|2,0,0]=4 1069 B10R1.113 CC1=CC(C(=O)O)=CN=C1 63156 [0,1,0,0,1,0|1,0,0]=3 1070 B10R1.113 CC1=CC(C(=O)O)=NC=C1 59430 [0,1,0,0,1,0|1,0,0]=3 1071 B10R1.113 CC1=CC(C(=O)O)=NC=N1 P10833 [0,1,0,0,1,0|2,0,0]=4 1072 B10R1.113 CC1=CC(C(N)=O)=CN=C1 AB11819 [0,1,0,0,1,0|2,0,0]=4 1073 B10R1.113 CC1=CC=CC(B(O)O)=C1 26035 [0,1,0,0,1,0|1,0,1]=4 1074 B10R1.113 CC1=CC=CC(C(=N)N)=C1 F11748 [0,1,0,0,1,0|2,0,0]=4 1075 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 D78225 [0,1,0,0,1,0|1,0,0]=3 1076 B10R1.113 CC1=CC=CC(C(=O)O)=C1 D70873 [0,1,0,0,1,0|0,0,0]=2 1077 B10R1.113 CC1=CC=CC(C(=O)O)=N1 CL0233 [0,1,0,0,1,0|1,0,0]=3 1078 B10R1.113 CC1=CC=CC(C(N)=S)=C1 A10481 [0,1,0,0,1,0|1,1,0]=4 1079 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 73947 [0,1,0,0,1,0|1,0,1]=4 1080 B10R1.113 CC1=CC=CC([N+](=O)[O-])=C1 F21441 [0,1,0,0,1,0|1,0,1]=4 1081 B10R1.113 CC1=CN=CC(C(=O)O)=N1 25557 [0,1,0,0,1,0|2,0,0]=4 1082 B10R1.113 CC1=NC=CC(C(=O)O)=C1 63948 [0,1,0,0,1,0|1,0,0]=3 1083 B10R1.113 CC1=NC=CC(C(=O)O)=N1 24979 [0,1,0,0,1,0|2,0,0]=4 1084 B10R1.113 C[C@H](O)C1=CC(N)=CC=C1 O10269 [0,1,0,0,1,0|1,0,1]=4 1085 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 55215 [0,1,0,0,1,0|1,0,1]=4 1086 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 SC1263 [0,1,0,0,1,0|1,0,1]=4 1087 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 28734 [0,1,0,0,1,0|1,0,1]=4 1088 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 35632 [0,1,0,0,1,0|1,0,1]=4 1089 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 29944 [0,1,0,0,1,0|1,0,1]=4 1090 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 42967 [0,1,0,0,1,0|1,0,0]=3 1091 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 D80780 [0,1,0,0,1,0|2,0,0]=4 1092 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 D91325 [0,1,0,0,1,0|2,0,0]=4 1093 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 33337 [0,1,0,0,1,0|2,0,0]=4 1094 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 FD10462 [0,1,0,0,1,0|2,0,0]=4 1095 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 F11734 [0,1,0,0,1,0|2,0,0]=4 1096 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F11741 [0,1,0,0,1,0|2,0,0]=4 1097 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 20585 [0,1,0,0,1,0|2,0,0]=4 1098 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 F19938 [0,1,0,0,1,0|2,0,0]=4 1099 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 78772 [0,1,0,0,1,0|2,0,0]=4 1100 B10R1.113 NC(=O)C1=CC(F)=CN=C1 29187 [0,1,0,0,1,0|2,0,0]=4 1101 B10R1.113 NC(=O)C1=CC(N)=CC=C1 35377 [0,1,0,0,1,0|1,0,0]=3 1102 B10R1.113 NC(=O)C1=CC(N)=NC=C1 29050 [0,1,0,0,1,0|2,0,0]=4 1103 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 26029 [0,1,0,0,1,0|1,0,0]=3 1104 B10R1.113 NC(=O)C1=CC=CC(Br)=N1 56614 [0,1,0,0,1,0|2,0,0]=4 1105 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 D70126 [0,1,0,0,1,0|1,0,0]=3 1106 B10R1.113 NC(=O)C1=CC=CC(F)=C1 D71217 [0,1,0,0,1,0|1,0,0]=3 1107 B10R1.113 NC(=O)C1=CC=CC(F)=N1 88350 [0,1,0,0,1,0|2,0,0]=4 1108 B10R1.113 NC(=O)C1=CC=CC(I)=C1 T71545 [0,1,0,0,1,0|1,0,0]=3 1109 B10R1.113 NC(=O)C1=CN=CC(N)=C1 25964 [0,1,0,0,1,0|2,0,0]=4 1110 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 78309 [0,1,0,0,1,0|2,0,0]=4 1111 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 39241 [0,1,0,0,1,0|2,0,0]=4 1112 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 CL0190 [0,1,0,0,1,0|2,0,0]=4 1113 B10R1.113 NC(=O)C1=NC=CC(F)=C1 30416 [0,1,0,0,1,0|2,0,0]=4 1114 B10R1.113 NC(=S)C1=CC(N)=CC=C1 A10495 [0,1,0,0,1,0|1,1,0]=4 1115 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 29037 [0,1,0,0,1,0|1,1,0]=4 1116 B10R1.113 NC1=CC(C(=O)O)=CN=C1 23148 [0,1,0,0,1,0|1,0,0]=3 1117 B10R1.113 NC1=CC(C(=O)O)=NC=C1 31876 [0,1,0,0,1,0|1,0,0]=3 1118 B10R1.113 NC1=CC(C(=O)O)=NC=C1 36296 [0,1,0,0,1,0|1,0,0]=3 1119 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CL0353 [0,1,0,0,1,0|1,0,0]=3 1120 B10R1.113 NC1=CC(C(=O)O)=NC=N1 D84123 [0,1,0,0,1,0|2,0,0]=4 1121 B10R1.113 NC1=CC=CC(B(O)O)=C1 26106 [0,1,0,0,1,0|1,0,1]=4 1122 B10R1.113 NC1=CC=CC(B(O)O)=C1 33227 [0,1,0,0,1,0|1,0,1]=4 1123 B10R1.113 NC1=CC=CC(B(O)O)=C1 78640 [0,1,0,0,1,0|1,0,1]=4 1124 B10R1.113 NC1=CC=CC(B(O)O)=C1 O10073 [0,1,0,0,1,0|1,0,1]=4 1125 B10R1.113 NC1=CC=CC(C(=O)O)=C1 D70484 [0,1,0,0,1,0|0,0,0]=2 1126 B10R1.113 NC1=CC=CC(C(=O)O)=N1 CL0230 [0,1,0,0,1,0|1,0,0]=3 1127 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 D70823 [0,1,0,0,1,0|1,0,1]=4 1128 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 D97675 [0,1,0,0,1,0|1,0,1]=4 1129 B10R1.113 NC1=NC=CC(C(=O)O)=C1 20144 [0,1,0,0,1,0|1,0,0]=3 1130 B10R1.113 NC1=NC=CC(C(=O)O)=N1 BL000508 [0,1,0,0,1,0|2,0,0]=4 1131 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 A10427 [0,1,0,0,1,0|2,0,0]=4 1132 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 75835 [0,1,0,0,1,0|1,0,0]=3 1133 B10R1.113 O=C(Cl)C1=CC=CC(Br)=C1 67715 [0,1,0,0,1,0|1,0,0]=3 1134 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 D77316 [0,1,0,0,1,0|1,0,0]=3 1135 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 AB6459 [0,1,0,0,1,0|1,0,0]=3 1136 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 52660 [0,1,0,0,1,0|1,0,0]=3 1137 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 33164 [0,1,0,0,1,0|1,0,0]=3 1138 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 P16537 [0,1,0,0,1,0|1,0,0]=3 1139 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 P10631 [0,1,0,0,1,0|2,0,0]=4 1140 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 38772 [0,1,0,0,1,0|2,0,0]=4 1141 B10R1.113 O=C(O)C1=CC(F)=CN=C1 82240 [0,1,0,0,1,0|1,0,0]=3 1142 B10R1.113 O=C(O)C1=CC(F)=NC=C1 22391 [0,1,0,0,1,0|1,0,0]=3 1143 B10R1.113 O=C(O)C1=CC(I)=CN=C1 26596 [0,1,0,0,1,0|1,0,0]=3 1144 B10R1.113 O=C(O)C1=CC(I)=NC=C1 A10522 [0,1,0,0,1,0|1,0,0]=3 1145 B10R1.113 O=C(O)C1=CC(O)=NC=C1 62227 [0,1,0,0,1,0|1,0,0]=3 1146 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 22039 [0,1,0,0,1,0|0,0,0]=2 1147 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 56092 [0,1,0,0,1,0|1,0,0]=3 1148 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 AC7860 [0,1,0,0,1,0|0,0,0]=2 1149 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 58082 [0,1,0,0,1,0|1,0,0]=3 1150 B10R1.113 O=C(O)C1=CC=CC(F)=C1 AC7508 [0,1,0,0,1,0|0,0,0]=2 1151 B10R1.113 O=C(O)C1=CC=CC(F)=N1 88349 [0,1,0,0,1,0|1,0,0]=3 1152 B10R1.113 O=C(O)C1=CC=CC(I)=C1 36348 [0,1,0,0,1,0|0,0,0]=2 1153 B10R1.113 O=C(O)C1=CC=CC(S)=C1 C10086 [0,1,0,0,1,0|0,0,0]=2 1154 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 24532 [0,1,0,0,1,0|2,0,0]=4 1155 B10R1.113 O=C(O)C1=CN=CC(Br)=N1 Y10050 [0,1,0,0,1,0|2,0,0]=4 1156 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 RB3064 [0,1,0,0,1,0|2,0,0]=4 1157 B10R1.113 O=C(O)C1=CN=CC(O)=C1 69574 [0,1,0,0,1,0|1,0,0]=3 1158 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=C1 AC8656 [0,1,0,0,1,0|1,0,0]=3 1159 B10R1.113 O=C(O)C1=NC(O)=CC=C1 22204 [0,1,0,0,1,0|1,0,0]=3 1160 B10R1.113 O=C(O)C1=NC(O)=NC=C1 24239 [0,1,0,0,1,0|2,0,0]=4 1161 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 54504 [0,1,0,0,1,0|1,0,0]=3 1162 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 57846 [0,1,0,0,1,0|1,0,0]=3 1163 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CL0291 [0,1,0,0,1,0|1,0,0]=3 1164 B10R1.113 O=C(O)C1=NC=CC(O)=C1 52376 [0,1,0,0,1,0|1,0,0]=3 1165 B10R1.113 O=C(O)C1=NC=NC(O)=C1 63339 [0,1,0,0,1,0|2,0,0]=4 1166 B10R1.113 O=C1C=C(C(=O)O)C=NN1 25957 [0,1,0,0,1,0|2,0,0]=4 1167 B10R1.113 O=C1C=COC(C(=O)O)=C1 78186 [0,1,0,0,1,0|1,0,0]=3 1168 B10R1.113 O=C1C=NC=C(C(=O)O)N1 O11623 [0,1,0,0,1,0|2,0,0]=4 1169 B10R1.113 O=C1CC(C(=O)O)=CC=N1 D72730 [0,1,0,0,1,0|1,0,1]=4 1170 B10R1.113 O=C1N=CC=C(C(=O)O)N1 26790 [0,1,0,0,1,0|2,0,0]=4 1171 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 75889 [0,1,0,0,1,0|1,0,1]=4 1172 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 36936 [0,1,0,0,1,0|1,0,1]=4 1173 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 75857 [0,1,0,0,1,0|1,0,1]=4 1174 B10R1.113 OB(O)C1=CC=CC(Br)=C1 RB2089 [0,1,0,0,1,0|1,0,1]=4 1175 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 57247 [0,1,0,0,1,0|1,0,1]=4 1176 B10R1.113 OB(O)C1=CC=CC(F)=C1 58568 [0,1,0,0,1,0|1,0,1]=4 1177 B10R1.113 OB(O)C1=CC=CC(I)=C1 23739 [0,1,0,0,1,0|1,0,1]=4 1178 B10R1.113 OB(O)C1=CC=CC(O)=C1 62341 [0,1,0,0,1,0|1,0,1]=4 1179 B10R1.113 OB(O)C1=CC=CC(S)=C1 RB2030 [0,1,0,0,1,0|1,0,1]=4 1180 B10R1.23 C[C@@H](C(=O)O)N1C=CC=C1 D83451 [0,1,0,0,1,0|1,0,0]=3 1181 B10R1.23 C[C@@H](C(=O)O)N1C=CN=C1 AC1139 [0,1,0,0,1,0|2,0,0]=4 1182 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 A50311 [0,1,0,0,1,0|1,0,0]=3 1183 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 D83264 [0,1,0,0,1,0|1,0,0]=3 1184 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 50011 [0,1,0,0,1,0|1,0,0]=3 1185 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 77782 [0,1,0,0,1,0|1,0,0]=3 1186 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 77812 [0,1,0,0,1,0|1,0,0]=3 1187 B10R1.23 O=C(O)C(=O)C1=CC=CS1 C80077 [0,1,0,0,1,0|1,0,1]=4 1188 B10R1.27 COC(=O)CC1=CC=CS1 D70882 [0,1,0,0,1,0|1,0,0]=3 1189 B10R1.27 COC(=O)CC1=CSC=C1 P10051 [0,1,0,0,1,0|1,0,0]=3 1190 B10R1.27 COC(=O)CN1C=CN=C1 64794 [0,1,0,0,1,0|2,0,0]=4 1191 B10R1.54 CC1=NC(CC(=O)O)=CS1 71392 [0,1,0,0,1,0|2,0,0]=4 1192 B10R1.54 CC1=NOC(CC(=O)O)=C1 73992 [0,1,0,0,1,0|2,0,0]=4 1193 B10R1.54 C[N+]1=CN(CC(=O)O)C=C1 D80537 [0,1,0,0,1,0|2,0,0]=4 1194 B10R1.54 NC1=NC(CC(=O)O)=CS1 C10840 [0,1,0,0,1,0|2,0,0]=4 1195 B10R1.54 NC1=NC(CC(=O)O)=CS1 D72492 [0,1,0,0,1,0|2,0,0]=4 1196 B10R1.54 O=C(O)CC1=CC(Br)=CS1 D97326 [0,1,0,0,1,0|1,0,0]=3 1197 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 71335 [0,1,0,0,1,0|1,0,0]=3 1198 B10R1.54 O=C(O)CN1C=C(Br)C=N1 F14589 [0,1,0,0,1,0|2,0,0]=4 1199 B10R1.64 CC1=NC=CN1CC(=O)O S10621 [0,1,0,0,1,0|2,0,0]=4 1200 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 32309 [0,1,0,0,0,1|1,0,0]=3 1201 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 D70581 [0,1,0,0,0,1|1,0,0]=3 1202 B12R1.21 CC(=O)CSC1=CC=C(F)C=C1 73930 [0,1,0,0,0,1|1,0,0]=3 1203 B12R1.21 CC(=O)NCC1=CC=C(Br)C=C1 C78568 [0,1,0,0,0,1|1,0,0]=3 1204 B12R1.21 CC(=O)NNC1=CC=C(Br)C=C1 D83902 [0,1,0,0,0,1|2,0,0]=4 1205 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 D97438 [0,1,0,0,0,1|1,0,0]=3 1206 B12R1.21 CC(=O)OCC1=CC=C(Cl)C=C1 C10410 [0,1,0,0,0,1|1,0,0]=3 1207 B12R1.21 CC(=O)\C=C\C1=CC=C(O)C=C1 C11421 [0,1,0,0,0,1|1,0,1]=4 1208 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 76168 [0,1,0,0,0,1|0,0,0]=2 1209 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 A50584 [0,1,0,0,0,1|0,0,0]=2 1210 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 71044 [0,1,0,0,0,1|0,0,0]=2 1211 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 AC7520 [0,1,0,0,0,1|0,0,1]=3 1212 B12R1.21 C[C@H](O)CCC1=CC=C(O)C=C1 T72839 [0,1,0,0,0,1|1,0,1]=4 1213 B12R1.21 N=C(N)SCC1=CC=C(Cl)C=C1 AR2243 [0,1,0,0,0,1|2,0,0]=4 1214 B12R1.21 NC(=O)C#CC1=CC=C(Cl)C=C1 83540 [0,1,0,0,0,1|1,0,1]=4 1215 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 35369 [0,1,0,0,0,1|0,0,0]=2 1216 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 68781 [0,1,0,0,0,1|0,0,0]=2 1217 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 CK2534 [0,1,0,0,0,1|0,0,1]=3 1218 B12R1.21 NC1=NC=C(\C=C\C(=O)O)C=C1 29303 [0,1,0,0,0,1|1,0,1]=4 1219 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 AB3203 [0,1,0,0,0,1|0,0,0]=2 1220 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 33552 [0,1,0,0,0,1|0,0,0]=2 1221 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 AB7295 [0,1,0,0,0,1|0,0,0]=2 1222 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 35011 [0,1,0,0,0,1|0,0,0]=2 1223 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 AT13193 [0,1,0,0,0,1|0,0,0]=2 1224 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 CS1182 [0,1,0,0,0,1|0,0,0]=2 1225 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 A50579 [0,1,0,0,0,1|0,0,0]=2 1226 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 A50588 [0,1,0,0,0,1|0,0,0]=2 1227 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 A50587 [0,1,0,0,0,1|0,0,0]=2 1228 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 78056 [0,1,0,0,0,1|0,0,0]=2 1229 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 AT23403 [0,1,0,0,0,1|0,0,0]=2 1230 B12R1.21 O=C(O)CSC1=CC=C(Cl)C=C1 W11890 [0,1,0,0,0,1|0,0,0]=2 1231 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 75256 [0,1,0,0,0,1|0,0,0]=2 1232 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 AB6442 [0,1,0,0,0,1|0,0,1]=3 1233 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 S12285 [0,1,0,0,0,1|0,0,1]=3 1234 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 78053 [0,1,0,0,0,1|0,0,1]=3 1235 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 AC7879 [0,1,0,0,0,1|0,0,1]=3 1236 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 AC7957 [0,1,0,0,0,1|0,0,1]=3 1237 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 CK2547 [0,1,0,0,0,1|0,0,1]=3 1238 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 87488 [0,1,0,0,0,1|1,0,0]=3 1239 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 AB6137 [0,1,0,0,0,1|1,0,0]=3 1240 B12R1.27 COC(=O)C#CC1=CC=CC=C1 D70333 [0,1,0,0,0,1|0,0,1]=3 1241 B12R1.27 COC(=O)CCC1=CC=CC=C1 AC8659 [0,1,0,0,0,1|0,0,0]=2 1242 B12R1.27 COC(=O)CCC1=CN=CC=C1 D94758 [0,1,0,0,0,1|1,0,0]=3 1243 B12R1.27 COC(=O)COC1=CC=CC=C1 D70332 [0,1,0,0,0,1|0,0,0]=2 1244 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 P16737 [0,1,0,0,0,1|0,0,1]=3 1245 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 AT14565 [0,1,0,0,0,1|1,0,1]=4 1246 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 79303 [0,1,0,0,0,1|1,0,1]=4 1247 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 W12270 [0,1,0,0,0,1|1,0,1]=4 1248 B12R1.27 NCC(=O)NCC1=CC=CC=C1 D97353 [0,1,0,0,0,1|1,0,0]=3 1249 B12R1.27 NCC(=O)NCC1=CC=CC=C1 F21128 [0,1,0,0,0,1|1,0,0]=3 1250 B12R1.27 NCC(=O)OCC1=CC=CC=C1 20050 [0,1,0,0,0,1|1,0,0]=3 1251 B12R1.27 NCC(=O)OCC1=CC=CC=C1 FD21614 [0,1,0,0,0,1|1,0,0]=3 1252 B12R1.27 NCC(=O)OCC1=CC=CC=C1 FD21621 [0,1,0,0,0,1|1,0,0]=3 1253 B12R1.27 NNC(=O)CCC1=CC=CC=C1 W15768 [0,1,0,0,0,1|1,0,0]=3 1254 B12R1.27 NNC(=O)COC1=CC=CC=C1 D84136 [0,1,0,0,0,1|1,0,0]=3 1255 B12R1.27 NNC(=O)OCC1=CC=CC=C1 C93486 [0,1,0,0,0,1|1,0,0]=3 1256 B12R1.27 NNC(=S)NCC1=CC=CC=C1 32936 [0,1,0,0,0,1|1,1,0]=4 1257 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 P19617 [0,1,0,0,0,1|1,0,0]=3 1258 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 S11886 [0,1,0,0,0,1|1,0,0]=3 1259 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 76813 [0,1,0,0,0,1|1,0,0]=3 1260 B12R1.27 O=C(CO)OCC1=CC=CC=C1 AB8174 [0,1,0,0,0,1|0,0,0]=2 1261 B12R1.27 O=C(CS)OCC1=CC=CC=C1 D96019 [0,1,0,0,0,1|0,1,0]=3 1262 B12R1.27 O=C(NO)OCC1=CC=CC=C1 70490 [0,1,0,0,0,1|0,0,0]=2 1263 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 D92114 [0,1,0,0,0,1|0,0,2]=4 1264 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O F13740 [0,1,0,0,0,1|0,0,0]=2 1265 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O 65146 [0,1,0,0,0,1|0,0,0]=2 1266 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O AR3815 [0,1,0,0,0,1|0,0,0]=2 1267 B12R1.43 C[C@H](OC1=CC=CC=C1)C(N)=O AR2180 [0,1,0,0,0,1|1,0,0]=3 1268 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 39405 [0,1,0,0,0,1|1,0,0]=3 1269 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F10543 [0,1,0,0,0,1|1,0,0]=3 1270 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F10920 [0,1,0,0,0,1|1,0,0]=3 1271 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F10983 [0,1,0,0,0,1|1,0,0]=3 1272 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F11007 [0,1,0,0,0,1|1,0,0]=3 1273 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 28345 [0,1,0,0,0,1|0,0,0]=2 1274 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O AC8117 [0,1,0,0,0,1|0,0,0]=2 1275 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O C10470 [0,1,0,0,0,1|0,0,0]=2 1276 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O D77851 [0,1,0,0,0,1|0,0,0]=2 1277 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O 50941 [0,1,0,0,0,1|1,0,0]=3 1278 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O C10909 [0,1,0,0,0,1|1,0,0]=3 1279 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O O10212 [0,1,0,0,0,1|1,0,0]=3 1280 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O W16799 [0,1,0,0,0,1|1,0,0]=3 1281 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O 24145 [0,1,0,0,0,1|1,0,0]=3 1282 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O 34743 [0,1,0,0,0,1|1,0,0]=3 1283 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O C74797 [0,1,0,0,0,1|1,0,0]=3 1284 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O H10629 [0,1,0,0,0,1|1,0,0]=3 1285 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O A50237 [0,1,0,0,0,1|1,0,0]=3 1286 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O A50238 [0,1,0,0,0,1|1,0,0]=3 1287 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O A50249 [0,1,0,0,0,1|1,0,0]=3 1288 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 D91915 [0,1,0,0,0,1|0,0,0]=2 1289 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 H11389 [0,1,0,0,0,1|0,0,0]=2 1290 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 AC1610 [0,1,0,0,0,1|0,0,0]=2 1291 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 FD1244 [0,1,0,0,0,1|0,0,0]=2 1292 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 FD1250 [0,1,0,0,0,1|0,0,0]=2 1293 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 77874 [0,1,0,0,0,1|1,0,0]=3 1294 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 W15978 [0,1,0,0,0,1|2,0,0]=4 1295 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 AC2474 [0,1,0,0,0,1|1,0,0]=3 1296 B12R1.107 CC(=O)N[C@@H](C)C1=CC=CC=C1 C11678 [0,1,0,0,0,1|1,0,0]=3 1297 B12R1.107 CN(CC(=O)O)C1=NC=CC=C1 31939 [0,1,0,0,0,1|1,0,0]=3 1298 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 D88640 [0,1,0,0,0,1|1,0,1]=4 1299 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 65104 [0,1,0,0,0,1|0,0,0]=2 1300 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 65105 [0,1,0,0,0,1|0,0,0]=2 1301 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 65106 [0,1,0,0,0,1|0,0,0]=2 1302 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 F12097 [0,1,0,0,0,1|0,0,0]=2 1303 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CC=C1 FD1091 [0,1,0,0,0,1|1,0,0]=3 1304 B12R1.107 N[C@@H](CC(=O)O)C1=CN=CC=C1 N12395 [0,1,0,0,0,1|1,0,0]=3 1305 B12R1.107 O=C(O)C[C@H](O)C1=CC=CC=C1 FD1325 [0,1,0,0,0,1|0,0,0]=2 1306 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 CL8849 [0,1,0,0,0,1|0,0,0]=2 1307 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 S12092 [0,1,0,0,0,1|0,0,0]=2 1308 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 73977 [0,1,0,0,0,1|0,0,1]=3 1309 B12R1.125 NC(=O)CCC1=C(O)C=CC=C1 D84146 [0,1,0,0,0,1|1,0,0]=3 1310 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 AB3202 [0,1,0,0,0,1|0,0,0]=2 1311 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 75611 [0,1,0,0,0,1|0,0,0]=2 1312 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 AB3822 [0,1,0,0,0,1|0,0,0]=2 1313 B12R1.125 O=C(O)CCC1=C(I)C=CC=C1 S10171 [0,1,0,0,0,1|0,0,0]=2 1314 B12R1.125 O=C(O)CCC1=C(O)C=CC=C1 F16128 [0,1,0,0,0,1|0,0,0]=2 1315 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 FD10490 [0,1,0,0,0,1|0,0,0]=2 1316 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 30753 [0,1,0,0,0,1|0,0,0]=2 1317 B12R1.125 O=C(O)CSC1=C(Cl)C=CC=C1 C13412 [0,1,0,0,0,1|0,0,0]=2 1318 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 28628 [0,1,0,0,0,1|0,0,1]=3 1319 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 D73309 [0,1,0,0,0,1|0,0,1]=3 1320 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 AC7821 [0,1,0,0,0,1|0,0,1]=3 1321 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 AC7832 [0,1,0,0,0,1|0,0,1]=3 1322 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 42496 [0,1,0,0,0,1|0,0,1]=3 1323 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 66560 [0,1,0,0,0,1|0,0,0]=2 1324 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 F16054 [0,1,0,0,0,1|0,0,0]=2 1325 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=C1 66558 [0,1,0,0,0,1|0,0,1]=3 1326 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=C1 AC7519 [0,1,0,0,0,1|0,0,1]=3 1327 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 I11525 [0,1,0,0,0,1|0,0,0]=2 1328 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 33491 [0,1,0,0,0,1|0,0,0]=2 1329 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 33548 [0,1,0,0,0,1|0,0,0]=2 1330 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 34301 [0,1,0,0,0,1|0,0,0]=2 1331 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 61032 [0,1,0,0,0,1|0,0,0]=2 1332 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 Y10997 [0,1,0,0,0,1|0,0,0]=2 1333 B12R1.226 O=C(O)COC1=CC=CC(Cl)=C1 37702 [0,1,0,0,0,1|0,0,0]=2 1334 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 38120 [0,1,0,0,0,1|0,0,0]=2 1335 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 F15419 [0,1,0,0,0,1|0,0,1]=3 1336 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 AB6441 [0,1,0,0,0,1|0,0,1]=3 1337 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 75802 [0,1,0,0,0,1|0,0,1]=3 1338 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 AC7822 [0,1,0,0,0,1|0,0,1]=3 1339 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 CK2538 [0,1,0,0,0,1|0,0,1]=3 1340 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 P19618 [0,1,0,0,0,1|0,0,1]=3 1341 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 CL8740 [0,1,0,0,0,1|1,0,1]=4 1342 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 D91950 [0,1,0,0,0,1|2,0,0]=4 1343 B12R1.891 O=S(=O)(O)CCC1=NC=CC=C1 D91949 [0,1,0,0,0,1|2,0,0]=4 1344 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 50340 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.4 CC(=O)CC1=CC=C(C#N)C=C1 D84247 [0,2,0,0,0,0|1,0,0]=3 1346 B12R1.4 CC(=O)NC1=CC=C(C#N)C=C1 35468 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 CK2088 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.4 CC(=O)NC1=CC=C(CO)C=C1 20522 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.4 CC(=O)OC1=CC=C(C=O)C=C1 20466 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 A51165 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.4 CC(=O)OC1=CC=C(CCl)C=C1 F10379 [0,2,0,0,0,0|2,0,0]=4 1352 B12R1.4 CC(=O)OC1=CC=C(CO)C=C1 D80495 [0,2,0,0,0,0|2,0,0]=4 1353 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 34183 [0,2,0,0,0,0|1,0,0]=3 1354 B12R1.4 CCC1=CC=C(OC(C)=O)C=C1 D88417 [0,2,0,0,0,0|2,0,0]=4 1355 B12R1.4 COC1=CC=C(CC(=O)Cl)C=C1 D78187 [0,2,0,0,0,0|1,0,0]=3 1356 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 D70488 [0,2,0,0,0,0|0,0,0]=2 1357 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 26091 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 63938 [0,2,0,0,0,0|1,0,0]=3 1359 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 C10221 [0,2,0,0,0,0|2,0,0]=4 1360 B12R1.4 COC1=CN=C(CC(=O)O)C=C1 88383 [0,2,0,0,0,0|1,0,0]=3 1361 B12R1.4 COC1=NC=C(CC(=O)O)C=C1 32328 [0,2,0,0,0,0|1,0,0]=3 1362 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 F11769 [0,2,0,0,0,0|0,0,0]=2 1363 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 59528 [0,2,0,0,0,0|0,0,0]=2 1364 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 75935 [0,2,0,0,0,0|0,0,0]=2 1365 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 11292 [0,2,0,0,0,0|0,0,0]=2 1366 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 H10579 [0,2,0,0,0,0|0,0,0]=2 1367 B12R1.19 CC(=O)NC1=CC(Br)=C(C)C=C1 D84576 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.19 CC(=O)NC1=CC(Br)=C(F)C=C1 32187 [0,2,0,0,0,0|2,0,0]=4 1369 B12R1.19 CC(=O)NC1=CC(C)=C(Br)C=C1 D88986 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.19 CC(=O)NC1=CC(C)=C(C)C=C1 50530 [0,2,0,0,0,0|2,0,0]=4 1371 B12R1.19 CC(=O)NC1=CC(Cl)=C(Br)C=C1 AT10248 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.19 CC(=O)NC1=CC(Cl)=C(C)C=C1 AB6861 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.19 CC(=O)NC1=CC(Cl)=C(Cl)C=C1 AB6994 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.19 CC(=O)NC1=CC(Cl)=C(F)C=C1 F21244 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.19 CC(=O)NC1=CC(Cl)=C(O)C=C1 25132 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.19 CC(=O)NC1=CC(N)=C(Cl)C=C1 D88451 [0,2,0,0,0,0|2,0,0]=4 1377 B12R1.19 CC(=O)NC1=CC(O)=C(O)C=C1 S10202 [0,2,0,0,0,0|2,0,0]=4 1378 B12R1.19 CC(=O)OC1=CC(N)=C(F)C=C1 34416 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.19 CC1=C(Br)C=CC(CC(=O)O)=C1 CL8787 [0,2,0,0,0,0|0,0,0]=2 1380 B12R1.19 CC1=C(C)C=C(CC(=O)O)C=C1 67768 [0,2,0,0,0,0|0,0,0]=2 1381 B12R1.19 CC1=C(F)C=C(CC(=O)O)C=C1 CL9109 [0,2,0,0,0,0|0,0,0]=2 1382 B12R1.19 CC1=C(F)C=CC(CC(=O)O)=C1 CL9442 [0,2,0,0,0,0|0,0,0]=2 1383 B12R1.19 CC1=C(N)C=CC(CC(=O)O)=C1 Y10010 [0,2,0,0,0,0|0,0,0]=2 1384 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 CL9284 [0,2,0,0,0,0|0,0,0]=2 1385 B12R1.19 O=C(O)CC1=CC(Br)=C(Cl)C=C1 SC5040 [0,2,0,0,0,0|0,0,0]=2 1386 B12R1.19 O=C(O)CC1=CC(Br)=C(F)C=C1 67770 [0,2,0,0,0,0|0,0,0]=2 1387 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 CK2069 [0,2,0,0,0,0|0,0,0]=2 1388 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 75669 [0,2,0,0,0,0|0,0,0]=2 1389 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 67623 [0,2,0,0,0,0|0,0,0]=2 1390 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 C13676 [0,2,0,0,0,0|0,0,0]=2 1391 B12R1.19 O=C(O)CC1=CC(F)=C(Br)C=C1 22748 [0,2,0,0,0,0|0,0,0]=2 1392 B12R1.19 O=C(O)CC1=CC(F)=C(Cl)C=C1 35504 [0,2,0,0,0,0|0,0,0]=2 1393 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 22054 [0,2,0,0,0,0|0,0,0]=2 1394 B12R1.19 O=C(O)CC1=CC(F)=C(I)C=C1 CL8777 [0,2,0,0,0,0|0,0,0]=2 1395 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 CL8962 [0,2,0,0,0,0|0,0,0]=2 1396 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 33468 [0,2,0,0,0,0|0,0,0]=2 1397 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 AB3043 [0,2,0,0,0,0|2,0,0]=4 1398 B12R1.20 CC(=O)N(C)C1=CC=C(O)C=C1 Y11633 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.20 CC1=CC=C([C@@H](C)C(=O)O)C=C1 F19228 [0,2,0,0,0,0|0,0,0]=2 1400 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 69416 [0,2,0,0,0,0|0,0,0]=2 1401 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 11021 [0,2,0,0,0,0|0,0,0]=2 1402 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(F)C=C1 24605 [0,2,0,0,0,0|0,0,0]=2 1403 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 F17592 [0,2,0,0,0,0|0,0,0]=2 1404 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 23737 [0,2,0,0,0,0|0,0,0]=2 1405 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 N10975 [0,2,0,0,0,0|0,0,0]=2 1406 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28178 [0,2,0,0,0,0|0,0,0]=2 1407 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28179 [0,2,0,0,0,0|0,0,0]=2 1408 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 28180 [0,2,0,0,0,0|0,0,0]=2 1409 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 57525 [0,2,0,0,0,0|0,0,0]=2 1410 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 57523 [0,2,0,0,0,0|0,0,0]=2 1411 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58552 [0,2,0,0,0,0|0,0,0]=2 1412 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58553 [0,2,0,0,0,0|0,0,0]=2 1413 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 58554 [0,2,0,0,0,0|0,0,0]=2 1414 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 62399 [0,2,0,0,0,0|0,0,0]=2 1415 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 D71081 [0,2,0,0,0,0|0,0,0]=2 1416 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 F11089 [0,2,0,0,0,0|0,0,0]=2 1417 B12R1.20 O=C(O)[C@H](Br)C1=CC=C(Cl)C=C1 75437 [0,2,0,0,0,0|0,0,0]=2 1418 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Br)C=C1 C10958 [0,2,0,0,0,0|0,0,0]=2 1419 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 75254 [0,2,0,0,0,0|0,0,0]=2 1420 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 A11529 [0,2,0,0,0,0|0,0,0]=2 1421 B12R1.20 O=C(O)[C@H](O)C1=CC=C(F)C=C1 H10731 [0,2,0,0,0,0|0,0,0]=2 1422 B12R1.20 O=C(O)[C@H](O)C1=CC=C(O)C=C1 28708 [0,2,0,0,0,0|0,0,0]=2 1423 B12R1.20 O=C(O)[C@H](O)C1=CC=C(O)C=C1 D95528 [0,2,0,0,0,0|0,0,0]=2 1424 B12R1.49 C=CC(=O)NC1=CC=C(Cl)C=C1 N11713 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 A51184 [0,2,0,0,0,0|2,0,0]=4 1426 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 85543 [0,2,0,0,0,0|1,0,0]=3 1427 B12R1.49 CNC(=O)CC1=CC=C(Cl)C=C1 W12083 [0,2,0,0,0,0|1,0,0]=3 1428 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 W17425 [0,2,0,0,0,0|1,0,0]=3 1429 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 AB3932 [0,2,0,0,0,0|0,0,0]=2 1430 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 76662 [0,2,0,0,0,0|0,0,0]=2 1431 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 76653 [0,2,0,0,0,0|0,0,0]=2 1432 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 AB7526 [0,2,0,0,0,0|0,0,0]=2 1433 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 AC6509 [0,2,0,0,0,0|0,0,0]=2 1434 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 50001 [0,2,0,0,0,0|0,0,0]=2 1435 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 AB7450 [0,2,0,0,0,0|0,0,0]=2 1436 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 35758 [0,2,0,0,0,0|0,0,0]=2 1437 B12R1.49 COC(=O)CC1=CN=C(Cl)C=C1 F16371 [0,2,0,0,0,0|1,0,0]=3 1438 B12R1.49 COC(=O)CC1=NC=C(Br)C=N1 72518 [0,2,0,0,0,0|2,0,0]=4 1439 B12R1.49 COC(=O)NC1=CC=C(N)C=C1 AB10046 [0,2,0,0,0,0|1,0,0]=3 1440 B12R1.49 N=C(CC1=CC=C(Br)C=C1)NO D83600 [0,2,0,0,0,0|1,0,0]=3 1441 B12R1.49 NCC(=O)NC1=CC=C(N)C=C1 D81587 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 W10668 [0,2,0,0,0,0|1,0,0]=3 1443 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 24102 [0,2,0,0,0,0|1,0,0]=3 1444 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 W10662 [0,2,0,0,0,0|1,0,0]=3 1445 B12R1.49 N[C@H](CO)CC1=CC=C(Cl)C=C1 D95165 [0,2,0,0,0,0|1,0,1]=4 1446 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 C10910 [0,2,0,0,0,0|1,0,1]=4 1447 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 D97455 [0,2,0,0,0,0|1,0,1]=4 1448 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N/O 91125 [0,2,0,0,0,0|1,0,0]=3 1449 B12R1.49 N\C(CC1=CC=C(F)C=C1)=N/O W10709 [0,2,0,0,0,0|1,0,0]=3 1450 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 W11889 [0,2,0,0,0,0|2,0,0]=4 1451 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 F30176 [0,2,0,0,0,0|2,0,0]=4 1452 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 D83579 [0,2,0,0,0,0|2,0,0]=4 1453 B12R1.106 CC(C)(O)CC1=CC=C(Cl)C=C1 C75564 [0,2,0,0,0,0|1,0,1]=4 1454 B12R1.106 CC1=CC=C(CS(=O)(=O)Cl)C=C1 AR2933 [0,2,0,0,0,0|1,0,1]=4 1455 B12R1.106 NC1=CC=C(OS(=O)(=O)O)C=C1 28707 [0,2,0,0,0,0|2,0,0]=4 1456 B12R1.106 NS(=O)(=O)CC1=CC=C(Br)C=C1 68662 [0,2,0,0,0,0|1,0,1]=4 1457 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Br)C=C1 68661 [0,2,0,0,0,0|1,0,1]=4 1458 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Cl)C=C1 AR2921 [0,2,0,0,0,0|1,0,1]=4 1459 B12R1.106 O=S(=O)(Cl)CC1=CC=C(F)C=C1 AR2930 [0,2,0,0,0,0|1,0,1]=4 1460 B12R1.106 O=S(=O)([O-])CC1=CC=C(Br)C=C1 66304 [0,2,0,0,0,0|1,0,1]=4 1461 B12R1.233 CC(=O)CC1=C(Cl)C=C(Cl)C=C1 D90132 [0,2,0,0,0,0|1,0,0]=3 1462 B12R1.233 CC(=O)NC1=C(Br)C=C(C)C=C1 54572 [0,2,0,0,0,0|2,0,0]=4 1463 B12R1.233 CC(=O)NC1=C(Br)C=C(F)C=C1 D88957 [0,2,0,0,0,0|2,0,0]=4 1464 B12R1.233 CC(=O)NC1=C(C)C=C(Br)C=C1 A51056 [0,2,0,0,0,0|2,0,0]=4 1465 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 W11349 [0,2,0,0,0,0|2,0,0]=4 1466 B12R1.233 CC(=O)NC1=C(C)C=C(Cl)C=C1 W10837 [0,2,0,0,0,0|2,0,0]=4 1467 B12R1.233 CC(=O)NC1=C(C)C=C(F)C=C1 F21460 [0,2,0,0,0,0|2,0,0]=4 1468 B12R1.233 CC(=O)NC1=C(C)C=C(N)C=C1 78470 [0,2,0,0,0,0|2,0,0]=4 1469 B12R1.233 CC(=O)NC1=C(Cl)C=C(Br)C=C1 S10886 [0,2,0,0,0,0|2,0,0]=4 1470 B12R1.233 CC(=O)NC1=C(Cl)C=C(Cl)C=C1 D84493 [0,2,0,0,0,0|2,0,0]=4 1471 B12R1.233 CC(=O)NC1=C(Cl)C=C(F)C=C1 36575 [0,2,0,0,0,0|2,0,0]=4 1472 B12R1.233 CC(=O)NC1=C(F)C=C(Br)C=C1 C10923 [0,2,0,0,0,0|2,0,0]=4 1473 B12R1.233 CC(=O)NC1=C(F)C=C(C)C=C1 D83825 [0,2,0,0,0,0|2,0,0]=4 1474 B12R1.233 CC(=O)NC1=C(F)C=C(Cl)C=C1 36892 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.233 CC(=O)NC1=C(F)C=C(F)C=C1 36609 [0,2,0,0,0,0|2,0,0]=4 1476 B12R1.233 CC(=O)NC1=C(N)C=C(Br)C=C1 F21313 [0,2,0,0,0,0|2,0,0]=4 1477 B12R1.233 CC1=C(CC(=O)O)C=CC(Br)=C1 CL9343 [0,2,0,0,0,0|0,0,0]=2 1478 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 CK2067 [0,2,0,0,0,0|0,0,0]=2 1479 B12R1.233 CC1=CC(C)=C(CC(=O)O)C=C1 67678 [0,2,0,0,0,0|0,0,0]=2 1480 B12R1.233 CC1=CC(F)=C(CC(=O)O)C=C1 CL9433 [0,2,0,0,0,0|0,0,0]=2 1481 B12R1.233 NC(=O)CC1=C(Cl)C=C(Cl)C=C1 D84567 [0,2,0,0,0,0|1,0,0]=3 1482 B12R1.233 NC1=C(CC(=O)O)C=CC(Cl)=C1 A10628 [0,2,0,0,0,0|0,0,0]=2 1483 B12R1.233 O=C(O)CC1=C(Br)C=C(Br)C=C1 22757 [0,2,0,0,0,0|0,0,0]=2 1484 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 CL8754 [0,2,0,0,0,0|0,0,0]=2 1485 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 67762 [0,2,0,0,0,0|0,0,0]=2 1486 B12R1.233 O=C(O)CC1=C(Cl)C=C(Br)C=C1 CL8783 [0,2,0,0,0,0|0,0,0]=2 1487 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 F11217 [0,2,0,0,0,0|0,0,0]=2 1488 B12R1.233 O=C(O)CC1=C(Cl)C=C(F)C=C1 CL8960 [0,2,0,0,0,0|0,0,0]=2 1489 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 CL8784 [0,2,0,0,0,0|0,0,0]=2 1490 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 CK1034 [0,2,0,0,0,0|0,0,0]=2 1491 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 67758 [0,2,0,0,0,0|0,0,0]=2 1492 B12R1.233 O=C(O)CC1=C(O)C=C(F)C=C1 95684 [0,2,0,0,0,0|0,0,0]=2 1493 B12R1.233 O=C(O)CN1C=CC(=O)NC1=O AC8863 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.34 C=C(C(=O)OC)C1=CC=CC=C1 C73581 [0,2,0,0,0,0|0,0,1]=3 1495 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 A10303 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 28420 [0,2,0,0,0,0|0,0,1]=3 1497 B12R1.34 COC(=O)[C@H](Br)C1=CC=CC=C1 S12168 [0,2,0,0,0,0|0,0,0]=2 1498 B12R1.34 COC(=O)[C@H](C)C1=CC=CC=C1 W13540 [0,2,0,0,0,0|0,0,0]=2 1499 B12R1.34 COC(=O)[C@H](Cl)C1=CC=CC=C1 D81981 [0,2,0,0,0,0|0,0,0]=2 1500 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 39409 [0,2,0,0,0,0|0,0,0]=2 1501 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 E70004 [0,2,0,0,0,0|0,0,0]=2 1502 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 F14561 [0,2,0,0,0,0|0,0,0]=2 1503 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 D70330 [0,2,0,0,0,0|0,0,0]=2 1504 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 FD1304 [0,2,0,0,0,0|0,0,0]=2 1505 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 FD1307 [0,2,0,0,0,0|0,0,0]=2 1506 B12R1.34 C\C(=N/O)C(=O)C1=CC=CC=C1 D91925 [0,2,0,0,0,0|1,0,1]=4 1507 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 32680 [0,2,0,0,0,0|1,0,0]=3 1508 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 D94755 [0,2,0,0,0,0|1,0,0]=3 1509 B12R1.124 C[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 57814 [0,2,0,0,0,0|0,0,0]=2 1510 B12R1.124 NC1=C(C(=O)C(=O)[O-])C=CC=C1 F19858 [0,2,0,0,0,0|0,0,2]=4 1511 B12R1.124 N[C@@H](C(=O)O)C1=C(Br)C=CC=C1 CL9429 [0,2,0,0,0,0|0,0,0]=2 1512 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 28172 [0,2,0,0,0,0|0,0,0]=2 1513 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 28174 [0,2,0,0,0,0|0,0,0]=2 1514 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 28176 [0,2,0,0,0,0|0,0,0]=2 1515 B12R1.124 N[C@@H](C(=O)O)C1=C(F)C=CC=C1 61056 [0,2,0,0,0,0|0,0,0]=2 1516 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 FD13129 [0,2,0,0,0,0|0,0,0]=2 1517 B12R1.124 O=C(O)C(=O)C1=C(Br)C=CC=C1 25864 [0,2,0,0,0,0|0,0,1]=3 1518 B12R1.124 O=C(O)[C@H](Br)C1=C(Cl)C=CC=C1 D78054 [0,2,0,0,0,0|0,0,0]=2 1519 B12R1.124 O=C(O)[C@H](O)C1=C(Cl)C=CC=C1 28189 [0,2,0,0,0,0|0,0,0]=2 1520 B12R1.124 O=C(O)[C@H](O)C1=C(Cl)C=CC=C1 28190 [0,2,0,0,0,0|0,0,0]=2 1521 B12R1.124 O=C(O)[C@H](O)C1=C(Cl)C=CC=C1 28191 [0,2,0,0,0,0|0,0,0]=2 1522 B12R1.124 O=C(O)[C@H](O)C1=C(F)C=CC=C1 D73185 [0,2,0,0,0,0|0,0,0]=2 1523 B12R1.225 C[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 S10089 [0,2,0,0,0,0|0,0,0]=2 1524 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Br)=C1 BL008388 [0,2,0,0,0,0|0,0,0]=2 1525 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 28177 [0,2,0,0,0,0|0,0,0]=2 1526 B12R1.225 O=C(O)C(=O)C1=CC=CC(Br)=C1 AB10480 [0,2,0,0,0,0|0,0,1]=3 1527 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 A12852 [0,2,0,0,0,0|0,0,1]=3 1528 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Cl)=C1 C11427 [0,2,0,0,0,0|0,0,0]=2 1529 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Cl)=C1 SC4001 [0,2,0,0,0,0|0,0,0]=2 1530 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 L10018 [0,2,0,0,0,0|0,0,0]=2 1531 B12R1.253 C[C@](O)(C(=O)O)C1=CC=CC=C1 T70989 [0,2,0,0,0,0|0,0,0]=2 1532 B12R1.253 O=C(O)C(F)(F)C1=NC=CC=C1 37509 [0,2,0,0,0,0|1,0,0]=3 1533 B12R1.478 CC[C@@H](C(=O)Cl)C1=CC=CC=C1 F10305 [0,2,0,0,0,0|1,0,0]=3 1534 B12R1.478 CC[C@@H](C(N)=O)C1=CC=CC=C1 D97844 [0,2,0,0,0,0|1,0,0]=3 1535 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 D95249 [0,2,0,0,0,0|0,0,0]=2 1536 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 28625 [0,2,0,0,0,0|0,0,0]=2 1537 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 63178 [0,2,0,0,0,0|0,0,0]=2 1538 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 63179 [0,2,0,0,0,0|0,0,0]=2 1539 B12R1.478 N#C[C@@H](C(N)=O)C1=CC=CC=C1 F31127 [0,2,0,0,0,0|1,0,0]=3 1540 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 43959 [0,2,0,0,0,0|0,0,0]=2 1541 B12R1.564 CC(C)(O)[C@H](N)C1=CC=CC=C1 11248 [0,2,0,0,0,0|1,0,1]=4 1542 B12R1.32 CCCC(=O)CC1=CC=CC=C1 F19922 [0,2,0,0,0,0|1,0,0]=3 1543 B12R1.32 CCNC(=O)OC1=CC=CC=C1 D92920 [0,2,0,0,0,0|2,0,0]=4 1544 B12R1.32 CCOC(=O)CC1=CC=CC=C1 D77783 [0,2,0,0,0,0|0,0,0]=2 1545 B12R1.32 CCOC(=O)CC1=CC=NC=C1 W12171 [0,2,0,0,0,0|1,0,0]=3 1546 B12R1.32 CCOC(=O)CC1=CN=CC=C1 TD8046 [0,2,0,0,0,0|1,0,0]=3 1547 B12R1.32 CCOC(=O)CC1=NC=CC=C1 28493 [0,2,0,0,0,0|1,0,0]=3 1548 B12R1.32 CCOC(=O)CC1=NC=CC=N1 24984 [0,2,0,0,0,0|2,0,0]=4 1549 B12R1.32 CCOC(=O)CC1=NC=CN=C1 50113 [0,2,0,0,0,0|2,0,0]=4 1550 B12R1.32 CN(CCO)CC1=CC=CC=C1 D70360 [0,2,0,0,0,0|2,0,0]=4 1551 B12R1.32 N#CCC(=O)CC1=CC=CC=C1 90350 [0,2,0,0,0,0|1,0,0]=3 1552 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 75523 [0,2,0,0,0,0|2,0,0]=4 1553 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 57872 [0,2,0,0,0,0|2,0,0]=4 1554 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 D84185 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 21183 [0,2,0,0,0,0|2,0,0]=4 1556 B12R1.50 CCC(=O)NC1=CC(N)=CC=C1 O11989 [0,2,0,0,0,0|2,0,0]=4 1557 B12R1.50 COC(=O)CC1=CC(C)=CC=C1 35769 [0,2,0,0,0,0|0,0,0]=2 1558 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 CL8810 [0,2,0,0,0,0|0,0,0]=2 1559 B12R1.50 COC(=O)CC1=CC(O)=CC=C1 AB3965 [0,2,0,0,0,0|0,0,0]=2 1560 B12R1.50 COC(=O)CC1=CC=CC(Br)=C1 AB3931 [0,2,0,0,0,0|0,0,0]=2 1561 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 AB9674 [0,2,0,0,0,0|0,0,0]=2 1562 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 22081 [0,2,0,0,0,0|0,0,0]=2 1563 B12R1.50 COC(=O)CC1=CC=CC(I)=C1 P16659 [0,2,0,0,0,0|0,0,0]=2 1564 B12R1.50 COC(=O)CC1=NC(C)=CC=C1 76380 [0,2,0,0,0,0|1,0,0]=3 1565 B12R1.50 COC(=O)CC1=NC=CC(C)=C1 D82783 [0,2,0,0,0,0|1,0,0]=3 1566 B12R1.50 NNC(=O)NC1=CC=CC(F)=C1 W18479 [0,2,0,0,0,0|2,0,0]=4 1567 B12R1.50 N\C(CC1=CC=CC(Cl)=C1)=N/O 71744 [0,2,0,0,0,0|1,0,0]=3 1568 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 C11415 [0,2,0,0,0,0|2,0,0]=4 1569 B12R1.194 CC[C@](C)(O)CC1=CC=CC=C1 D91562 [0,2,0,0,0,0|1,0,1]=4 1570 B12R1.371 CC1=C(NC(=O)CCl)C=CC=C1 71025 [0,2,0,0,0,0|2,0,0]=4 1571 B12R1.371 COC(=O)CC1=C(Br)C=CC=C1 AB3930 [0,2,0,0,0,0|0,0,0]=2 1572 B12R1.371 COC(=O)CC1=C(Br)C=CC=N1 38410 [0,2,0,0,0,0|1,0,0]=3 1573 B12R1.371 COC(=O)CC1=C(C)C=CC=C1 D74700 [0,2,0,0,0,0|0,0,0]=2 1574 B12R1.371 COC(=O)CC1=C(Cl)C=CC=C1 29411 [0,2,0,0,0,0|0,0,0]=2 1575 B12R1.371 COC(=O)CC1=C(F)C=CC=C1 AB7523 [0,2,0,0,0,0|0,0,0]=2 1576 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 A10071 [0,2,0,0,0,0|0,0,0]=2 1577 B12R1.371 NNC(=O)CC1=C(Cl)C=CC=C1 D70921 [0,2,0,0,0,0|1,0,0]=3 1578 B12R1.371 NNC(=O)CC1=C(F)C=CC=C1 D97532 [0,2,0,0,0,0|1,0,0]=3 1579 B12R1.371 NNC(=O)NC1=C(Cl)C=CC=C1 W18576 [0,2,0,0,0,0|2,0,0]=4 1580 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N10848 [0,2,0,0,0,0|1,0,1]=4 1581 B12R1.371 O=C(CBr)NC1=C(F)C=CC=C1 71401 [0,2,0,0,0,0|2,0,0]=4 1582 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 57527 [0,2,0,0,0,0|2,0,0]=4 1583 B12R1.75 CC(=O)NC1=C(C#N)C=CC=C1 59604 [0,2,0,0,0,0|2,0,0]=4 1584 B12R1.75 CC(=O)NC1=C(CO)C=CC=C1 30764 [0,2,0,0,0,0|2,0,0]=4 1585 B12R1.75 CC(=O)OC1=C(C#N)C=CC=C1 A10372 [0,2,0,0,0,0|2,0,0]=4 1586 B12R1.75 CCC1=C(OC(C)=O)C=CC=C1 D88449 [0,2,0,0,0,0|2,0,0]=4 1587 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 F11410 [0,2,0,0,0,0|0,0,0]=2 1588 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 N11926 [0,2,0,0,0,0|1,0,0]=3 1589 B12R1.75 COC1=C(C[C@H](C)O)C=CC=C1 D82158 [0,2,0,0,0,0|1,0,1]=4 1590 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 D88200 [0,2,0,0,0,0|2,0,0]=4 1591 B12R1.75 COC1=C(OC(C)=O)C=CC=C1 N10380 [0,2,0,0,0,0|2,0,0]=4 1592 B12R1.75 N#CC1=C(CC(=O)O)C=CC=C1 CL8757 [0,2,0,0,0,0|0,0,0]=2 1593 B12R1.75 NCC1=C(CC(=O)O)C=CC=C1 A50518 [0,2,0,0,0,0|0,0,0]=2 1594 B12R1.75 O=C(O)CC1=C(CCl)C=CC=C1 CK1033 [0,2,0,0,0,0|0,0,0]=2 1595 B12R1.127 CC(=O)NC1=C(C)C=CC(Br)=C1 22735 [0,2,0,0,0,0|2,0,0]=4 1596 B12R1.127 CC(=O)NC1=C(C)C=CC(C)=C1 78682 [0,2,0,0,0,0|2,0,0]=4 1597 B12R1.127 CC(=O)NC1=C(C)C=CC(F)=C1 F17525 [0,2,0,0,0,0|2,0,0]=4 1598 B12R1.127 CC(=O)NC1=C(C)C=CC(N)=C1 74118 [0,2,0,0,0,0|2,0,0]=4 1599 B12R1.127 CC(=O)NC1=C(Cl)C=CC(Cl)=C1 AB6993 [0,2,0,0,0,0|2,0,0]=4 1600 B12R1.127 CC(=O)NC1=C(F)C=CC(N)=C1 76211 [0,2,0,0,0,0|2,0,0]=4 1601 B12R1.127 CC(=O)NC1=C(I)C=CC(F)=C1 SC5035 [0,2,0,0,0,0|2,0,0]=4 1602 B12R1.127 CC(=O)NC1=C(O)C=CC(C)=C1 AC8060 [0,2,0,0,0,0|2,0,0]=4 1603 B12R1.127 CC1=C(CC(=O)O)C=C(Br)C=C1 CL9128 [0,2,0,0,0,0|0,0,0]=2 1604 B12R1.127 CC1=C(CC(=O)O)C=C(F)C=C1 CK2070 [0,2,0,0,0,0|0,0,0]=2 1605 B12R1.127 CC1=CC(CC(=O)O)=C(Br)C=C1 CL9308 [0,2,0,0,0,0|0,0,0]=2 1606 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 CK2073 [0,2,0,0,0,0|0,0,0]=2 1607 B12R1.127 NC1=CC(CC(=O)O)=C(F)C=C1 36816 [0,2,0,0,0,0|0,0,0]=2 1608 B12R1.127 O=C(O)CC1=C(Br)C=CC(Br)=C1 CL8749 [0,2,0,0,0,0|0,0,0]=2 1609 B12R1.127 O=C(O)CC1=C(Br)C=CC(Cl)=C1 67763 [0,2,0,0,0,0|0,0,0]=2 1610 B12R1.127 O=C(O)CC1=C(Br)C=CC(F)=C1 67907 [0,2,0,0,0,0|0,0,0]=2 1611 B12R1.127 O=C(O)CC1=C(Cl)C=CC(Br)=C1 36455 [0,2,0,0,0,0|0,0,0]=2 1612 B12R1.127 O=C(O)CC1=C(Cl)C=CC(Cl)=C1 SC5031 [0,2,0,0,0,0|0,0,0]=2 1613 B12R1.127 O=C(O)CC1=C(Cl)C=CC(F)=C1 CL8756 [0,2,0,0,0,0|0,0,0]=2 1614 B12R1.127 O=C(O)CC1=C(F)C=CC(Br)=C1 CL8796 [0,2,0,0,0,0|0,0,0]=2 1615 B12R1.127 O=C(O)CC1=C(F)C=CC(Cl)=C1 CK2072 [0,2,0,0,0,0|0,0,0]=2 1616 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 67759 [0,2,0,0,0,0|0,0,0]=2 1617 B12R1.127 O=C(O)CC1=C(O)C=CC(Br)=C1 CL8798 [0,2,0,0,0,0|0,0,0]=2 1618 B12R1.151 CC(C)(O)CC1=C(F)C=CC=C1 D97644 [0,2,0,0,0,0|1,0,1]=4 1619 B12R1.151 CS(=O)(=O)CC1=C(Br)C=CC=C1 C74305 [0,2,0,0,0,0|1,0,1]=4 1620 B12R1.151 NS(=O)(=O)CC1=C(Br)C=CC=C1 71899 [0,2,0,0,0,0|1,0,1]=4 1621 B12R1.224 CC(=O)NC1=CC=CC(Cl)=C1Cl AB6992 [0,2,0,0,0,0|2,0,0]=4 1622 B12R1.224 CC1=C(F)C=CC=C1CC(=O)O CL8776 [0,2,0,0,0,0|0,0,0]=2 1623 B12R1.224 CC1=CC=CC(CC(=O)O)=C1Br CL9369 [0,2,0,0,0,0|0,0,0]=2 1624 B12R1.224 CC1=CC=CC(CC(=O)O)=C1C CL8748 [0,2,0,0,0,0|0,0,0]=2 1625 B12R1.224 CC1=CC=CC(CC(=O)O)=C1O 95682 [0,2,0,0,0,0|0,0,0]=2 1626 B12R1.224 O=C(O)CC1=CC=CC(Br)=C1F CL8769 [0,2,0,0,0,0|0,0,0]=2 1627 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Br CL9123 [0,2,0,0,0,0|0,0,0]=2 1628 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Cl 22076 [0,2,0,0,0,0|0,0,0]=2 1629 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1F 22096 [0,2,0,0,0,0|0,0,0]=2 1630 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Br 22708 [0,2,0,0,0,0|0,0,0]=2 1631 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Cl CL8958 [0,2,0,0,0,0|0,0,0]=2 1632 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F 61772 [0,2,0,0,0,0|0,0,0]=2 1633 B12R1.1009 CC(=O)NC1=C(C)C=CC=C1C S10126 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.1009 CC1=CC=CC(C)=C1CC(=O)O CL9458 [0,2,0,0,0,0|0,0,0]=2 1635 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1Br CL8750 [0,2,0,0,0,0|0,0,0]=2 1636 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1Cl D83277 [0,2,0,0,0,0|0,0,0]=2 1637 B12R1.1009 O=C(O)CC1=C(Br)C=CC=C1F CL9410 [0,2,0,0,0,0|0,0,0]=2 1638 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl 67680 [0,2,0,0,0,0|0,0,0]=2 1639 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F 67765 [0,2,0,0,0,0|0,0,0]=2 1640 B12R1.1009 O=C(O)CC1=C(Cl)N=CN=C1Cl C10589 [0,2,0,0,0,0|2,0,0]=4 1641 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F 67761 [0,2,0,0,0,0|0,0,0]=2 1642 B12R1.101 CC(=O)NC1=CC(F)=CC(F)=C1 C13916 [0,2,0,0,0,0|2,0,0]=4 1643 B12R1.101 CC1=CC(C)=CC(CC(=O)O)=C1 CK2071 [0,2,0,0,0,0|0,0,0]=2 1644 B12R1.101 CC1=CC(F)=CC(CC(=O)O)=C1 CL9282 [0,2,0,0,0,0|0,0,0]=2 1645 B12R1.101 O=C(O)CC1=CC(Br)=CC(Br)=C1 60098 [0,2,0,0,0,0|0,0,0]=2 1646 B12R1.101 O=C(O)CC1=CC(Br)=CC(F)=C1 36243 [0,2,0,0,0,0|0,0,0]=2 1647 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 CL8766 [0,2,0,0,0,0|0,0,0]=2 1648 B12R1.101 O=C(O)CC1=CC(Cl)=CC(F)=C1 CL8772 [0,2,0,0,0,0|0,0,0]=2 1649 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 22063 [0,2,0,0,0,0|0,0,0]=2 1650 B12R1.119 O=S(=O)(Cl)CC1=CC(F)=CC=C1 A51059 [0,2,0,0,0,0|1,0,1]=4 1651 B12R1.438 C#CC1=CC=CC(NC(C)=O)=C1 F10464 [0,2,0,0,0,0|2,0,0]=4 1652 B12R1.438 CC(=O)NC1=CC(CN)=CC=C1 D94946 [0,2,0,0,0,0|2,0,0]=4 1653 B12R1.438 CC(=O)OC1=CC(C=O)=CC=C1 A10206 [0,2,0,0,0,0|2,0,0]=4 1654 B12R1.438 COC1=CC=CC(CC(=O)Cl)=C1 D97427 [0,2,0,0,0,0|1,0,0]=3 1655 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 CK2074 [0,2,0,0,0,0|0,0,0]=2 1656 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 34187 [0,2,0,0,0,0|1,0,0]=3 1657 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 64241 [0,2,0,0,0,0|2,0,0]=4 1658 B12R1.438 N#CC1=CC=CC(CC(=O)O)=C1 57322 [0,2,0,0,0,0|0,0,0]=2 1659 B12R1.438 O=C(O)CC1=CC=CC(CBr)=C1 CL8771 [0,2,0,0,0,0|0,0,0]=2 1660 B10R1.66 O=C(O)CCC1=CC=CO1 68597 [0,0,1,1,0,0|1,0,1]=4 1661 B10R1.66 O=C(O)CCC1=CSC=C1 W13262 [0,0,1,1,0,0|1,0,1]=4 1662 B10R1.66 O=C(O)CCN1C=CC=C1 30775 [0,0,1,1,0,0|1,0,1]=4 1663 B10R1.66 O=C(O)\C=C/C1=CC=CS1 A10226 [0,0,1,1,0,0|1,0,1]=4 1664 B10R1.66 O=C(O)\C=C\C1=CC=CO1 75613 [0,0,1,1,0,0|1,0,1]=4 1665 B10R1.66 O=C(O)\C=C\C1=CC=CO1 P20225 [0,0,1,1,0,0|1,0,1]=4 1666 B10R1.66 O=C(O)\C=C\C1=CC=CS1 33961 [0,0,1,1,0,0|1,0,1]=4 1667 B10R1.66 O=C(O)\C=C\C1=COC=C1 32962 [0,0,1,1,0,0|1,0,1]=4 1668 B10R1.66 O=C(O)\C=C\C1=CSC=C1 W11773 [0,0,1,1,0,0|1,0,1]=4 1669 B10R2.6 C1=CC=C(C2CC2)C=C1 59390 [1,0,0,1,0,0|1,0,1]=4 1670 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 AC8296 [1,0,0,1,0,0|0,0,1]=3 1671 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 F20441 [1,0,0,1,0,0|0,0,1]=3 1672 B10R2.7 C1=CC2=C(C=C1)CC=C2 D72500 [1,0,0,1,0,0|1,0,0]=3 1673 B10R2.7 C1=CC2=C(C=C1)CCC2 D97393 [1,0,0,1,0,0|1,0,1]=4 1674 B10R2.7 C1=CC2=C(C=C1)CNC2 62864 [1,0,0,1,0,0|2,0,0]=4 1675 B10R2.7 C1=CC2=C(C=C1)CNC2 SC3601 [1,0,0,1,0,0|2,0,0]=4 1676 B10R2.7 C1=CC2=C(C=C1)COC2 D77530 [1,0,0,1,0,0|2,0,0]=4 1677 B10R2.7 C1=CC2=C(C=C1)NC=N2 D70829 [1,0,0,1,0,0|2,0,0]=4 1678 B10R2.7 C1=CC2=C(C=C1)NCC2 P19974 [1,0,0,1,0,0|1,0,1]=4 1679 B10R2.7 C1=CC2=C(C=C1)OC=N2 H10149 [1,0,0,1,0,0|1,0,0]=3 1680 B10R2.7 C1=CC2=C(C=C1)OCC2 F10902 [1,0,0,1,0,0|0,0,1]=3 1681 B10R2.7 C1=CC2=C(C=C1)OCO2 D70968 [1,0,0,1,0,0|1,0,1]=4 1682 B10R2.7 C1=CC2=C(C=C1)ON=C2 53958 [1,0,0,1,0,0|1,0,1]=4 1683 B10R2.7 C1=CC2=C(C=C1)SC=C2 23043 [1,0,0,1,0,0|0,1,1]=4 1684 B10R2.7 C1=CC2=C(C=C1)SC=N2 D77749 [1,0,0,1,0,0|1,1,0]=4 1685 B10R2.7 C1=CC2=C(N=C1)N=CO2 W17511 [1,0,0,1,0,0|2,0,0]=4 1686 B10R2.320 Br[C@H]1CC2=C1C=CC=C2 67855 [1,0,0,1,0,0|1,0,1]=4 1687 B10R2.320 O[C@H]1CC2=C1C=CC=C2 67860 [1,0,0,1,0,0|0,0,1]=3 1688 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 75897 [0,0,0,1,0,1|1,0,0]=3 1689 B12R2.24 O=C1C=C2C=CC=CC2=CN1 P10536 [0,0,0,1,0,1|1,0,1]=4 1690 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 D81844 [0,0,0,1,0,1|0,0,1]=3 1691 B12R2.24 O=C1C=NC2=C(C=CC=C2)N1 F16123 [0,0,0,1,0,1|1,0,1]=4 1692 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 71053 [0,0,0,1,0,1|1,0,0]=3 1693 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 22566 [0,0,0,1,0,1|1,0,0]=3 1694 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 64816 [0,0,0,1,0,1|1,0,0]=3 1695 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 D70234 [0,0,0,1,0,1|0,0,0]=2 1696 B12R2.24 O=C1CCN2C=CC=CC2=N1 77967 [0,0,0,1,0,1|2,0,0]=4 1697 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 69683 [0,0,0,1,0,1|1,0,0]=3 1698 B12R2.24 O=C1COC2=C(C=CC=C2)N1 64814 [0,0,0,1,0,1|1,0,0]=3 1699 B12R2.24 O=C1COC2=C(C=CC=C2)O1 W17423 [0,0,0,1,0,1|0,0,0]=2 1700 B12R2.24 O=C1COC2=CC=CN=C2N1 30018 [0,0,0,1,0,1|2,0,0]=4 1701 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 Y10089 [0,0,0,1,0,1|1,0,0]=3 1702 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 F19976 [0,0,0,1,0,1|1,0,0]=3 1703 B12R2.24 OC1=CC2=CC=CC=C2C=C1 D86186 [0,0,0,1,0,1|1,0,1]=4 1704 B12R2.24 OC1=CC2=CC=CC=C2C=N1 28407 [0,0,0,1,0,1|1,0,1]=4 1705 B12R2.24 OC1=CC2=CC=CC=C2N=C1 29144 [0,0,0,1,0,1|1,0,1]=4 1706 B12R2.24 OC1=NC2=CC=CC=C2C=C1 70352 [0,0,0,1,0,1|1,0,1]=4 1707 B12R2.24 O[C@H]1CCC2=C(C=CC=C2)C1 94674 [0,0,0,1,0,1|1,0,1]=4 1708 B12R2.2057 C1=CC=C(OC[C@H]2CO2)C=C1 F53321 [0,0,0,1,0,1|1,0,1]=4 1709 B12R2.2403 O=S1(=O)NCC2=C1C=CC=C2 79571 [0,0,0,1,0,1|1,0,1]=4 1710 B12R2.3190 O=C(O)[C@@H]1CC2=C1C=CC=C2 67881 [0,0,0,1,0,1|0,0,0]=2 1711 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 35613 [0,1,0,1,0,0|1,0,0]=3 1712 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 83183 [0,1,0,1,0,0|1,0,0]=3 1713 B12R2.606 CC1=CC2=C(C=C1)NC(=O)N2 F14739 [0,1,0,1,0,0|2,0,0]=4 1714 B12R2.606 CC1=CC2=C(C=C1)OC(C)=N2 F14942 [0,1,0,1,0,0|2,0,0]=4 1715 B12R2.606 CC1=CC2=C(C=C1)OC(N)=N2 C76003 [0,1,0,1,0,0|2,0,0]=4 1716 B12R2.606 CC1=CC2=C(C=C1)OC(S)=N2 71733 [0,1,0,1,0,0|1,1,0]=4 1717 B12R2.606 CC1=NC2=C(C=C(Br)C=C2)O1 23910 [0,1,0,1,0,0|2,0,0]=4 1718 B12R2.606 CC1=NC2=C(C=C(Cl)C=C2)O1 W17337 [0,1,0,1,0,0|2,0,0]=4 1719 B12R2.606 CC1=NC2=C(C=C(N)C=C2)O1 78608 [0,1,0,1,0,0|2,0,0]=4 1720 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 W17196 [0,1,0,1,0,0|2,0,0]=4 1721 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 F13803 [0,1,0,1,0,0|2,0,0]=4 1722 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 F14854 [0,1,0,1,0,0|2,0,0]=4 1723 B12R2.606 CC1=NC2=C(C=CC(F)=C2)O1 W17338 [0,1,0,1,0,0|2,0,0]=4 1724 B12R2.606 ClC1=CC2=C(C=C1)N=C(Cl)O2 AB2806 [0,1,0,1,0,0|2,0,0]=4 1725 B12R2.606 ClC1=CC2=C(C=C1)OC(Cl)=N2 80780 [0,1,0,1,0,0|2,0,0]=4 1726 B12R2.606 FC1=CC2=C(C=C1)OC(S)=N2 F30137 [0,1,0,1,0,0|1,1,0]=4 1727 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 25815 [0,1,0,1,0,0|1,0,0]=3 1728 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 37209 [0,1,0,1,0,0|1,0,0]=3 1729 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 87806 [0,1,0,1,0,0|1,0,0]=3 1730 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 CL3530 [0,1,0,1,0,0|2,0,0]=4 1731 B12R2.606 NC1=CC2=C(C=C1)NC(=O)O2 78816 [0,1,0,1,0,0|1,0,0]=3 1732 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 F15056 [0,1,0,1,0,0|1,1,0]=4 1733 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 30766 [0,1,0,1,0,0|1,0,0]=3 1734 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 30459 [0,1,0,1,0,0|2,0,0]=4 1735 B12R2.606 NC1=NC2=C(C=CC(Br)=C2)O1 29747 [0,1,0,1,0,0|2,0,0]=4 1736 B12R2.606 NC1=NC2=C(C=CC(Cl)=C2)O1 52984 [0,1,0,1,0,0|2,0,0]=4 1737 B12R2.606 NC1=NC2=C(C=CC(F)=C2)O1 P10198 [0,1,0,1,0,0|2,0,0]=4 1738 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 68032 [0,1,0,1,0,0|1,0,0]=3 1739 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 53585 [0,1,0,1,0,0|1,0,0]=3 1740 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 23032 [0,1,0,1,0,0|1,0,0]=3 1741 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 33629 [0,1,0,1,0,0|1,0,0]=3 1742 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 21706 [0,1,0,1,0,0|1,0,0]=3 1743 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 58042 [0,1,0,1,0,0|1,0,0]=3 1744 B12R2.606 O=C1CC2=C(C=CC(Cl)=N2)N1 39136 [0,1,0,1,0,0|2,0,0]=4 1745 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 61060 [0,1,0,1,0,0|1,0,0]=3 1746 B12R2.606 O=C1CC2=C(C=CC(I)=C2)N1 12836 [0,1,0,1,0,0|1,0,0]=3 1747 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 50045 [0,1,0,1,0,0|1,0,0]=3 1748 B12R2.606 O=C1CC2=C(C=CC(O)=C2)O1 TD8103 [0,1,0,1,0,0|0,0,0]=2 1749 B12R2.606 O=C1CC2=CC(Br)=CN=C2N1 24537 [0,1,0,1,0,0|2,0,0]=4 1750 B12R2.606 O=C1CC2=CC(Cl)=CN=C2N1 27131 [0,1,0,1,0,0|2,0,0]=4 1751 B12R2.606 O=C1CC2=NC=C(Br)C=C2N1 82302 [0,1,0,1,0,0|2,0,0]=4 1752 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)N1 34662 [0,1,0,1,0,0|2,0,0]=4 1753 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 20621 [0,1,0,1,0,0|1,0,0]=3 1754 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)S1 34494 [0,1,0,1,0,0|1,1,0]=4 1755 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)N1 24823 [0,1,0,1,0,0|2,0,0]=4 1756 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 D89508 [0,1,0,1,0,0|1,0,0]=3 1757 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)S1 F15047 [0,1,0,1,0,0|1,1,0]=4 1758 B12R2.606 O=C1NC2=C(C=C(F)C=C2)O1 D84609 [0,1,0,1,0,0|1,0,0]=3 1759 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)O1 53496 [0,1,0,1,0,0|1,0,0]=3 1760 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 D78096 [0,1,0,1,0,0|1,0,0]=3 1761 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)S1 F14913 [0,1,0,1,0,0|1,1,0]=4 1762 B12R2.606 O=C1NC2=C(C=CC(F)=C2)O1 71686 [0,1,0,1,0,0|1,0,0]=3 1763 B12R2.606 O=C1NC2=NC=C(Br)C=C2O1 37504 [0,1,0,1,0,0|2,0,0]=4 1764 B12R2.606 O=C1NC2=NC=C(Cl)C=C2O1 S12148 [0,1,0,1,0,0|2,0,0]=4 1765 B12R2.606 O[C@H]1CC2=C(C=C(Br)C=C2)C1 26292 [0,1,0,1,0,0|1,0,1]=4 1766 B12R2.606 SC1=NC2=C(C=C(Cl)C=C2)O1 W10408 [0,1,0,1,0,0|1,1,0]=4 1767 B12R2.606 SC1=NC2=C(C=CC(Br)=C2)O1 35564 [0,1,0,1,0,0|1,1,0]=4 1768 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)O1 58192 [0,1,0,1,0,0|1,1,0]=4 1769 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 79476 [0,1,0,1,0,0|1,0,0]=3 1770 B12R2.18 CN1C(=O)CC2=C1N=CC=C2 P15308 [0,1,0,1,0,0|2,0,0]=4 1771 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 W11509 [0,1,0,1,0,0|2,0,0]=4 1772 B12R2.18 C[C@@H]1C(=O)NC2=C1C=CC=C2 D84199 [0,1,0,1,0,0|1,0,0]=3 1773 B12R2.18 C[C@H]1CC2=C(C=CC=C2)C1=O 75581 [0,1,0,1,0,0|1,0,1]=4 1774 B12R2.18 N[C@@H]1C(=O)NC2=C1C=CC=C2 AT10673 [0,1,0,1,0,0|1,0,0]=3 1775 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O 20134 [0,1,0,1,0,0|1,0,1]=4 1776 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O 20142 [0,1,0,1,0,0|1,0,1]=4 1777 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O P15222 [0,1,0,1,0,0|1,0,1]=4 1778 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O 29193 [0,1,0,1,0,0|0,0,1]=3 1779 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O D70304 [0,1,0,1,0,0|1,0,1]=4 1780 B12R2.18 OC1C2=C(C=CC=C2)CC1Br A10217 [0,1,0,1,0,0|1,0,1]=4 1781 B12R2.18 O[C@@H]1C2=C(C=CC=C2)C[C@H]1Br 31137 [0,1,0,1,0,0|1,0,1]=4 1782 B12R2.32 CSC1=NC2=C(C=CC=C2)O1 23220 [0,1,0,1,0,0|1,1,0]=4 1783 B12R2.32 ClCC1=NC2=C(C=CC=C2)O1 20268 [0,1,0,1,0,0|2,0,0]=4 1784 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 25990 [0,1,0,1,0,0|1,0,1]=4 1785 B12R2.32 NNC1=NC2=C(C=CC=C2)O1 F10429 [0,1,0,1,0,0|2,0,0]=4 1786 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 52682 [0,1,0,1,0,0|1,0,1]=4 1787 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 53682 [0,1,0,1,0,0|0,0,1]=3 1788 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 82463 [0,1,0,1,0,0|0,1,1]=4 1789 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 82999 [0,1,0,1,0,0|2,0,0]=4 1790 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 73938 [0,1,0,1,0,0|1,1,0]=4 1791 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 23861 [0,1,0,1,0,0|1,0,1]=4 1792 B12R2.32 OCC1=CC2=C(C=CC=C2)O1 AB3056 [0,1,0,1,0,0|0,0,2]=4 1793 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 62317 [0,1,0,1,0,0|0,1,1]=4 1794 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 28470 [0,1,0,1,0,0|2,0,0]=4 1795 B12R2.32 OCC1=NC2=C(C=CC=C2)O1 26174 [0,1,0,1,0,0|1,0,1]=4 1796 B12R2.32 OCC1=NC2=C(C=CC=C2)S1 AC2208 [0,1,0,1,0,0|1,1,0]=4 1797 B12R2.32 OCC1CC2=C(C=CC=C2)C1 83148 [0,1,0,1,0,0|1,0,1]=4 1798 B12R2.32 ON=C1CC2=C(C=CC=C2)C1 D86143 [0,1,0,1,0,0|1,0,0]=3 1799 B12R2.202 CC1=CC2=CC=CC(Br)=C2C1 P12786 [0,1,0,1,0,0|2,0,0]=4 1800 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 RB3322 [0,1,0,1,0,0|1,0,0]=3 1801 B12R2.202 CC1=CC=CC2=C1N=C(C)O2 31742 [0,1,0,1,0,0|2,0,0]=4 1802 B12R2.202 CC1=CC=CC2=C1NC(=O)C2 O11661 [0,1,0,1,0,0|1,0,0]=3 1803 B12R2.202 CC1=CC=CC2=C1NC(=O)N2 O11256 [0,1,0,1,0,0|2,0,0]=4 1804 B12R2.202 CC1=NC2=CC=CC(Br)=C2O1 F30149 [0,1,0,1,0,0|2,0,0]=4 1805 B12R2.202 C[C@H]1CC2=CC=CC(N)=C2O1 D82891 [0,1,0,1,0,0|1,0,1]=4 1806 B12R2.202 O=C1CC2=C(Br)C=CC=C2N1 BL002803 [0,1,0,1,0,0|1,0,0]=3 1807 B12R2.202 O=C1CC2=C(Br)C=CN=C2N1 83123 [0,1,0,1,0,0|2,0,0]=4 1808 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 23496 [0,1,0,1,0,0|1,0,0]=3 1809 B12R2.202 O=C1CC2=C(Cl)C=CN=C2N1 27635 [0,1,0,1,0,0|2,0,0]=4 1810 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 84276 [0,1,0,1,0,0|1,0,0]=3 1811 B12R2.202 O=C1CC2=C(I)C=CC=C2N1 82144 [0,1,0,1,0,0|1,0,0]=3 1812 B12R2.202 O=C1CC2=C(I)C=CN=C2N1 P15399 [0,1,0,1,0,0|2,0,0]=4 1813 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 BL006424 [0,1,0,1,0,0|1,0,0]=3 1814 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 33874 [0,1,0,1,0,0|1,0,0]=3 1815 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 61126 [0,1,0,1,0,0|1,0,0]=3 1816 B12R2.202 O=C1NC2=C(F)C=CC=C2O1 P15214 [0,1,0,1,0,0|1,0,0]=3 1817 B12R2.202 O=C1NC2=CC=CC(Cl)=C2S1 O11648 [0,1,0,1,0,0|1,1,0]=4 1818 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 AC1962 [0,1,0,1,0,0|1,1,0]=4 1819 B12R2.202 OC1=NC2=C(C=CC=C2F)S1 F15061 [0,1,0,1,0,0|1,1,0]=4 1820 B8R1.8 OCCC1=CC=CS1 P10012 [1,0,0,0,1,0|1,0,1]=4 1821 B8R1.8 OCCC1=CSC=C1 62948 [1,0,0,0,1,0|1,0,1]=4 1822 B8R1.7 CC(=O)C1=CC=CN1 F14878 [0,0,0,0,2,0|2,0,0]=4 1823 B8R1.7 CC(=O)C1=CC=CO1 55774 [0,0,0,0,2,0|2,0,0]=4 1824 B8R1.7 CC(=O)C1=CC=CS1 W18336 [0,0,0,0,2,0|2,0,0]=4 1825 B8R1.7 CC(=O)C1=CCC=C1 TD8050 [0,0,0,0,2,0|1,0,1]=4 1826 B8R1.7 CC(=O)C1=CNC=C1 30137 [0,0,0,0,2,0|2,0,0]=4 1827 B8R1.7 CC(=O)C1=COC=C1 N12485 [0,0,0,0,2,0|2,0,0]=4 1828 B8R1.7 CC(=O)C1=CSC=C1 50448 [0,0,0,0,2,0|2,0,0]=4 1829 B8R1.7 CC(C)=C1C=CC=C1 A10651 [0,0,0,0,2,0|2,0,0]=4 1830 B8R1.7 NC(=O)C1=CC=CN1 D83540 [0,0,0,0,2,0|2,0,0]=4 1831 B8R1.7 NC(=O)C1=CC=CO1 A51100 [0,0,0,0,2,0|2,0,0]=4 1832 B8R1.7 NC(=O)C1=CC=CS1 D85795 [0,0,0,0,2,0|2,0,0]=4 1833 B8R1.7 O=C(Cl)C1=CC=CS1 D78154 [0,0,0,0,2,0|2,0,0]=4 1834 B8R1.7 O=C(O)C1=CC=CN1 33105 [0,0,0,0,2,0|1,0,0]=3 1835 B8R1.7 O=C(O)C1=CC=CS1 D70571 [0,0,0,0,2,0|1,0,0]=3 1836 B8R1.7 O=C(O)C1=CC=NO1 28558 [0,0,0,0,2,0|2,0,0]=4 1837 B8R1.7 O=C(O)C1=CC=NS1 62856 [0,0,0,0,2,0|2,0,0]=4 1838 B8R1.7 O=C(O)C1=CCC=C1 36684 [0,0,0,0,2,0|0,0,1]=3 1839 B8R1.7 O=C(O)C1=CN=CO1 80167 [0,0,0,0,2,0|2,0,0]=4 1840 B8R1.7 O=C(O)C1=CN=CS1 69866 [0,0,0,0,2,0|2,0,0]=4 1841 B8R1.7 O=C(O)C1=CNC=C1 65414 [0,0,0,0,2,0|1,0,0]=3 1842 B8R1.7 O=C(O)C1=CNC=N1 69188 [0,0,0,0,2,0|2,0,0]=4 1843 B8R1.7 O=C(O)C1=CNN=C1 65412 [0,0,0,0,2,0|2,0,0]=4 1844 B8R1.7 O=C(O)C1=COC=C1 83420 [0,0,0,0,2,0|1,0,0]=3 1845 B8R1.7 O=C(O)C1=COC=N1 64870 [0,0,0,0,2,0|2,0,0]=4 1846 B8R1.7 O=C(O)C1=CON=C1 25393 [0,0,0,0,2,0|2,0,0]=4 1847 B8R1.7 O=C(O)C1=CSC=C1 P17867 [0,0,0,0,2,0|1,0,0]=3 1848 B8R1.7 O=C(O)C1=CSC=N1 83445 [0,0,0,0,2,0|2,0,0]=4 1849 B8R1.7 O=C(O)C1=NC=CN1 CL2211 [0,0,0,0,2,0|2,0,0]=4 1850 B8R1.7 O=C(O)C1=NC=CS1 29143 [0,0,0,0,2,0|2,0,0]=4 1851 B8R1.7 O=C(O)C1=NNC=C1 CL3512 [0,0,0,0,2,0|2,0,0]=4 1852 B8R1.7 O=C(O)C1=NOC=C1 24572 [0,0,0,0,2,0|2,0,0]=4 1853 B8R1.7 O=C(O)[C-]1C=CC=C1 D77984 [0,0,0,0,2,0|0,0,1]=3 1854 B8R1.7 O=C([O-])C1=CC=CS1 F16481 [0,0,0,0,2,0|1,0,1]=4 1855 B8R1.7 O=C([O-])C1=CC=CS1 H10133 [0,0,0,0,2,0|1,0,1]=4 1856 B12R1.252 CC(=O)COCC1=CC=CC=C1 11068 [0,0,0,0,0,2|1,0,0]=3 1857 B12R1.252 CC(=O)NCCC1=CC=CC=C1 28552 [0,0,0,0,0,2|1,0,0]=3 1858 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 A11414 [0,0,0,0,0,2|1,0,1]=4 1859 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 A11416 [0,0,0,0,0,2|1,0,1]=4 1860 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 C72530 [0,0,0,0,0,2|1,0,1]=4 1861 B12R1.252 NC(=S)NCCC1=CC=CC=C1 D85871 [0,0,0,0,0,2|1,1,0]=4 1862 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 FD7227 [0,0,0,0,0,2|1,0,0]=3 1863 B12R1.252 O=C(O)CCCC1=CC=CC=C1 CX1106 [0,0,0,0,0,2|0,0,0]=2 1864 B12R1.252 O=C(O)CCNC1=CC=CC=C1 30827 [0,0,0,0,0,2|0,0,0]=2 1865 B12R1.252 O=C(O)CCOC1=CC=CC=C1 11256 [0,0,0,0,0,2|0,0,0]=2 1866 B12R1.252 O=C(O)CCSC1=CC=CC=C1 D94986 [0,0,0,0,0,2|0,0,0]=2 1867 B12R1.252 O=C(O)CNCC1=CC=CC=C1 26468 [0,0,0,0,0,2|0,0,0]=2 1868 B12R1.252 O=C(O)CNCC1=CC=CC=C1 AB6138 [0,0,0,0,0,2|0,0,0]=2 1869 B12R1.252 O=C(O)COCC1=CC=CC=C1 53674 [0,0,0,0,0,2|0,0,0]=2 1870 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 F14822 [0,0,0,0,0,2|0,0,0]=2 1871 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 F14969 [0,0,0,0,0,2|0,0,1]=3