0 B10R1.1 C=CCC1=CC=C(O)C=C1 AC1877 [0,0,0,0,0,0|1,0,2]=3 1 B10R1.1 CC1=CC=C(CNN)C=C1 O10109 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.1 CC1=NC=C(CCO)C=C1 54746 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.1 CCNC1=CC=C(F)C=C1 AB11321 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CCOC1=CN=C(Br)C=N1 52691 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.1 CCOC1=CN=C(Br)N=C1 38793 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.1 CCOC1=NC=C(Cl)C=C1 F52729 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.1 CCSC1=CC=C(C)C=C1 H10147 [0,0,0,0,0,0|1,1,0]=2 8 B10R1.1 CNCC1=CC=C(O)C=C1 31972 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.1 COCC1=CC=C(O)C=C1 63646 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.1 CSCC1=CC=C(Br)C=C1 W19176 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.1 CSCC1=CC=C(C)C=C1 W19462 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.1 CSCC1=CC=C(F)C=C1 W18716 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.1 NCCC1=CN=C(Cl)C=C1 85004 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.1 NNCC1=CC=C(F)C=C1 36999 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.1 NOCC1=CC=C(Cl)C=C1 78769 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.1 O=CCC1=CC=C(Cl)C=C1 74968 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.1 OCCC1=NC=C(Br)C=C1 37598 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.1 OCCC1=NC=C(F)C=C1 P18353 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.1 BrCC1=NC=C(Br)C=C1 28859 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 C#CC1=CC=C(I)C=C1 F21257 [1,0,0,0,0,0|1,0,2]=4 21 B9R1.1 C#CC1=CN=C(O)C=C1 O11429 [1,0,0,0,0,0|1,0,2]=4 22 B9R1.1 CC1=CN=C(CCl)C=C1 A10650 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.1 CC1=CN=C(CCl)C=C1 C16351 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 CC1=NC=C(CCl)C=C1 CL0057 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 CC1=NC=C(CN)C=C1 72232 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 CCC1=CN=C(Br)C=C1 CS1557 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.1 CCC1=CN=C(Cl)C=C1 72594 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.1 CCC1=CN=C(N)C=N1 27455 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.1 CCC1=CN=C(O)C=C1 25325 [1,0,0,0,0,0|1,0,0]=2 30 B9R1.1 CCC1=NC=C(Br)C=C1 26547 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.1 CCC1=NC=C(Br)C=N1 27600 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.1 CCC1=NC=C(Cl)C=C1 C71513 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.1 CCC1=NC=C(N)C=C1 C72111 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.1 CCC1=NC=C(N)C=N1 81903 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.1 CCC1=NN=C(Cl)C=C1 59639 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.1 CCC1=NNC(=O)C=C1 65671 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.1 CNC1=CC=C(O)C=C1 D77985 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.1 CNC1=CN=C(Br)C=C1 D86940 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 CNC1=CN=C(C)C=C1 D83365 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 CNC1=NC=C(N)C=C1 C74450 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 COC1=CN=C(F)C=C1 98092 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.1 COC1=CN=C(N)N=C1 11206 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 COC1=NC=C(I)C=N1 W11580 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 COC1=NC=C(N)C=N1 35336 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 COC1=NC=C(N)N=C1 24331 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.1 COC1=NC=C(O)C=N1 C16680 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.1 COC1=NN=C(I)C=C1 C15088 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 ClCC1=CC=C(I)C=C1 AB8901 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.1 ClCC1=CN=C(Br)C=C1 C71417 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 ClCC1=CN=C(Br)C=C1 C73235 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.1 ClCC1=NC=C(Br)C=C1 12269 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 ClCC1=NC=C(Br)C=C1 C77222 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.1 FCC1=CC=C(Br)C=C1 W10394 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.1 N#CC1=CC=C(S)C=C1 F31167 [1,0,0,0,0,0|1,1,1]=4 55 B9R1.1 N#CC1=NC=C(O)C=C1 24955 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.1 NCC1=CC=C(O)C=C1 AC1832 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.1 NCC1=CN=C(Br)C=C1 68600 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 NCC1=CN=C(N)C=C1 F13784 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 NCC1=CN=C(N)C=C1 P19117 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 NCC1=NC=C(Br)C=C1 32062 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 NCC1=NC=C(Cl)C=C1 W13681 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.1 NCC1=NC=C(F)C=C1 70856 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 NCC1=NC=C(N)C=C1 O11499 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 NCC1=NC=C(N)C=C1 W11510 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.1 NCC1=NC=C(O)C=C1 24338 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.1 OC1=CN=C(CF)N=C1 72904 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 OCC1=CC=C(S)C=C1 Y11017 [1,0,0,0,0,0|1,1,0]=3 68 B9R1.8 BrC#CC1=CC=CC=C1 A51120 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.8 BrCCC1=CC=NC=C1 C71689 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.8 CCNC1=CC=CN=C1 C15578 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.8 CNCC1=CC=NC=C1 AR1712 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.8 ClCCC1=CC=NC=C1 O11064 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 C11398 [1,0,0,0,0,0|2,0,1]=4 76 B11R1.1 C#CCOC1=CC=C(Cl)C=C1 W16039 [0,1,0,0,0,0|1,0,1]=3 77 B11R1.1 C=CCCC1=CC=C(Br)C=C1 VT1222 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.1 C=CCCC1=CC=C(O)C=C1 AC1840 [0,1,0,0,0,0|1,0,1]=3 79 B11R1.1 CC1=NC=C(CCCN)C=C1 73040 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.1 CCNCC1=CC=C(C)C=C1 78307 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.1 CCNCC1=CC=C(N)C=C1 AC1810 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.1 CCNCC1=CC=C(O)C=C1 31967 [0,1,0,0,0,0|1,0,0]=2 83 B11R1.1 CCNCC1=CN=C(Cl)C=C1 F11983 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.1 CCOCC1=CC=C(Br)C=C1 W19177 [0,1,0,0,0,0|1,0,0]=2 85 B11R1.1 CCOCC1=CC=C(O)C=C1 27758 [0,1,0,0,0,0|0,0,0]=1 86 B11R1.1 CCOCC1=CN=C(Cl)C=C1 D73333 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.1 CNCCC1=CC=C(N)C=C1 76010 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 C72197 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.1 FC1=CC=C(CCCBr)C=C1 AB8466 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.1 FC1=CC=C(CCCI)C=C1 AC3098 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.1 N#CCCC1=CC=C(Br)C=C1 O10869 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.1 NCCCC1=CC=C(F)C=C1 C72058 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.1 NCCNC1=NC=C(Br)C=C1 52009 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.1 O=CCCC1=CC=C(Br)C=C1 29444 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 AB6893 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.1 O=CCCC1=CC=C(O)C=C1 F19751 [0,1,0,0,0,0|1,0,1]=3 97 B11R1.1 OCCNC1=NC=C(F)C=C1 W16644 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.1 OCCOC1=CC=C(Br)C=C1 AC1411 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.1 OC\C=C\C1=CC=C(O)C=C1 A11786 [0,1,0,0,0,0|1,0,1]=3 100 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 C73008 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.20 CC(C)NC1=CC=C(F)C=C1 22289 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 C71698 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.20 CC(C)OC1=NC=C(N)C=C1 P18240 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.20 CC(C)OC1=NN=C(Cl)C=C1 AT23121 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.20 CC(C)OC1=NN=C(I)C=C1 C73322 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.20 CC(C)SC1=CC=C(Br)C=C1 AT20955 [0,1,0,0,0,0|1,1,0]=3 108 B11R1.20 CC(C)SC1=NC=C(Br)C=C1 F20124 [0,1,0,0,0,0|2,1,0]=4 109 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N10874 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.20 CC1=CN=C(OC(C)C)C=C1 W12584 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 84989 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y14838 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11301 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N11302 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11173 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 Y11623 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 84990 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 C75202 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.20 FC(F)OC1=CN=C(Cl)C=C1 33633 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.20 FC(F)OC1=NC=C(Br)C=C1 W11456 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.20 NC1=CN=C(OC(F)F)C=C1 92022 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 D93745 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 D81498 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N10531 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11058 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 N11096 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y10547 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 Y13360 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.22 CCC(=O)C1=CN=C(Cl)C=C1 F13171 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.22 CCC(=O)C1=NC=C(Br)C=C1 N14256 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.22 CCC(=O)C1=NC=C(Cl)C=C1 D81575 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 F16933 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10949 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N10950 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 N12584 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 Y10817 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10160 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 Y10161 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 D81275 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 S11131 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y11768 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10163 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10164 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y10653 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11063 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 Y11174 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14552 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.22 CC[C@H](N)C1=CC=C(I)C=C1 Y14553 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.22 CC[C@H](N)C1=CC=C(O)C=C1 N12238 [0,1,0,0,0,0|1,0,0]=2 150 B11R1.22 CC[C@H](O)C1=CC=C(Br)C=C1 AB6446 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 D83483 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 29238 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 N10761 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 Y10719 [0,1,0,0,0,0|3,0,0]=4 155 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16874 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 F16927 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10862 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y10897 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.22 CN[C@@H](C)C1=CC=C(F)C=C1 N13109 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.22 COC(=O)C1=CC=C(S)C=C1 W12575 [0,1,0,0,0,0|2,1,0]=4 161 B11R1.22 C[C@@H](CN)C1=CC=C(Br)C=C1 84993 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.22 NC[C@H](O)C1=CC=C(Cl)C=C1 C78214 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 D83092 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11041 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11043 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 I11713 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 Y11114 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10527 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N10528 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10651 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 Y10776 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 F16942 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11004 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11005 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 I11499 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 Y10343 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 N10665 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12067 [0,1,0,0,0,0|3,0,0]=4 179 B11R1.22 N[C@@H](CO)C1=CC=C(I)C=C1 Y12960 [0,1,0,0,0,0|3,0,0]=4 180 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10690 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y10915 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 Y11472 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.22 N\C(=N/O)C1=CC=C(O)C=C1 60210 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 77934 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 27936 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 11739 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.81 CCCC1=C(O)C=C(O)C=C1 C73634 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.81 CCOC1=C(C)N=C(N)C=C1 O11421 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C75445 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.81 CCOC1=C(Cl)N=C(Cl)N=C1 I10147 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.81 CCOC1=C(F)C=C(N)C=N1 26695 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.81 CCOC1=C(F)C=C(O)C=C1 36938 [0,1,0,0,0,0|0,0,0]=1 193 B11R1.81 COCC1=C(Br)C=C(F)C=C1 N11828 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.81 COCC1=C(F)C=C(N)C=C1 I10129 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.81 COCC1=C(N)C=C(Br)C=C1 CL9392 [0,1,0,0,0,0|3,0,0]=4 196 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 O10665 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 C77752 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.81 OCCC1=C(Cl)C=C(Br)C=C1 F50644 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CL8845 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.83 C=COC1=CC=C(CO)C=C1 D80867 [0,1,0,0,0,0|0,0,2]=3 201 B11R1.83 CCCC1=CC=C(CN)C=C1 35547 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.83 CCCC1=CC=C(CN)C=C1 Y14555 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.83 CCOC1=NC=C(CCl)C=C1 AB10985 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.83 CCOC1=NC=C(CO)C=C1 20990 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.83 CNC1=CC=C(CCO)C=C1 AB11620 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.83 CNCC1=CC=C(C#N)C=C1 C74766 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.83 COC1=CC=C(CC=O)C=C1 F11615 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.83 COC1=CC=C(CSC)C=C1 W18269 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.83 COC1=NC=C(CCN)C=C1 72625 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.83 N#CC1=CC=C(CCBr)C=C1 26978 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.83 N#CC1=CC=C(CCO)C=C1 30197 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.83 NCCC1=CC=C(C=O)C=C1 51618 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.83 O=CC1=CC=C(CCO)C=C1 CK2095 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.83 OCCC1=CC=C(CO)C=C1 D82395 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.192 CC1=C(Br)C=CC(CCN)=C1 AB8409 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 A12131 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.192 CCNC1=CC(Cl)=C(Cl)C=C1 AB1379 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.192 CCOC1=CC(F)=C(N)C=C1 A12546 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.192 CCOC1=NC(N)=C(F)C=N1 24975 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.192 CNCC1=CC(F)=C(F)C=C1 36786 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.192 CNCC1=CC(O)=C(O)C=C1 31716 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.192 COCC1=CC(Br)=C(F)C=C1 N10448 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.192 COCC1=CC(N)=C(Br)C=C1 CL9396 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.192 N#CCC1=CC(O)=C(O)C=C1 D82364 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.192 NCCC1=CC(F)=C(Cl)C=C1 D79909 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.192 OCCC1=CC(F)=C(F)C=C1 CL9076 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.192 OCCC1=CC(O)=C(O)C=C1 68063 [0,1,0,0,0,0|2,0,0]=3 228 B9R0.48 CCOC(=O)\C=C\B(O)O A51290 [0,0,1,0,0,0|3,0,0]=4 229 B9R0.48 CCOC(=O)\C=C\C(C)=O 71109 [0,0,1,0,0,0|1,0,2]=4 230 B11R2.34 BrC1=CN=C(C2CC2)C=C1 82181 [0,0,0,1,0,0|3,0,0]=4 231 B11R2.34 BrC1=NC=C(C2CC2)C=C1 81857 [0,0,0,1,0,0|3,0,0]=4 232 B11R2.34 ClC1=NC=C(C2CC2)C=C1 81869 [0,0,0,1,0,0|3,0,0]=4 233 B11R2.34 NC1=CC=C(C2CC2)C=C1 26267 [0,0,0,1,0,0|2,0,0]=3 234 B11R2.34 NC1=CC=C(C2CC2)C=C1 33400 [0,0,0,1,0,0|2,0,0]=3 235 B11R2.34 NC1=CN=C(C2CC2)C=C1 C71516 [0,0,0,1,0,0|3,0,0]=4 236 B11R2.34 NC1=NC=C(C2CC2)C=C1 94373 [0,0,0,1,0,0|3,0,0]=4 237 B11R2.34 OC1=NC=C(C2CC2)C=C1 C71515 [0,0,0,1,0,0|2,0,0]=3 238 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Y10449 [0,0,0,1,0,0|2,0,0]=3 239 B11R2.36 BrC1=CC2=C(C=C1)CCN2 73495 [0,0,0,1,0,0|3,0,0]=4 240 B11R2.36 BrC1=CC2=C(C=C1)COC2 71931 [0,0,0,1,0,0|3,0,0]=4 241 B11R2.36 BrC1=CC2=C(C=C1)ON=C2 25694 [0,0,0,1,0,0|2,0,1]=4 242 B11R2.36 BrC1=CN=C2CCCC2=C1 81986 [0,0,0,1,0,0|3,0,0]=4 243 B11R2.36 BrC1=NC2=C(C=C1)NCC2 C72057 [0,0,0,1,0,0|3,0,0]=4 244 B11R2.36 CC1=CC2=C(C=C1)CCC2 Y11729 [0,0,0,1,0,0|2,0,0]=3 245 B11R2.36 ClC1=CC2=C(C=C1)CCC2 N12723 [0,0,0,1,0,0|2,0,0]=3 246 B11R2.36 ClC1=CC2=C(C=C1)CCN2 F11859 [0,0,0,1,0,0|3,0,0]=4 247 B11R2.36 ClC1=CC2=C(C=C1)CNC2 AB6849 [0,0,0,1,0,0|3,0,0]=4 248 B11R2.36 ClC1=CC2=C(C=C1)OCC2 W17536 [0,0,0,1,0,0|1,0,0]=2 249 B11R2.36 ClC1=CC2=C(C=C1)ON=C2 D78570 [0,0,0,1,0,0|2,0,1]=4 250 B11R2.36 ClC1=CC2=C(C=CC2)C=C1 F13902 [0,0,0,1,0,0|2,0,1]=4 251 B11R2.36 ClC1=CN=C2NCCC2=C1 C71466 [0,0,0,1,0,0|3,0,0]=4 252 B11R2.36 ClC1=NC=C2NCCC2=C1 F18600 [0,0,0,1,0,0|3,0,0]=4 253 B11R2.36 FC1=CC2=C(C=C1)CCN2 F21334 [0,0,0,1,0,0|3,0,0]=4 254 B11R2.36 FC1=CC2=C(C=C1)CCO2 Y13232 [0,0,0,1,0,0|3,0,0]=4 255 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F30233 [0,0,0,1,0,0|1,0,2]=4 256 B11R2.36 FC1=CC2=C(C=C1)OCO2 AC4347 [0,0,0,1,0,0|2,0,0]=3 257 B11R2.36 FC1=CN=C2NCCC2=C1 P20984 [0,0,0,1,0,0|3,0,0]=4 258 B11R2.36 IC1=CC2=C(C=C1)ON=C2 C77293 [0,0,0,1,0,0|2,0,1]=4 259 B11R2.36 NC1=CC2=C(C=C1)CCO2 F12399 [0,0,0,1,0,0|3,0,0]=4 260 B11R2.36 NC1=CC2=C(C=C1)CNC2 AB9521 [0,0,0,1,0,0|3,0,0]=4 261 B11R2.36 NC1=CC2=C(C=C1)OCO2 D97371 [0,0,0,1,0,0|2,0,0]=3 262 B11R2.36 O=C1C=CC2=C(CCC2)N1 83506 [0,0,0,1,0,0|2,0,1]=4 263 B11R2.36 OC1=CC2=C(C=C1)C=NO2 24777 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.36 OC1=CC2=C(C=C1)CCN2 C75271 [0,0,0,1,0,0|2,0,0]=3 265 B11R2.36 OC1=CC2=C(C=C1)CCO2 27138 [0,0,0,1,0,0|2,0,0]=3 266 B11R2.36 OC1=CC2=C(C=C1)CNC2 20927 [0,0,0,1,0,0|2,0,0]=3 267 B11R2.36 OC1=CC2=C(C=C1)CNC2 52281 [0,0,0,1,0,0|2,0,0]=3 268 B11R2.36 OC1=CC2=C(C=C1)CNC2 52301 [0,0,0,1,0,0|2,0,0]=3 269 B11R2.36 OC1=CC2=C(C=C1)N=CO2 D77541 [0,0,0,1,0,0|2,0,1]=4 270 B11R2.36 OC1=CC2=C(C=C1)OC=N2 AC4843 [0,0,0,1,0,0|1,0,1]=3 271 B11R2.36 OC1=CC2=C(C=C1)OCC2 24188 [0,0,0,1,0,0|0,0,0]=1 272 B11R2.36 OC1=CC2=C(C=C1)SC=C2 59802 [0,0,0,1,0,0|0,1,2]=4 273 B11R2.36 OC1=CC2=C(C=C1)SC=N2 C76461 [0,0,0,1,0,0|1,1,1]=4 274 B11R2.36 OC1=CC2=C(C=CO2)C=C1 84605 [0,0,0,1,0,0|2,0,1]=4 275 B9R1.7 CCOC1=CC(=O)CC1 W16153 [0,0,0,0,1,0|0,0,3]=4 276 B9R1.7 CCOC1=CC(N)=NO1 31468 [0,0,0,0,1,0|3,0,0]=4 277 B9R1.7 CCO[C@@H]1C=CC(=O)O1 91454 [0,0,0,0,1,0|1,0,2]=4 278 B8R1.2 CCC1=NC=NC=C1 F17281 [2,0,0,0,0,0|2,0,0]=4 279 B8R1.2 COC1=NC=NC=C1 T72699 [2,0,0,0,0,0|2,0,0]=4 280 B8R1.2 NCC1=CC=CC=C1 RB3068 [2,0,0,0,0,0|1,0,0]=3 281 B8R1.2 NCC1=CC=NC=C1 35876 [2,0,0,0,0,0|2,0,0]=4 282 B8R1.2 SCC1=CC=NC=C1 F18336 [2,0,0,0,0,0|2,0,0]=4 283 B8R1.2 SCC1=CN=CC=C1 F18343 [2,0,0,0,0,0|2,0,0]=4 284 B8R1.2 SCC1=NC=CC=C1 Y10072 [2,0,0,0,0,0|2,0,0]=4 285 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [2,0,0,0,0,0|1,0,1]=4 286 B8R1.3 CC1=CN=C(O)C=N1 84954 [2,0,0,0,0,0|2,0,0]=4 287 B8R1.3 CC1=NC=C(I)C=C1 C10582 [2,0,0,0,0,0|2,0,0]=4 288 B8R1.3 CC1=NC=C(O)C=N1 25911 [2,0,0,0,0,0|2,0,0]=4 289 B8R1.3 NC1=CC=C(O)C=C1 C75965 [2,0,0,0,0,0|1,0,0]=3 290 B8R1.3 NC1=NC=C(O)C=C1 BL008086 [2,0,0,0,0,0|2,0,0]=4 291 B8R1.3 SC1=CC=C(I)C=C1 F20637 [2,0,0,0,0,0|1,1,0]=4 292 B10R1.3 C#CC1=CC=C(CBr)C=C1 79956 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.3 C#CC1=CC=C(CCl)C=C1 79958 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.3 C#CC1=NC=C(OC)C=C1 D84302 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.3 C=CC1=CC=C(CO)C=C1 F14590 [1,1,0,0,0,0|0,0,2]=4 296 B10R1.3 CNC1=CC=C(C=O)C=C1 D93507 [1,1,0,0,0,0|1,0,1]=4 297 B10R1.3 CNC1=CC=C(CO)C=C1 20987 [1,1,0,0,0,0|1,0,0]=3 298 B10R1.3 COC1=CN=C(CBr)C=C1 O10508 [1,1,0,0,0,0|2,0,0]=4 299 B10R1.3 COC1=CN=C(CCl)C=C1 81763 [1,1,0,0,0,0|2,0,0]=4 300 B10R1.3 COC1=CN=C(CN)C=C1 AC7188 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.3 COC1=CN=C(CO)N=C1 F30447 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.3 COC1=NC=C(CCl)C=C1 82159 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.3 COC1=NC=C(CN)C=C1 C73256 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.3 COC1=NC=C(CO)C=N1 P11192 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.3 COC1=NC=C(CO)N=C1 F30445 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.3 COC1=NC=C(NN)C=C1 F13050 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.3 COC1=NN=C(CO)C=C1 P11745 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.3 COC1=NN=C(OC)C=C1 C75238 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.3 CSC1=CC=C(NN)C=C1 79686 [1,1,0,0,0,0|1,1,0]=4 310 B10R1.3 NCC1=CC=C(CBr)C=C1 54465 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.3 NCC1=CC=C(CCl)C=C1 51899 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.3 O=CC1=CC=C(CCl)C=C1 CL9238 [1,1,0,0,0,0|1,0,1]=4 313 B10R1.3 SCC1=CC=C(CS)C=C1 T70041 [1,1,0,0,0,0|1,1,0]=4 314 B10R1.13 C=C(C)C1=CC=C(I)C=C1 AC1339 [1,1,0,0,0,0|1,0,1]=4 315 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 AC7918 [1,1,0,0,0,0|1,0,1]=4 316 B10R1.13 CC(=O)C1=NC=C(O)C=C1 53717 [1,1,0,0,0,0|1,0,1]=4 317 B10R1.13 CC(C)C1=CC=C(O)C=C1 D72532 [1,1,0,0,0,0|0,0,0]=2 318 B10R1.13 CC(C)C1=NC=C(Br)C=C1 C71514 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.13 CC(C)C1=NC=C(N)C=C1 D81293 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.13 CC(C)C1=NC=C(N)C=C1 RB1132 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 20068 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 Y14023 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 W19044 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 T73083 [1,1,0,0,0,0|1,1,0]=4 325 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10810 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.13 CC1=CN=C([C@H](C)O)C=C1 AB7629 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 F16847 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 Y11095 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.13 CN(N)C1=CC=C(Br)C=C1 E10129 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.13 C[C@H](Cl)C1=CC=C(F)C=C1 AC6174 [1,1,0,0,0,0|1,0,0]=3 331 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 C16655 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10310 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 Y10311 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20069 [1,1,0,0,0,0|1,0,0]=3 335 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 20071 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 O11060 [1,1,0,0,0,0|1,0,0]=3 337 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11752 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 Y11753 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y10879 [1,1,0,0,0,0|0,0,0]=2 340 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 Y14795 [1,1,0,0,0,0|0,0,0]=2 341 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 81501 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11108 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 N11223 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 66671 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74099 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 74101 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 81462 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D82399 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 N11298 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y11564 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N13196 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 Y12226 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90530 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F17006 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 N11135 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y10461 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y11597 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 Y13385 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1272 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 SC1278 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 25877 [1,1,0,0,0,0|0,0,0]=2 362 B10R1.13 C[C@H](O)C1=CN=C(Br)C=C1 AT11876 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Y13723 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.13 C[C@H](O)C1=NC=C(O)C=N1 W17842 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.13 FC(F)C1=CC=C(I)C=C1 C71790 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.13 OC1=CN=C(C(F)F)C=C1 D92853 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 93716 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 AB10222 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.25 CC1=C(CF)C=CC(Br)=C1 C73525 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.25 CC1=C(CN)C=CC(Br)=C1 C71550 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.25 CC1=C(CO)C=CC(N)=C1 F19834 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.25 CC1=CC(Br)=C(CN)C=C1 W19042 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.25 CC1=CC(C)=C(CBr)C=C1 24686 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 N12896 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.25 CCC1=C(Br)C=C(N)C=C1 27953 [1,1,0,0,0,0|1,0,0]=3 376 B10R1.25 CCC1=C(Br)C=C(O)C=C1 Y11628 [1,1,0,0,0,0|0,0,0]=2 377 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 W17033 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.25 CCC1=C(F)C=C(Br)C=C1 D82415 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.25 CCC1=C(F)C=C(O)C=C1 C11362 [1,1,0,0,0,0|0,0,0]=2 380 B10R1.25 CCC1=C(N)C=C(Br)C=C1 C72839 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C74962 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.25 CCN1C=CC(Br)=CC1=O P13647 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.25 CNC1=C(Br)C=C(F)C=C1 71883 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.25 CNC1=C(C)C=C(O)C=C1 C16321 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 S10226 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.25 COC1=C(C)C=C(O)C=C1 95659 [1,1,0,0,0,0|0,0,0]=2 388 B10R1.25 COC1=C(C)N=C(Br)C=C1 W15448 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C71882 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 COC1=C(Cl)C=C(I)C=C1 F15482 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.25 COC1=C(Cl)C=C(N)N=C1 37736 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.25 COC1=C(Cl)N=C(I)C=C1 72074 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.25 COC1=C(F)C=C(N)C=N1 27254 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.25 COC1=C(F)N=C(Br)C=C1 CS1206 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.25 COC1=C(I)C=C(Br)C=N1 C75707 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.25 COC1=C(I)C=C(Cl)N=C1 S10146 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.25 COC1=C(N)N=C(C)C=C1 84162 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.25 COC1=C(N)N=C(F)C=C1 D70935 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.25 COC1=CC=C(Br)N=C1Br 79976 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.25 COC1=CC=C(C)N=C1Cl C73850 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.25 COC1=CC=C(C)N=C1I F30133 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.25 COC1=CC=C(Cl)N=C1Br C72025 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.25 COC1=CC=C(Cl)N=C1Cl 81824 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.25 COC1=CC=C(Cl)N=C1I 82334 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.25 COC1=CC=C(N)N=C1Cl F19661 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.25 COC1=CN=C(Br)C=C1Cl F16734 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.25 COC1=CN=C(Br)C=C1N AC1554 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.25 COC1=CN=C(Br)C=C1O AT23971 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.25 COC1=CN=C(Cl)C=C1N C71879 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.25 COC1=CNC(=O)C=C1Br W15670 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.25 COC1=NC=C(Cl)C=C1N E70381 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.25 COC1=NC=C(F)C=C1C C76918 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.25 COC1=NC=C(F)C=C1N C71761 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.25 COC1=NC=C(F)C=C1O S10276 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.25 CSC1=C(Br)C=C(F)C=C1 69928 [1,1,0,0,0,0|1,1,0]=4 416 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 Y11168 [1,1,0,0,0,0|1,1,0]=4 417 B10R1.25 CSC1=C(F)C=C(N)C=C1 94984 [1,1,0,0,0,0|1,1,0]=4 418 B10R1.25 FC1=C(CBr)C=CC(I)=C1 55991 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.25 FC1=CC(I)=C(CBr)C=C1 56051 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.25 N#CC1=C(Br)C=C(O)C=C1 AC6875 [1,1,0,0,0,0|1,0,1]=4 421 B10R1.25 N#CC1=C(O)C=C(O)C=C1 C76016 [1,1,0,0,0,0|1,0,1]=4 422 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 C73878 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11612 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.25 NCC1=C(Cl)C=C(Br)C=C1 Y12485 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14725 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.25 NCC1=C(O)C=C(Br)C=C1 N13143 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.25 OCC1=C(Br)C=C(O)C=C1 98273 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 CL9122 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 95677 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.25 OCC1=C(O)C=C(Br)C=C1 35526 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 C76015 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.176 C=CC1=CC(I)=C(O)C=C1 D94289 [1,1,0,0,0,0|0,0,2]=4 433 B10R1.176 CC1=C(Br)C=CC(CN)=C1 N12558 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.176 CC1=C(Br)C=CC(CN)=C1 Y12257 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.176 CC1=C(F)C=CC(CBr)=C1 D87871 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.176 CC1=C(O)C=CC(C#N)=C1 O11240 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14331 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.176 CC1=C(O)C=CC(CO)=C1 C73536 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.176 CCC1=CC(Br)=C(C)C=C1 D93128 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.176 CCC1=CC(Br)=C(I)C=C1 Y11303 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.176 CCC1=CC(C)=C(C)C=C1 C77212 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.176 CCC1=CC(C)=C(I)C=C1 W17700 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.176 CCC1=CC(F)=C(N)C=C1 N13141 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.176 CCC1=CC(N)=C(N)C=C1 76101 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 O10732 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 C72403 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.176 COC1=CC(=O)N(C)C=C1 79097 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.176 COC1=CC(Br)=C(C)C=N1 P20929 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.176 COC1=CC(Br)=C(C)N=C1 P12000 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.176 COC1=CC(Br)=C(Cl)C=N1 C71758 [1,1,0,0,0,0|2,0,0]=4 451 B10R1.176 COC1=CC(Br)=C(Cl)N=C1 C14046 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.176 COC1=CC(Br)=C(F)C=N1 F12224 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.176 COC1=CC(Cl)=C(Br)C=N1 25841 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.176 COC1=CC(Cl)=C(I)C=C1 D72033 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.176 COC1=CC(Cl)=C(I)C=N1 W10502 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.176 COC1=CC(F)=C(N)C=N1 D94273 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.176 COC1=CC(F)=C(N)N=C1 C71770 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.176 COC1=CC(I)=C(Cl)C=N1 S10269 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.176 COC1=CC(I)=C(F)C=N1 22601 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.176 COC1=CC(O)=C(F)C=N1 79067 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.176 COC1=CC(O)=C(N)C=C1 20700 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.176 COC1=CC(O)=C(O)C=C1 F18177 [1,1,0,0,0,0|0,0,0]=2 463 B10R1.176 COC1=CC=C(Br)C(Br)=N1 S10112 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 C76674 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.176 COC1=CN=C(Br)C(F)=C1 D83224 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.176 COC1=CN=C(Br)C(N)=C1 24981 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C76383 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.176 COC1=NC(Cl)=C(Br)C=C1 C76489 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.176 COC1=NC(F)=C(Br)C=C1 S10193 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.176 COC1=NC(N)=C(Br)C=C1 C75397 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.176 COC1=NC(N)=C(Cl)C=C1 O10989 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.176 COC1=NC=C(C)C(N)=C1 C72054 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.176 COC1=NC=C(N)C(N)=C1 29189 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.176 ClC1=C(Br)C=CC(CBr)=C1 76034 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.176 FC1=C(I)C=CC(CBr)=C1 CL9459 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.176 NC1=C(F)C=C(CO)C=C1 74966 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.176 NC1=C(O)C=CC(CO)=C1 Y13579 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.176 NCC1=CC(F)=C(Br)C=C1 95673 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.176 NCC1=CC(F)=C(Br)C=C1 CS1629 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.176 NCC1=CC(F)=C(N)C=C1 C90556 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.176 NCC1=CC(O)=C(Cl)C=C1 Y11334 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.176 NCC1=CC(O)=C(F)C=C1 D71055 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.176 NCC1=CC(O)=C(O)C=C1 S11863 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.176 OC1=C(F)C=CC(CCl)=C1 D79295 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.176 OCC1=CC(O)=C(F)C=C1 C77207 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.4 CCNC1=C(N)C=NC=C1 W19029 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.4 CCNC1=C(O)C=CC=C1 I11473 [1,1,0,0,0,0|1,0,0]=3 489 B10R1.4 CCNC1=CC=CN=C1N P19791 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.4 CCOC1=C(N)C=CN=C1 79299 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.4 CCOC1=CC=CN=C1F AC1769 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.4 CCOC1=CC=CNC1=O N13107 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.4 CCOC1=NC=CC=C1O 79061 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.4 CCOC1=NC=CN=C1N 25986 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.4 CCOC1=NC=NC=C1N C75583 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.4 COCC1=C(O)C=CC=C1 AC1453 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.4 NCCC1=C(O)C=CC=C1 83456 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.4 [BH3-]C1=C(CNC)C=CC=C1 AC8598 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.10 CC#CC1=CC=CC(Br)=C1 Y10633 [1,1,0,0,0,0|1,0,1]=4 500 B10R1.10 CC1=CC=CC(CCCl)=C1 C74996 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.10 CCCC1=CC=CC(Br)=C1 W17019 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.10 CCCC1=CC=CC(N)=C1 S11405 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.10 CCNC1=CC=CC(F)=C1 AB11320 [1,1,0,0,0,0|1,0,0]=3 504 B10R1.10 CCNC1=CC=CC(O)=C1 T71675 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.10 CCOC1=CC(Br)=NC=C1 C73290 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.10 CCOC1=CC(Cl)=NC=C1 AC1568 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.10 CCOC1=CC(Cl)=NN=C1 C77015 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.10 CCOC1=CC=NC(Cl)=N1 A11250 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.10 CCOC1=NC(C)=CN=C1 C75488 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.10 CCOC1=NC(N)=CC=C1 78558 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.10 CCOC1=NC(N)=CC=N1 70347 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.10 CCOC1=NC=CC(Cl)=C1 26911 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.10 CNCC1=CC(C)=CC=C1 C78188 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.10 CSCC1=CC(F)=CC=C1 A12575 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.10 CSCC1=CC=CC(Br)=C1 W10420 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.10 CSCC1=CC=CC(Cl)=C1 W19463 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.10 NCCC1=CC=CC(N)=C1 51444 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.15 CC[C@H](Br)C1=CC=CC=C1 A11640 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.15 CC[C@H](N)C1=CC=CN=C1 31586 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.15 CC[C@H](N)C1=CC=CN=C1 74009 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.15 CC[C@H](N)C1=CC=NC=C1 31287 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74015 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.15 CC[C@H](N)C1=CC=NC=C1 74017 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.15 CC[C@H](N)C1=CC=NC=C1 D81379 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.15 CC[C@H](N)C1=NC=CC=C1 F16910 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.15 CC[C@H](N)C1=NC=CC=C1 I11245 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10610 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11176 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y11466 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.15 CC[C@H](N)C1=NC=CC=C1 Y12115 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T71858 [1,1,0,0,0,0|1,0,0]=3 535 B10R1.15 CC[C@H](O)C1=CC=CC=C1 T72707 [1,1,0,0,0,0|1,0,0]=3 536 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 32835 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.15 NC[C@H](N)C1=CC=CC=C1 N12631 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.15 O[C@@H](CF)C1=CC=CC=C1 C91661 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.17 CCCCC1=CC=NC=C1 BL000376 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.17 CCCOC1=CC=CC=C1 C75927 [1,1,0,0,0,0|0,0,0]=2 541 B10R1.17 CCNCC1=CC=CC=C1 D77748 [1,1,0,0,0,0|1,0,0]=3 542 B10R1.17 CNCCC1=CC=CN=C1 AR1271 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.17 CNNCC1=CC=CC=C1 30192 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.17 ICCCC1=CC=CC=C1 AC6098 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.17 NCC#CC1=CC=CC=C1 AB10164 [1,1,0,0,0,0|1,0,1]=4 546 B10R1.17 NCCCC1=CC=CN=C1 31799 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.17 NCCCC1=CC=NC=C1 S12068 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.17 NCCOC1=CC=NC=C1 F31099 [1,1,0,0,0,0|1,0,0]=3 549 B10R1.17 NCCOC1=CC=NC=C1 Y10522 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.17 OCCOC1=CN=CC=C1 D86242 [1,1,0,0,0,0|1,0,0]=3 551 B10R1.17 SCCCC1=CC=NC=C1 F18251 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 50056 [1,1,0,0,0,0|1,0,1]=4 553 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.18 C[C@H](N)CC1=NC=CC=C1 C80024 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.18 FC(F)SC1=CC=CC=C1 I11988 [1,1,0,0,0,0|1,1,0]=4 556 B12R1.1 CCCCCC1=CC=C(F)C=C1 A11207 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.1 CCCCOC1=CN=C(Br)C=C1 A12893 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.1 COCCOC1=CC=C(O)C=C1 27038 [0,2,0,0,0,0|0,0,0]=2 559 B12R1.1 FC1=CC=C(CCCCCl)C=C1 C13856 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.1 FC1=CC=C(OCCCCl)C=C1 D77782 [0,2,0,0,0,0|1,0,0]=3 561 B12R1.1 N#CCCOC1=CC=C(Cl)C=C1 AC8492 [0,2,0,0,0,0|1,0,0]=3 562 B12R1.1 NCCCCC1=CC=C(Cl)C=C1 VT1079 [0,2,0,0,0,0|2,0,0]=4 563 B12R1.1 NCCCCC1=CC=C(O)C=C1 P16850 [0,2,0,0,0,0|1,0,0]=3 564 B12R1.1 OCCCOC1=CC=C(Br)C=C1 88164 [0,2,0,0,0,0|1,0,0]=3 565 B12R1.1 OCCNCC1=CC=C(F)C=C1 C80019 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 D77805 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.16 CC1=CC=C([C@@H](N)CCO)C=C1 66824 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 N13972 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.16 CCC[C@H](N)C1=CC=C(C)C=C1 Y11987 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.16 CCC[C@H](N)C1=CC=C(C)C=C1 Y14024 [0,2,0,0,0,0|2,0,0]=4 571 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 Y10286 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 D77688 [0,2,0,0,0,0|1,0,0]=3 573 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 AB21610 [0,2,0,0,0,0|1,0,1]=4 574 B12R1.16 CCOC(=O)C1=CN=C(F)C=C1 88966 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=C1 C72155 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.16 CCOC(=O)C1=NC=C(N)C=C1 D86980 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.16 CNC[C@H](O)C1=CC=C(O)C=C1 42875 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.16 COC[C@H](N)C1=CC=C(Cl)C=C1 D81217 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.16 NC1=CC=C([C@@H](N)CCO)C=C1 11356 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.16 N[C@@H](CCO)C1=CC=C(Br)C=C1 55910 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 58176 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 58178 [0,2,0,0,0,0|2,0,0]=4 583 B12R1.16 N[C@@H](CCO)C1=CC=C(F)C=C1 61118 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.16 O[C@@H](CCCl)C1=CC=C(F)C=C1 Y10754 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.21 CC(=O)CCC1=CC=C(F)C=C1 D71139 [0,2,0,0,0,0|2,0,0]=4 586 B12R1.21 CC(C)OCC1=CC=C(Br)C=C1 N10192 [0,2,0,0,0,0|1,0,0]=3 587 B12R1.21 CC1=CC=C(OC[C@H](C)N)C=C1 F50498 [0,2,0,0,0,0|1,0,0]=3 588 B12R1.21 NC(=S)COC1=CC=C(Br)C=C1 W19015 [0,2,0,0,0,0|1,0,1]=4 589 B12R1.49 CC1=CC=C(O[C@@H](C)CN)C=C1 AR3806 [0,2,0,0,0,0|1,0,0]=3 590 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 79685 [0,2,0,0,0,0|2,0,0]=4 591 B12R1.49 CCC(=O)CC1=CC=C(C)C=C1 N12572 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 N14142 [0,2,0,0,0,0|2,0,0]=4 593 B12R1.49 CCC(=O)OC1=CC=C(O)C=C1 C11963 [0,2,0,0,0,0|0,0,0]=2 594 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 AR3803 [0,2,0,0,0,0|1,0,0]=3 595 B12R1.49 C[C@@H](CN)OC1=CC=C(F)C=C1 AR3971 [0,2,0,0,0,0|1,0,0]=3 596 B12R1.49 NC1=CC=C(C[C@H](N)CO)C=C1 Y11490 [0,2,0,0,0,0|2,0,0]=4 597 B12R1.49 N[C@H](CO)CC1=CC=C(Br)C=C1 C78431 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.49 N[C@H](CO)CC1=CC=C(Cl)C=C1 32524 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.49 N[C@H](CO)CC1=CC=C(Cl)C=C1 N10806 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.49 N[C@H](CO)CC1=CC=C(Cl)C=C1 N11400 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 N11305 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 N11306 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 Y11195 [0,2,0,0,0,0|2,0,0]=4 604 B12R1.49 O=C(CCl)NC1=CC=C(O)C=C1 69837 [0,2,0,0,0,0|1,0,1]=4 605 B12R1.69 CC1=CC(N)=C(CCCO)C=C1 W12077 [0,2,0,0,0,0|2,0,0]=4 606 B12R1.69 COCOC1=C(Br)C=C(C)C=C1 C71191 [0,2,0,0,0,0|1,0,0]=3 607 B12R1.69 ClCCOC1=C(Cl)C=C(Br)C=C1 W16058 [0,2,0,0,0,0|1,0,0]=3 608 B12R1.69 FC1=CC(F)=C(OCCBr)C=C1 W16558 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.69 OCCNC1=C(F)C=C(F)C=C1 D95134 [0,2,0,0,0,0|2,0,0]=4 610 B12R1.71 C=CC1=CC=C(CCCN)C=C1 W17096 [0,2,0,0,0,0|2,0,0]=4 611 B12R1.71 COC1=CC=C(CCCBr)C=C1 C78319 [0,2,0,0,0,0|1,0,0]=3 612 B12R1.71 COC1=CC=C(OCCBr)C=C1 F30177 [0,2,0,0,0,0|0,0,0]=2 613 B12R1.71 CSC1=CC=C(OCCN)C=C1 31479 [0,2,0,0,0,0|0,1,0]=3 614 B12R1.71 N#CC1=CC=C(OCCN)C=C1 32298 [0,2,0,0,0,0|1,0,0]=3 615 B12R1.71 O=CC1=CC=C(OCCBr)C=C1 AC1815 [0,2,0,0,0,0|0,0,1]=3 616 B12R1.385 CC1=C(Br)C=C(SCCO)C=C1 79550 [0,2,0,0,0,0|1,1,0]=4 617 B12R1.385 CCCOC1=CC(N)=C(N)C=C1 79315 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.385 CCNCC1=CC(O)=C(O)C=C1 32542 [0,2,0,0,0,0|1,0,0]=3 619 B12R1.4 CC(C)NC1=CC=C(C#N)C=C1 W15912 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 N12164 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.4 CC(C)OC1=NC=C(C#N)C=C1 F31166 [0,2,0,0,0,0|2,0,0]=4 622 B12R1.4 COC1=CC=C(C[C@H](C)N)C=C1 F13064 [0,2,0,0,0,0|1,0,0]=3 623 B12R1.4 COC1=CC=C(OC(C)=O)C=C1 C11131 [0,2,0,0,0,0|0,0,1]=3 624 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 W16241 [0,2,0,0,0,0|1,0,1]=4 625 B12R1.19 CC(=O)NC1=CC(C)=C(O)C=C1 C73156 [0,2,0,0,0,0|1,0,1]=4 626 B12R1.19 CC(=O)NC1=CC(N)=C(O)C=C1 W13329 [0,2,0,0,0,0|1,0,1]=4 627 B12R1.19 CC1=C(N)C=C(OC(C)C)C=C1 W11212 [0,2,0,0,0,0|1,0,0]=3 628 B12R1.19 CC1=C(N)C=CC(OC(C)C)=C1 W16012 [0,2,0,0,0,0|1,0,0]=3 629 B12R1.19 FC(F)OC1=CC(Cl)=C(Br)C=C1 F18882 [0,2,0,0,0,0|2,0,0]=4 630 B12R1.20 CC(C)C(=O)C1=CC=C(O)C=C1 D76549 [0,2,0,0,0,0|1,0,0]=3 631 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 F16981 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 Y11062 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 Y14022 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.20 CC(C)[C@H](N)C1=CC=C(Cl)C=C1 F31299 [0,2,0,0,0,0|2,0,0]=4 635 B12R1.20 CC(C)[C@H](N)C1=CC=C(Cl)C=C1 N12762 [0,2,0,0,0,0|2,0,0]=4 636 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 Y10284 [0,2,0,0,0,0|2,0,0]=4 637 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 Y10285 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.20 CC1=CC=C(C(=O)C(C)C)C=C1 N13973 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.20 CC1=CC=C([C@@H](N)C(C)C)C=C1 Y11241 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.20 CC1=CC=C([C@@H](N)C(C)C)C=C1 Y11242 [0,2,0,0,0,0|2,0,0]=4 641 B12R1.20 C[C@H](Br)C(=O)C1=CC=C(Cl)C=C1 W12152 [0,2,0,0,0,0|2,0,0]=4 642 B12R1.20 C[C@H](Br)C(=O)C1=CC=C(O)C=C1 25133 [0,2,0,0,0,0|1,0,0]=3 643 B12R1.106 CC(C)(N)CC1=CC=C(Br)C=C1 85007 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.106 CC1=CC=C(OC(C)(C)C)C=C1 CK2379 [0,2,0,0,0,0|1,0,0]=3 645 B12R1.106 O=P([O-])([O-])OC1=CC=C(O)C=C1 C73842 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.233 CC(C)OC1=C(F)C=C(N)C=C1 24274 [0,2,0,0,0,0|1,0,0]=3 647 B12R1.233 CC(C)OC1=C(N)C=C(Br)C=C1 C90902 [0,2,0,0,0,0|1,0,0]=3 648 B12R1.233 CC1=CC(Br)=C(OC(C)C)N=C1 C76432 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.233 FC(F)OC1=C(Br)C=C(Br)C=C1 F18972 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.233 FC(F)OC1=C(Br)C=C(Cl)C=C1 75448 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.233 FC1=C(OC(F)F)C=CC(Br)=C1 CK2371 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.233 FC1=C(OC(F)F)C=CC(I)=C1 F19063 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.233 FC1=CC(Br)=C(OC(F)F)C=C1 79362 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.233 NC1=CC(F)=C(OC(F)F)C=C1 W17704 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.233 OC1=CC(F)=C(OC(F)F)C=C1 89603 [0,2,0,0,0,0|1,0,0]=3 656 B12R1.5 C=CC1=CC=C([C@@H](N)CC)C=C1 Y12655 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.5 C=CC1=CC=C([C@@H](N)CC)C=C1 Y13063 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.5 C=CC1=CC=C([C@@H](N)CC)C=C1 Y13303 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 N10942 [0,2,0,0,0,0|1,0,0]=3 660 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 Y10277 [0,2,0,0,0,0|1,0,0]=3 661 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 Y10898 [0,2,0,0,0,0|1,0,0]=3 662 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 C74747 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 N10529 [0,2,0,0,0,0|2,0,0]=4 664 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 N11095 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 Y10338 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 Y10646 [0,2,0,0,0,0|2,0,0]=4 667 B12R1.9 CC[S@](=N)(=O)C1=CC=C(Br)C=C1 W10956 [0,2,0,0,0,0|1,1,0]=4 668 B12R1.367 CCC(=O)C1=CC(C)=C(F)C=C1 N14308 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.367 CCC(=O)C1=CC(F)=C(C)C=C1 N14054 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.367 CC[C@H](N)C1=CC(C)=C(Br)C=C1 Y13259 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.367 CC[C@H](N)C1=CC(C)=C(Br)C=C1 Y13282 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.367 CC[C@H](N)C1=CC(C)=C(C)C=C1 N11061 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.367 CC[C@H](N)C1=CC(F)=C(C)C=C1 N12884 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.367 CC[C@H](N)C1=CC(F)=C(Cl)C=C1 Y11975 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.367 CC[C@H](N)C1=CC(F)=C(Cl)C=C1 Y11976 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.367 CC[C@H](N)C1=CC(F)=C(Cl)C=C1 Y12956 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 Y10297 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 Y10298 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 Y11774 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 Y11775 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 Y13035 [0,2,0,0,0,0|2,0,0]=4 682 B12R1.367 NCC(=O)C1=CC(O)=C(O)C=C1 A11075 [0,2,0,0,0,0|2,0,0]=4 683 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 A12589 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Cl)C=C1 T70851 [0,2,0,0,0,0|2,0,0]=4 685 B12R1.1703 CCC(=O)C1=C(F)C=C(Cl)C=C1 55949 [0,2,0,0,0,0|2,0,0]=4 686 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 Y10891 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 Y11488 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 N11313 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 Y11983 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.1703 CC[C@H](N)C1=C(C)C=C(F)C=C1 Y11984 [0,2,0,0,0,0|2,0,0]=4 691 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 F21058 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 Y10296 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 Y11754 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.1703 COC(=O)C1=C(Br)C=C(O)C=C1 C90903 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12208 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.1703 N[C@@H](CO)C1=C(Cl)C=C(O)C=C1 Y12209 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 T70646 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.112 CCOC1=C(C#N)C=C(Br)C=C1 W18844 [0,2,0,0,0,0|1,0,0]=3 699 B12R1.112 CCOC1=NC=C(Br)C=C1OC C71954 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.114 CCOC1=C(Cl)C=C(C#N)C=C1 AB8875 [0,2,0,0,0,0|1,0,0]=3 701 B12R1.114 CCOC1=C(F)C=C(C=O)C=C1 F30104 [0,2,0,0,0,0|0,0,1]=3 702 B12R1.114 COC1=CC(F)=C(CCN)C=C1 F20047 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.1123 NCCC1=CC(O)=C(O)C=C1O 73849 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.113 CCOC1=CC=C(C(N)=S)C=C1 76923 [0,2,0,0,0,0|0,1,0]=3 705 B12R1.113 CCOC1=CC=C([C@H](C)O)C=C1 A12294 [0,2,0,0,0,0|0,0,0]=2 706 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 C77361 [0,2,0,0,0,0|1,0,0]=3 707 B12R1.113 CCOC1=CN=C(C(=O)O)C=N1 36273 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.113 CCOC1=NC=C(B(O)O)C=N1 O10047 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.113 CNCC1=CC=C(B(O)O)C=C1 I12448 [0,2,0,0,0,0|2,0,0]=4 710 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 C75240 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.116 CCOC1=CC=C(OCC)C=C1 D76500 [0,2,0,0,0,0|0,0,0]=2 712 B12R1.288 CCOC1=CC(F)=C(CO)C=C1 D83523 [0,2,0,0,0,0|0,0,0]=2 713 B12R1.288 CCOC1=CC(O)=C(C=O)C=C1 11674 [0,2,0,0,0,0|0,0,1]=3 714 B10R1.2 CCC1=CC=CC(O)=C1O C77203 [0,0,1,1,0,0|2,0,0]=4 715 B10R2.31 NC1=CC2=C(C=C1)CC2 67858 [1,0,0,1,0,0|1,0,0]=3 716 B10R2.31 NC1=CC2=C(C=C1)CC2 D83029 [1,0,0,1,0,0|1,0,0]=3 717 B10R2.7 C1=CC2=C(C=N1)CCN2 86683 [1,0,0,1,0,0|2,0,0]=4 718 B10R2.7 C1=CC2=C(C=N1)NCC2 A10607 [1,0,0,1,0,0|2,0,0]=4 719 B10R2.7 C1=CC2=C(C=N1)NCC2 C73056 [1,0,0,1,0,0|2,0,0]=4 720 B10R2.7 C1=CN=C2CCNC2=C1 70854 [1,0,0,1,0,0|2,0,0]=4 721 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 I11495 [0,1,0,1,0,0|2,0,0]=4 722 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 O11641 [0,1,0,1,0,0|2,0,0]=4 723 B12R2.24 BrC1=CC2=C(C=C1)COCC2 72150 [0,1,0,1,0,0|1,0,0]=3 724 B12R2.24 BrC1=CC2=C(C=C1)NCCN2 AT11557 [0,1,0,1,0,0|2,0,0]=4 725 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 25915 [0,1,0,1,0,0|2,0,0]=4 726 B12R2.24 BrC1=CC2=C(C=C1)OCC=C2 Y12222 [0,1,0,1,0,0|1,0,1]=4 727 B12R2.24 BrC1=CN=C2OCCNC2=C1 F30181 [0,1,0,1,0,0|2,0,0]=4 728 B12R2.24 BrC1=CN=C2OCCOC2=C1 F14749 [0,1,0,1,0,0|2,0,0]=4 729 B12R2.24 CC1=CC2=C(C=C1)CCCC2 I10992 [0,1,0,1,0,0|2,0,0]=4 730 B12R2.24 CC1=CC2=C(C=C1)CCCN2 26368 [0,1,0,1,0,0|2,0,0]=4 731 B12R2.24 CC1=CC2=C(C=C1)CCCN2 H11139 [0,1,0,1,0,0|2,0,0]=4 732 B12R2.24 CC1=CC2=C(C=C1)CCCO2 Y13225 [0,1,0,1,0,0|2,0,0]=4 733 B12R2.24 CC1=CC2=C(C=C1)CCOC2 N14607 [0,1,0,1,0,0|2,0,0]=4 734 B12R2.24 CC1=CC2=C(C=C1)NCCN2 D78710 [0,1,0,1,0,0|2,0,0]=4 735 B12R2.24 CC1=CC2=C(C=C1)NCCS2 72217 [0,1,0,1,0,0|2,0,0]=4 736 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 N11405 [0,1,0,1,0,0|2,0,0]=4 737 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C10821 [0,1,0,1,0,0|2,0,0]=4 738 B12R2.24 ClC1=CC2=C(C=C1)CCCO2 Y13230 [0,1,0,1,0,0|2,0,0]=4 739 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 28104 [0,1,0,1,0,0|2,0,0]=4 740 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 O11644 [0,1,0,1,0,0|2,0,0]=4 741 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 83052 [0,1,0,1,0,0|2,0,0]=4 742 B12R2.24 ClC1=CC2=C(C=C1)NCCO2 27238 [0,1,0,1,0,0|2,0,0]=4 743 B12R2.24 ClC1=CC2=C(C=C1)OCCC2 N11282 [0,1,0,1,0,0|1,0,0]=3 744 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 VT1094 [0,1,0,1,0,0|1,0,0]=3 745 B12R2.24 ClC1=NC2=C(C=C1)OCCN2 84509 [0,1,0,1,0,0|2,0,0]=4 746 B12R2.24 FC1=CC2=C(C=C1)CCCC2 N10855 [0,1,0,1,0,0|2,0,0]=4 747 B12R2.24 FC1=CC2=C(C=C1)CCCN2 N12847 [0,1,0,1,0,0|2,0,0]=4 748 B12R2.24 FC1=CC2=C(C=C1)CCCO2 Y13024 [0,1,0,1,0,0|2,0,0]=4 749 B12R2.24 FC1=CC2=C(C=C1)OCCC2 Y11947 [0,1,0,1,0,0|1,0,0]=3 750 B12R2.24 FC1=CC2=C(C=C1)OCCN2 C71739 [0,1,0,1,0,0|1,0,0]=3 751 B12R2.24 IC1=CC2=C(C=C1)OCCC2 32826 [0,1,0,1,0,0|1,0,0]=3 752 B12R2.24 NC1=CC2=C(C=C1)CCCN2 F21389 [0,1,0,1,0,0|2,0,0]=4 753 B12R2.24 NC1=CC2=C(C=C1)CCCO2 Y13028 [0,1,0,1,0,0|2,0,0]=4 754 B12R2.24 NC1=CC2=C(C=C1)CCNC2 F19187 [0,1,0,1,0,0|2,0,0]=4 755 B12R2.24 NC1=CC2=C(C=C1)CNCC2 51458 [0,1,0,1,0,0|2,0,0]=4 756 B12R2.24 NC1=CC2=C(C=C1)CNCC2 52057 [0,1,0,1,0,0|2,0,0]=4 757 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y12467 [0,1,0,1,0,0|1,0,0]=3 758 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Y13365 [0,1,0,1,0,0|1,0,0]=3 759 B12R2.24 NC1=CC2=C(C=C1)OCCN2 P16924 [0,1,0,1,0,0|1,0,0]=3 760 B12R2.24 OC1=CC2=C(C=C1)CCCO2 Y11632 [0,1,0,1,0,0|1,0,0]=3 761 B12R2.24 OC1=CC2=C(C=C1)CCNC2 S11181 [0,1,0,1,0,0|1,0,0]=3 762 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Y13231 [0,1,0,1,0,0|1,0,0]=3 763 B12R2.24 OC1=CC2=C(C=C1)COCC2 N13209 [0,1,0,1,0,0|0,0,0]=2 764 B12R2.24 OC1=CC2=C(C=C1)NCCO2 P16674 [0,1,0,1,0,0|1,0,0]=3 765 B12R2.24 OC1=CC2=C(C=C1)OCCC2 N12986 [0,1,0,1,0,0|0,0,0]=2 766 B12R2.24 OC1=CC2=C(C=C1)OCCN2 C74348 [0,1,0,1,0,0|0,0,0]=2 767 B12R2.24 OC1=CN=C2CCNCC2=C1 S11487 [0,1,0,1,0,0|2,0,0]=4 768 B12R2.24 OC1=CN=C2CCNCC2=C1 SC1341 [0,1,0,1,0,0|2,0,0]=4 769 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 F31086 [0,1,0,1,0,0|2,0,0]=4 770 B12R2.79 NC1CC1C2=CC=C(F)C=C2 F31089 [0,1,0,1,0,0|2,0,0]=4 771 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 F31004 [0,1,0,1,0,0|2,0,0]=4 772 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 F31006 [0,1,0,1,0,0|2,0,0]=4 773 B12R2.132 CC1=C2C=C(Cl)C=CC2=NO1 C75084 [0,1,0,1,0,0|1,0,1]=4 774 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N N10991 [0,1,0,1,0,0|2,0,0]=4 775 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N Y12626 [0,1,0,1,0,0|2,0,0]=4 776 B12R2.132 CC1=CC2=C(C=C1)OCC2=O N12808 [0,1,0,1,0,0|1,0,1]=4 777 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 27530 [0,1,0,1,0,0|1,0,1]=4 778 B12R2.132 CN1N=CC2=C1C=C(O)C=C2 78492 [0,1,0,1,0,0|2,0,0]=4 779 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 71649 [0,1,0,1,0,0|2,0,0]=4 780 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 N10744 [0,1,0,1,0,0|2,0,0]=4 781 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 P10462 [0,1,0,1,0,0|2,0,0]=4 782 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 P10463 [0,1,0,1,0,0|2,0,0]=4 783 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 Y11201 [0,1,0,1,0,0|2,0,0]=4 784 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 Y12017 [0,1,0,1,0,0|2,0,0]=4 785 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 N13065 [0,1,0,1,0,0|2,0,0]=4 786 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 Y11815 [0,1,0,1,0,0|2,0,0]=4 787 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F16923 [0,1,0,1,0,0|2,0,0]=4 788 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 I11030 [0,1,0,1,0,0|2,0,0]=4 789 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 Y10106 [0,1,0,1,0,0|2,0,0]=4 790 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 Y10313 [0,1,0,1,0,0|2,0,0]=4 791 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 P15824 [0,1,0,1,0,0|1,0,0]=3 792 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 Y10912 [0,1,0,1,0,0|1,0,0]=3 793 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 Y14813 [0,1,0,1,0,0|1,0,0]=3 794 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N10934 [0,1,0,1,0,0|1,0,0]=3 795 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 24739 [0,1,0,1,0,0|1,0,1]=4 796 B12R2.132 O=C1COC2=C1C=C(O)C=C2 P16901 [0,1,0,1,0,0|0,0,1]=3 797 B12R2.132 OB1OCC2=C1C=C(O)C=C2 F12770 [0,1,0,1,0,0|2,0,0]=4 798 B12R2.132 O[C@H]1CCC2=C1C=C(Br)C=C2 N10435 [0,1,0,1,0,0|2,0,0]=4 799 B12R2.132 O[C@H]1CCC2=C1C=C(Cl)C=C2 53581 [0,1,0,1,0,0|2,0,0]=4 800 B12R2.132 O[C@H]1CCC2=C1C=C(F)C=C2 N13071 [0,1,0,1,0,0|2,0,0]=4 801 B12R2.294 BrC1=NC=C(OC2CC2)C=C1 80013 [0,1,0,1,0,0|2,0,0]=4 802 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 F52110 [0,1,0,1,0,0|2,0,0]=4 803 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 85616 [0,1,0,1,0,0|2,0,0]=4 804 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 84084 [0,1,0,1,0,0|2,0,0]=4 805 B12R2.2302 NC1=CC=C(C2COC2)C=C1 85368 [0,1,0,1,0,0|2,0,0]=4 806 B12R2.606 CC1=CC2=C(C=C(O)C=C2)O1 F21500 [0,1,0,1,0,0|1,0,1]=4 807 B12R2.606 CC1=CC2=C(C=C1)N[C@@H](C)C2 D78738 [0,1,0,1,0,0|2,0,0]=4 808 B12R2.606 CC1=NC2=C(C=CC(N)=C2)O1 78609 [0,1,0,1,0,0|1,0,1]=4 809 B12R2.606 CC1=NC2=C(C=CC(O)=C2)N1 C75100 [0,1,0,1,0,0|1,0,1]=4 810 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 I10199 [0,1,0,1,0,0|0,0,1]=3 811 B12R2.606 CN1C=C2C=C(O)C=CC2=N1 D83262 [0,1,0,1,0,0|2,0,0]=4 812 B12R2.606 C[C@H]1CC2=C(C=CC(Br)=C2)O1 72190 [0,1,0,1,0,0|1,0,0]=3 813 B12R2.606 C[C@H]1CC2=C(C=CC(F)=C2)N1 C76645 [0,1,0,1,0,0|2,0,0]=4 814 B12R2.606 NC1=CC2=C(C=C1)OC(=O)C2 D82169 [0,1,0,1,0,0|1,0,1]=4 815 B12R2.606 N[C@H]1CC2=C(C=C(Br)C=C2)C1 AT10840 [0,1,0,1,0,0|2,0,0]=4 816 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)O1 D78722 [0,1,0,1,0,0|1,0,1]=4 817 B12R2.606 O=C1NC2=C(C=CC(O)=C2)O1 D83229 [0,1,0,1,0,0|1,0,1]=4 818 B12R2.290 CC1(C2=CC=C(Br)C=C2)CC1 D85572 [0,1,0,1,0,0|2,0,0]=4 819 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 28804 [0,1,0,1,0,0|2,0,0]=4 820 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 29864 [0,1,0,1,0,0|2,0,0]=4 821 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 E10027 [0,1,0,1,0,0|2,0,0]=4 822 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10990 [0,1,0,1,0,0|2,0,0]=4 823 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N12981 [0,1,0,1,0,0|2,0,0]=4 824 B12R2.612 CC1=CC2=C(C=C1)[C@@H](O)CC2 72141 [0,1,0,1,0,0|2,0,0]=4 825 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 67300 [0,1,0,1,0,0|2,0,0]=4 826 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 67303 [0,1,0,1,0,0|2,0,0]=4 827 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 N11203 [0,1,0,1,0,0|2,0,0]=4 828 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 O10181 [0,1,0,1,0,0|2,0,0]=4 829 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 Y10109 [0,1,0,1,0,0|2,0,0]=4 830 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 N12837 [0,1,0,1,0,0|2,0,0]=4 831 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 Y10880 [0,1,0,1,0,0|2,0,0]=4 832 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 Y10881 [0,1,0,1,0,0|2,0,0]=4 833 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 Y10918 [0,1,0,1,0,0|2,0,0]=4 834 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 Y10919 [0,1,0,1,0,0|2,0,0]=4 835 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11253 [0,1,0,1,0,0|2,0,0]=4 836 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11814 [0,1,0,1,0,0|2,0,0]=4 837 B12R2.612 N[C@H]1CCC2=C1C=CC(O)=C2 Y11929 [0,1,0,1,0,0|1,0,0]=3 838 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 78363 [0,1,0,1,0,0|2,0,0]=4 839 B12R2.612 OB1OCC2=C1C=CC(O)=C2 P15896 [0,1,0,1,0,0|2,0,0]=4 840 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 67299 [0,1,0,1,0,0|2,0,0]=4 841 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 67301 [0,1,0,1,0,0|2,0,0]=4 842 B12R2.246 CC1=CC(N)=C2CCCC2=C1 Y11353 [0,1,0,1,0,0|2,0,0]=4 843 B12R2.246 CC1=CC(N)=C2CCCC2=C1 Y11354 [0,1,0,1,0,0|2,0,0]=4 844 B12R2.246 CC1=CC(N)=C2NCCC2=C1 P19646 [0,1,0,1,0,0|2,0,0]=4 845 B12R2.246 NC1=C2NCCC2=CC(F)=C1 P19647 [0,1,0,1,0,0|2,0,0]=4 846 B12R2.246 OC1=CC(O)=NC2=C1CCC2 SC2081 [0,1,0,1,0,0|2,0,0]=4 847 B12R2.1317 CC1=C(C2CC2)C=CC(N)=C1 33444 [0,1,0,1,0,0|2,0,0]=4 848 B12R2.1317 OC1=CC(Cl)=C(C2CC2)N=C1 68803 [0,1,0,1,0,0|2,0,0]=4 849 B12R2.9 N#CC1=CC=C(C2CC2)C=C1 51708 [0,1,0,1,0,0|2,0,0]=4 850 B12R2.9 NCC1=CC=C(C2CC2)C=C1 70989 [0,1,0,1,0,0|2,0,0]=4 851 B12R2.9 OCC1=CC=C(C2CC2)C=C1 51967 [0,1,0,1,0,0|1,0,0]=3 852 B12R2.44 C#CC1=CC2=C(C=C1)OCO2 S12364 [0,1,0,1,0,0|2,0,0]=4 853 B12R2.44 C=CC1=CC2=C(C=C1)OCO2 S11942 [0,1,0,1,0,0|2,0,0]=4 854 B12R2.44 COC1=CC2=C(C=C1)CCN2 Y10745 [0,1,0,1,0,0|2,0,0]=4 855 B12R2.44 COC1=CC2=C(C=C1)CNC2 64065 [0,1,0,1,0,0|2,0,0]=4 856 B12R2.44 COC1=CC2=C(C=C1)OC=C2 85079 [0,1,0,1,0,0|0,0,2]=4 857 B12R2.44 COC1=CC2=C(C=C1)OC=N2 AC3817 [0,1,0,1,0,0|1,0,1]=4 858 B12R2.44 COC1=CN=C2NCCC2=C1 P20217 [0,1,0,1,0,0|2,0,0]=4 859 B12R2.44 COC1=NC=C2NCCC2=C1 O11462 [0,1,0,1,0,0|2,0,0]=4 860 B12R2.44 N#CC1=CC2=C(C=C1)NCC2 29812 [0,1,0,1,0,0|2,0,0]=4 861 B12R2.44 NCC1=CC2=C(C=C1)CCC2 W11761 [0,1,0,1,0,0|2,0,0]=4 862 B12R2.44 NCC1=CC2=C(C=C1)CCC2 Y11717 [0,1,0,1,0,0|2,0,0]=4 863 B12R2.44 NCC1=CC2=C(C=C1)NCC2 W19193 [0,1,0,1,0,0|2,0,0]=4 864 B12R2.44 OCC1=CC2=C(C=C1)CCO2 Y10452 [0,1,0,1,0,0|2,0,0]=4 865 B12R2.44 OCC1=CC2=C(C=C1)COC2 72635 [0,1,0,1,0,0|2,0,0]=4 866 B12R2.82 CC1=C2CCOC2=NC=C1N 97227 [0,1,0,1,0,0|2,0,0]=4 867 B12R2.82 FC1=C(Br)C=CC2=C1CCN2 36640 [0,1,0,1,0,0|2,0,0]=4 868 B12R2.82 FC1=C(Br)C=CC2=C1OCO2 C71857 [0,1,0,1,0,0|2,0,0]=4 869 B12R2.82 NC1=C(Br)C2=C(C=C1)CCC2 AC6580 [0,1,0,1,0,0|2,0,0]=4 870 B12R2.82 NC1=C(Br)C=CC2=C1OCO2 P16934 [0,1,0,1,0,0|2,0,0]=4 871 B12R2.82 NC1=C(Cl)C=CC2=C1OCO2 67292 [0,1,0,1,0,0|2,0,0]=4 872 B12R2.82 OC1=C(F)C2=C(C=C1)CNC2 82138 [0,1,0,1,0,0|2,0,0]=4 873 B12R2.100 FC1=C(Br)C=C2CCCC2=C1 Y13363 [0,1,0,1,0,0|2,0,0]=4 874 B12R2.100 FC1=C(Br)C=C2CCNC2=C1 C72478 [0,1,0,1,0,0|2,0,0]=4 875 B12R2.100 FC1=C(F)C=C2NCCC2=C1 35989 [0,1,0,1,0,0|2,0,0]=4 876 B12R2.100 NC1=C(F)C=C2OCOC2=C1 AC2153 [0,1,0,1,0,0|2,0,0]=4 877 B12R2.100 NC1=C(I)C=C2OCOC2=C1 Y11139 [0,1,0,1,0,0|2,0,0]=4 878 B12R2.100 OC1=C(Br)C=C2CCCC2=C1 C74651 [0,1,0,1,0,0|1,0,0]=3 879 B12R2.100 OC1=C(Br)C=C2OCOC2=C1 T71241 [0,1,0,1,0,0|1,0,0]=3 880 B12R2.291 FC1=C(F)C=C(C2CC2)C=C1 W15099 [0,1,0,1,0,0|2,0,0]=4 881 B12R2.291 FC1=C(I)C=CC(C2CC2)=C1 96635 [0,1,0,1,0,0|2,0,0]=4 882 B8R1.1 CCC1=CC(O)=NO1 AC2644 [1,0,0,0,1,0|2,0,0]=4 883 B8R1.1 CCC1=CC=C(C)O1 A12137 [1,0,0,0,1,0|2,0,0]=4 884 B8R1.1 CCN1C=C(O)C=N1 AT11883 [1,0,0,0,1,0|2,0,0]=4 885 B8R1.8 CCOC1=NNC=C1 AT14799 [1,0,0,0,1,0|2,0,0]=4