0 B9R1.8 CC#CC1=CC=CC=C1 CS-W013608 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.8 NCCC1=CC=CC=N1 CS-W005000 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.8 NCCC1=CN=CC=C1 CS-W008641 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.8 NNCC1=CC=CC=C1 CS-W008735 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.8 NOCC1=CC=CC=C1 CS-W008676 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.8 OCCC1=CC=NC=C1 CS-W016575 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.8 ONCC1=CC=CC=C1 CS-W005571 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.2 CNC1=CC=NC=C1 CS-W013674 [1,0,0,0,0,0|2,0,0]=3 8 B8R1.2 COC1=CC=CC=N1 CS-W009307 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.2 COC1=CC=CN=N1 CS-W021957 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.2 COC1=CC=NC=C1 CS-W007634 [1,0,0,0,0,0|2,0,0]=3 11 B8R1.2 CSC1=CC=CC=C1 CS-0015372 [1,0,0,0,0,0|1,0,0]=2 12 B8R1.2 ClCC1=CC=CC=N1 CS-W007502 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.2 ClCC1=CC=NC=C1 CS-W016094 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.2 NCC1=CC=CC=N1 CS-W007488 [1,0,0,0,0,0|1,0,0]=2 15 B8R1.2 NCC1=CC=CN=C1 CS-W019701 [1,0,0,0,0,0|1,0,0]=2 16 B8R1.2 NCC1=CN=CN=C1 CS-W022426 [1,0,0,0,0,0|2,0,0]=3 17 B8R1.2 NCC1=NC=CC=N1 CS-D1165 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.2 NN=C1C=CNC=C1 CS-W004835 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.2 NNC1=NC=CC=N1 CS-W005381 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.2 O=CC1=CC=CC=N1 CS-W007336 [1,0,0,0,0,0|2,0,1]=4 21 B8R1.2 O=CC1=CC=NC=C1 CS-D1135 [1,0,0,0,0,0|2,0,1]=4 22 B8R1.2 OCC1=CC=CN=C1 CS-4356 [1,0,0,0,0,0|2,0,0]=3 23 B8R1.2 OCC1=NN=CC=C1 CS-W005032 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.2 ONC1=CC=CC=C1 CS-W007515 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.1 N#CCC1=CC=C(Br)C=C1 CS-W008769 [0,1,0,0,0,0|0,0,2]=3 26 B10R1.1 N#CCC1=CC=C(I)C=C1 CS-W005301 [0,1,0,0,0,0|0,0,2]=3 27 B10R1.1 N#CCC1=CC=C(O)C=C1 CS-W016539 [0,1,0,0,0,0|0,0,2]=3 28 B10R1.1 N#CCC1=CN=C(Cl)C=C1 CS-W013293 [0,1,0,0,0,0|1,0,2]=4 29 B10R1.1 NCCC1=CC=C(F)C=C1 CS-W018312 [0,1,0,0,0,0|0,0,0]=1 30 B10R1.1 NCCC1=CC=C(N)C=C1 CS-W021984 [0,1,0,0,0,0|0,0,0]=1 31 B10R1.1 NOCC1=CC=C(F)C=C1 CS-0043692 [0,1,0,0,0,0|1,0,0]=2 32 B10R1.1 OC1=CC=C(CCBr)C=C1 CS-W004888 [0,1,0,0,0,0|1,0,0]=2 33 B10R1.1 OCCC1=CC=C(Br)C=C1 CS-W004747 [0,1,0,0,0,0|1,0,0]=2 34 B10R1.1 OCCC1=CC=C(I)C=C1 CS-W004990 [0,1,0,0,0,0|1,0,0]=2 35 B10R1.4 CNCC1=CC=CC=C1Br CS-0031414 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.4 CNCC1=CC=CC=C1C CS-0045339 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.4 CNCC1=CC=CC=C1F CS-W005782 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.4 ClC1=CC=CC=C1CCBr CS-0081877 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.4 N#CCC1=CC=CC=C1F CS-W013356 [0,1,0,0,0,0|0,0,2]=3 40 B10R1.4 N#CCC1=CC=CC=C1N CS-W008009 [0,1,0,0,0,0|0,0,2]=3 41 B10R1.4 N#CCC1=CC=CN=C1Cl CS-W020736 [0,1,0,0,0,0|1,0,2]=4 42 B10R1.4 NCCC1=C(Cl)C=CC=C1 CS-W019353 [0,1,0,0,0,0|0,0,0]=1 43 B10R1.4 NCCC1=CC=CC=C1Br CS-W013200 [0,1,0,0,0,0|0,0,0]=1 44 B10R1.4 NOCC1=CC=CC=C1F CS-0098085 [0,1,0,0,0,0|1,0,0]=2 45 B10R1.4 OCCC1=CC=CC=C1Cl CS-W017988 [0,1,0,0,0,0|1,0,0]=2 46 B10R1.4 OCCC1=CC=CC=C1I CS-0045354 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.10 OCCC1=CC(F)=CC=C1 CS-W021390 [0,1,0,0,0,0|1,0,0]=2 48 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 CS-W013344 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.15 COS(=O)C1=CC=CC=C1 CS-M2210 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.15 NC(CO)C1=CC=CC=C1 CS-W005163 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.15 NNC(=O)C1=CC=CC=C1 CS-W017759 [0,1,0,0,0,0|1,0,1]=3 52 B10R1.15 O=C(CBr)C1=CN=CC=C1 CS-W010052 [0,1,0,0,0,0|2,0,1]=4 53 B10R1.15 OC[C@H](O)C1=CC=CC=C1 CS-W016497 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.17 BrCCOC1=CC=CC=C1 CS-W015572 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.17 CCOCC1=CC=CC=C1 CS-W018329 [0,1,0,0,0,0|1,0,0]=2 56 B10R1.17 ClCCSC1=CC=CC=C1 CS-M0048 [0,1,0,0,0,0|1,0,0]=2 57 B10R1.17 N#CC#CC1=CC=CC=C1 CS-W013484 [0,1,0,0,0,0|0,0,3]=4 58 B10R1.17 O=C\C=C\C1=CC=CC=C1 CS-0009609 [0,1,0,0,0,0|1,0,2]=4 59 B10R1.17 OCCCC1=NC=CC=C1 CS-0079867 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.18 NC(=O)CC1=CC=CC=C1 CS-W018983 [0,1,0,0,0,0|0,0,1]=2 61 B10R1.18 NC(=O)OC1=CC=CC=C1 CS-0095625 [0,1,0,0,0,0|1,0,1]=3 62 B10R1.18 NC(=S)NC1=NC=CC=C1 CS-W018070 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.18 O=C(O)CC1=CC=CC=N1 CS-W017541 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.18 S=C(Cl)OC1=CC=CC=C1 CS-W008892 [0,1,0,0,0,0|2,0,1]=4 65 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 CS-W013577 [0,0,0,1,0,0|1,0,0]=2 66 B10R2.6 [C@H]1(C2=CC=CC=C2)CO1 CS-W011206 [0,0,0,1,0,0|1,0,0]=2 67 B10R2.7 C1=CC2=C(C=C1)CNC2 CS-D1516 [0,0,0,1,0,0|2,0,0]=3 68 B10R2.7 C1=CC2=C(C=C1)NCC2 CS-W009145 [0,0,0,1,0,0|0,0,0]=1 69 B10R2.7 C1=CC2=C(C=N1)NCC2 CS-W021490 [0,0,0,1,0,0|1,0,0]=2 70 B10R2.7 C1=CC=C2NN=CC2=C1 CS-W008689 [0,0,0,1,0,0|1,0,1]=3 71 B10R2.7 C1=CC=C2OCOC2=C1 CS-W020572 [0,0,0,1,0,0|2,0,0]=3 72 B10R2.7 C1=CC=C2SC=CC2=C1 CS-D1193 [0,0,0,1,0,0|1,0,2]=4 73 B10R2.7 C1=CN=C2C=CNC2=C1 CS-D1166 [0,0,0,1,0,0|1,0,2]=4 74 B10R2.7 C1=CN=C2NC=CC2=C1 CS-B0516 [0,0,0,1,0,0|1,0,2]=4 75 B10R2.7 C1=CN=C2NCCC2=C1 CS-M0806 [0,0,0,1,0,0|1,0,0]=2 76 B10R2.7 C1=NC=C2NC=NC2=C1 CS-W005266 [0,0,0,1,0,0|2,0,1]=4 77 B8R1.8 CCCC1=NC=CN1 CS-W013667 [0,0,0,0,1,0|3,0,0]=4 78 B8R1.8 CNCC1=CC=CS1 CS-W018825 [0,0,0,0,1,0|3,0,0]=4 79 B8R1.8 CNCC1=CSC=C1 CS-B1142 [0,0,0,0,1,0|3,0,0]=4 80 B8R1.8 N#CCC1=CSC=C1 CS-0040874 [0,0,0,0,1,0|1,0,2]=4 81 B8R1.8 NCCC1=CC=CO1 CS-B1143 [0,0,0,0,1,0|1,0,0]=2 82 B8R1.8 NCCN1C=CN=N1 CS-0047077 [0,0,0,0,1,0|3,0,0]=4 83 B8R1.8 OCCC1=CC=CS1 CS-W020421 [0,0,0,0,1,0|2,0,0]=3 84 B7R1.3 BrC1=CC=CN=C1 CS-0008362 [2,0,0,0,0,0|2,0,0]=4 85 B7R1.3 BrC1=CC=NC=C1 CS-M0097 [2,0,0,0,0,0|2,0,0]=4 86 B7R1.3 BrC1=CC=NC=C1 CS-M3060 [2,0,0,0,0,0|2,0,0]=4 87 B7R1.3 CC1=NC=CC=N1 CS-W016665 [2,0,0,0,0,0|2,0,0]=4 88 B7R1.3 ClC1=CC=NC=C1 CS-W019791 [2,0,0,0,0,0|2,0,0]=4 89 B7R1.3 ClC1=CN=CC=C1 CS-W011253 [2,0,0,0,0,0|2,0,0]=4 90 B7R1.3 FC1=CC=CC=N1 CS-W011339 [2,0,0,0,0,0|2,0,0]=4 91 B7R1.3 FC1=CC=NC=C1 CS-W011075 [2,0,0,0,0,0|2,0,0]=4 92 B7R1.3 FC1=CN=CC=C1 CS-W011338 [2,0,0,0,0,0|2,0,0]=4 93 B7R1.3 IC1=CC=CC=C1 CS-W008603 [2,0,0,0,0,0|1,0,0]=3 94 B7R1.3 NC1=CC=CC=C1 CS-W018553 [2,0,0,0,0,0|0,0,0]=2 95 B7R1.3 NC1=CN=NC=C1 CS-W007757 [2,0,0,0,0,0|2,0,0]=4 96 B7R1.3 NC1=NC=CN=C1 CS-D1606 [2,0,0,0,0,0|2,0,0]=4 97 B7R1.3 NC1=NC=NC=C1 CS-W005460 [2,0,0,0,0,0|2,0,0]=4 98 B7R1.3 OC1=CC=CC=N1 CS-0032800 [2,0,0,0,0,0|2,0,0]=4 99 B7R1.3 OC1=CC=NC=C1 CS-W007690 [2,0,0,0,0,0|2,0,0]=4 100 B7R1.3 [O-]C1=CC=CC=C1 CS-0048749 [2,0,0,0,0,0|1,0,0]=3 101 B9R1.1 C#CC1=CC=C(Br)C=C1 CS-W007542 [1,1,0,0,0,0|0,0,2]=4 102 B9R1.1 C=CC1=CC=C(Br)C=C1 CS-W009005 [1,1,0,0,0,0|0,0,2]=4 103 B9R1.1 C=CC1=CC=C(O)C=C1 CS-W005288 [1,1,0,0,0,0|0,0,2]=4 104 B9R1.1 CC1=CC=C(CN)C=C1 CS-W022218 [1,1,0,0,0,0|0,0,0]=2 105 B9R1.1 CC1=CC=C(NN)C=C1 CS-W016192 [1,1,0,0,0,0|1,0,0]=3 106 B9R1.1 CC1=CN=C(CN)C=C1 CS-0019191 [1,1,0,0,0,0|1,0,0]=3 107 B9R1.1 CCC1=CC=C(Br)C=C1 CS-W016965 [1,1,0,0,0,0|0,0,0]=2 108 B9R1.1 CCC1=CC=C(I)C=C1 CS-0109504 [1,1,0,0,0,0|0,0,0]=2 109 B9R1.1 CCC1=CN=C(Cl)N=C1 CS-W011014 [1,1,0,0,0,0|2,0,0]=4 110 B9R1.1 CNC1=CC=C(N)C=C1 CS-W022918 [1,1,0,0,0,0|1,0,0]=3 111 B9R1.1 CNC1=NC=C(Br)C=C1 CS-W008672 [1,1,0,0,0,0|2,0,0]=4 112 B9R1.1 COC1=CN=C(N)C=C1 CS-D1544 [1,1,0,0,0,0|2,0,0]=4 113 B9R1.1 COC1=NC=C(Br)C=C1 CS-D0943 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.1 COC1=NC=C(F)C=C1 CS-0007509 [1,1,0,0,0,0|2,0,0]=4 115 B9R1.1 COC1=NC=C(O)C=C1 CS-W005101 [1,1,0,0,0,0|2,0,0]=4 116 B9R1.1 CSC1=NC=C(Br)C=C1 CS-0007564 [1,1,0,0,0,0|2,0,0]=4 117 B9R1.1 ClCC1=NC=C(Br)C=C1 CS-0043013 [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 N#CC1=CC=C(S)C=C1 CS-D0524 [1,1,0,0,0,0|0,0,2]=4 119 B9R1.1 NC1=CC=C(CO)C=C1 CS-W007465 [1,1,0,0,0,0|1,0,0]=3 120 B9R1.1 NCC1=CC=C(O)C=C1 CS-W004078 [1,1,0,0,0,0|0,0,0]=2 121 B9R1.1 NCC1=NC=C(Br)C=C1 CS-W003275 [1,1,0,0,0,0|1,0,0]=3 122 B9R1.1 NNC1=CC=C(Br)C=C1 CS-W013083 [1,1,0,0,0,0|1,0,0]=3 123 B9R1.1 NNC1=CC=C(Cl)C=C1 CS-W017296 [1,1,0,0,0,0|1,0,0]=3 124 B9R1.1 NNC1=CC=C(F)C=C1 CS-W007861 [1,1,0,0,0,0|1,0,0]=3 125 B9R1.1 O=CC1=CC=C(F)C=C1 CS-W008729 [1,1,0,0,0,0|1,0,1]=4 126 B9R1.1 OCC1=CN=C(F)C=C1 CS-0044070 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.2 C#CC1=CC(F)=CC=C1 CS-W013579 [1,1,0,0,0,0|0,0,2]=4 128 B9R1.2 C#CC1=CC=CC(Br)=C1 CS-W018828 [1,1,0,0,0,0|0,0,2]=4 129 B9R1.2 CC1=CC=CC(C=O)=C1 CS-0007820 [1,1,0,0,0,0|1,0,1]=4 130 B9R1.2 CC1=CN=CC(CCl)=C1 CS-W021769 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.2 CC1=CN=CC(CO)=C1 CS-0040539 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.2 CCC1=CC(=N)NC=C1 CS-W007772 [1,1,0,0,0,0|1,0,0]=3 133 B9R1.2 CCC1=CC(Cl)=NC=N1 CS-W020142 [1,1,0,0,0,0|2,0,0]=4 134 B9R1.2 CNC1=CC=CC(Br)=C1 CS-W004947 [1,1,0,0,0,0|1,0,0]=3 135 B9R1.2 COC1=CC(Cl)=NC=C1 CS-W007914 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.2 COC1=CC(F)=NC=C1 CS-W006693 [1,1,0,0,0,0|2,0,0]=4 137 B9R1.2 COC1=CC(I)=CC=C1 CS-W012919 [1,1,0,0,0,0|1,0,0]=3 138 B9R1.2 COC1=CC=CC(Br)=N1 CS-D1443 [1,1,0,0,0,0|2,0,0]=4 139 B9R1.2 COC1=CC=CC(I)=N1 CS-0037881 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.2 COC1=CC=NC(C)=C1 CS-W005919 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.2 COC1=NC=CC(Br)=C1 CS-D0772 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.2 COC1=NC=CC(F)=C1 CS-W006596 [1,1,0,0,0,0|2,0,0]=4 143 B9R1.2 COC1=NC=CC(N)=C1 CS-D0771 [1,1,0,0,0,0|2,0,0]=4 144 B9R1.2 CSC1=CC=CC(Br)=C1 CS-W015472 [1,1,0,0,0,0|1,0,0]=3 145 B9R1.2 FC1=CC=CC(CBr)=N1 CS-W006122 [1,1,0,0,0,0|2,0,0]=4 146 B9R1.2 N#CC1=CC(Cl)=CC=C1 CS-W011053 [1,1,0,0,0,0|0,0,2]=4 147 B9R1.2 N#CC1=CC(F)=CC=C1 CS-W013568 [1,1,0,0,0,0|0,0,2]=4 148 B9R1.2 NCC1=CC(F)=NC=C1 CS-0059165 [1,1,0,0,0,0|1,0,0]=3 149 B9R1.2 NCC1=CC(O)=CC=C1 CS-0079906 [1,1,0,0,0,0|0,0,0]=2 150 B9R1.2 NCC1=CC=CC(I)=C1 CS-W002083 [1,1,0,0,0,0|0,0,0]=2 151 B9R1.2 NNC1=CC(Cl)=NC=C1 CS-W009067 [1,1,0,0,0,0|2,0,0]=4 152 B9R1.2 O=CC1=CC(I)=CC=C1 CS-W007699 [1,1,0,0,0,0|1,0,1]=4 153 B9R1.2 O=CC1=CC=CC(Br)=C1 CS-W009197 [1,1,0,0,0,0|1,0,1]=4 154 B9R1.2 OCC1=CC(Br)=CC=C1 CS-W007761 [1,1,0,0,0,0|1,0,0]=3 155 B9R1.2 OCC1=CC(Cl)=CC=C1 CS-W018271 [1,1,0,0,0,0|1,0,0]=3 156 B9R1.2 OCC1=CC(I)=CC=C1 CS-0059266 [1,1,0,0,0,0|1,0,0]=3 157 B9R1.2 OCC1=CC(O)=CN=C1 CS-0094527 [1,1,0,0,0,0|2,0,0]=4 158 B9R1.2 OCC1=NC=CC(Br)=C1 CS-W018599 [1,1,0,0,0,0|2,0,0]=4 159 B9R1.2 OCC1=NC=CC(Cl)=C1 CS-W003408 [1,1,0,0,0,0|2,0,0]=4 160 B9R1.6 CC(=O)C1=CC=CN=C1 CS-W008604 [1,1,0,0,0,0|1,0,1]=4 161 B9R1.6 CC(=O)C1=CC=NC=C1 CS-W008727 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.6 CC(C)C1=CC=CC=N1 CS-W019396 [1,1,0,0,0,0|1,0,0]=3 163 B9R1.6 CC(N)C1=CC=CC=C1 CS-W013564 [1,1,0,0,0,0|0,0,0]=2 164 B9R1.6 CC(N)C1=NC=CC=C1 CS-M2153 [1,1,0,0,0,0|1,0,0]=3 165 B9R1.6 CC(N)C1=NC=CC=C1 CS-W023139 [1,1,0,0,0,0|1,0,0]=3 166 B9R1.6 C[C@@H](N)C1=CC=CC=C1 CS-W008645 [1,1,0,0,0,0|0,0,0]=2 167 B9R1.6 C[C@@H](N)C1=CC=NC=C1 CS-0098148 [1,1,0,0,0,0|1,0,0]=3 168 B9R1.6 C[C@@H](O)C1=CC=CC=C1 CS-M2101 [1,1,0,0,0,0|0,0,0]=2 169 B9R1.6 C[C@@H](O)C1=NC=CC=C1 CS-0040476 [1,1,0,0,0,0|1,0,0]=3 170 B9R1.6 C[C@H](N)C1=CC=CN=C1 CS-0044516 [1,1,0,0,0,0|1,0,0]=3 171 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0035271 [1,1,0,0,0,0|1,0,1]=4 172 B9R1.15 C#CC1=C(Br)C=CC=C1 CS-0028333 [1,1,0,0,0,0|0,0,2]=4 173 B9R1.15 C=CC1=CC=CC=C1N CS-W006235 [1,1,0,0,0,0|0,0,2]=4 174 B9R1.15 CC1=C(CO)N=CC=C1 CS-0046819 [1,1,0,0,0,0|2,0,0]=4 175 B9R1.15 CC1=CC=CC=C1C=O CS-W008902 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.15 CC1=CC=CC=C1NN CS-W007773 [1,1,0,0,0,0|1,0,0]=3 177 B9R1.15 CCC1=C(Br)C=NC=C1 CS-W021862 [1,1,0,0,0,0|1,0,0]=3 178 B9R1.15 CNC1=CC=CC=C1F CS-W013511 [1,1,0,0,0,0|1,0,0]=3 179 B9R1.15 CNC1=CC=CC=C1N CS-W015729 [1,1,0,0,0,0|1,0,0]=3 180 B9R1.15 CNC1=CN=CC=C1C CS-M3532 [1,1,0,0,0,0|2,0,0]=4 181 B9R1.15 COC1=C(Br)C=CN=C1 CS-0006068 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.15 COC1=C(Br)C=CN=C1 CS-0031482 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.15 COC1=CC=CC=C1Br CS-W007633 [1,1,0,0,0,0|1,0,0]=3 184 B9R1.15 COC1=CC=CC=C1I CS-W009305 [1,1,0,0,0,0|1,0,0]=3 185 B9R1.15 COC1=CC=CN=C1I CS-0063167 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.15 COC1=CC=CN=C1N CS-W019632 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.15 COC1=NC=CC=C1Br CS-D0942 [1,1,0,0,0,0|2,0,0]=4 188 B9R1.15 CSC1=C(N)C=CC=C1 CS-0072892 [1,1,0,0,0,0|1,0,0]=3 189 B9R1.15 ClCC1=C(Cl)N=CC=C1 CS-W016128 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.15 N#CC1=CC=CC=C1Br CS-W007475 [1,1,0,0,0,0|0,0,2]=4 191 B9R1.15 N#CC1=CC=CC=C1Cl CS-W018317 [1,1,0,0,0,0|0,0,2]=4 192 B9R1.15 N#CC1=CC=CC=C1O CS-W013585 [1,1,0,0,0,0|0,0,2]=4 193 B9R1.15 NC1=CC=CC=C1CO CS-W004705 [1,1,0,0,0,0|1,0,0]=3 194 B9R1.15 NCC1=C(Cl)N=CC=N1 CS-W006685 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.15 NCC1=CC=CC=C1Br CS-W004667 [1,1,0,0,0,0|0,0,0]=2 196 B9R1.15 O=CC1=CC=CC=C1Br CS-D1759 [1,1,0,0,0,0|1,0,1]=4 197 B9R1.15 O=CC1=CC=CC=C1I CS-W007846 [1,1,0,0,0,0|1,0,1]=4 198 B9R1.15 OCC1=CC=CC=C1Br CS-W008828 [1,1,0,0,0,0|1,0,0]=3 199 B9R1.15 OCC1=CC=CC=C1I CS-W004678 [1,1,0,0,0,0|1,0,0]=3 200 B9R1.15 OCC1=NC=CC=C1F CS-0031358 [1,1,0,0,0,0|2,0,0]=4 201 B9R1.7 CN1C=NC(CCN)=C1 CS-0046885 [0,1,0,0,1,0|2,0,0]=4 202 B11R1.1 CCCCC1=CC=C(Br)C=C1 CS-W014978 [0,2,0,0,0,0|1,0,0]=3 203 B11R1.1 NCCCC1=CC=C(Cl)C=C1 CS-W021762 [0,2,0,0,0,0|0,0,0]=2 204 B11R1.1 NCCOC1=CC=C(F)C=C1 CS-0073022 [0,2,0,0,0,0|0,0,0]=2 205 B11R1.1 OCCCC1=CC=C(Br)C=C1 CS-B0314 [0,2,0,0,0,0|1,0,0]=3 206 B11R1.20 CC(C)OC1=CC=C(N)C=C1 CS-0051136 [0,2,0,0,0,0|2,0,0]=4 207 B11R1.20 CC(C)OC1=CC=C(O)C=C1 CS-0000201 [0,2,0,0,0,0|2,0,0]=4 208 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS-W018535 [0,2,0,0,0,0|1,0,1]=4 209 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS-D0933 [0,2,0,0,0,0|1,0,1]=4 210 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS-W014980 [0,2,0,0,0,0|1,0,1]=4 211 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS-W016035 [0,2,0,0,0,0|1,0,1]=4 212 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 CS-W022181 [0,2,0,0,0,0|1,0,1]=4 213 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 CS-0037604 [0,2,0,0,0,0|1,0,0]=3 214 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 CS-0089922 [0,2,0,0,0,0|1,0,0]=3 215 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS-W009314 [0,2,0,0,0,0|1,0,1]=4 216 B11R1.81 CCOC1=CC=C(N)C=C1Cl CS-0098712 [0,2,0,0,0,0|2,0,0]=4 217 B11R1.81 N#CCC1=C(Br)C=C(F)C=C1 CS-W005386 [0,2,0,0,0,0|0,0,2]=4 218 B11R1.81 NCCC1=C(F)C=C(F)C=C1 CS-W021377 [0,2,0,0,0,0|0,0,0]=2 219 B11R1.83 C#CC1=CC=C(CC#N)C=C1 CS-W016438 [0,2,0,0,0,0|0,0,2]=4 220 B11R1.83 CNCC1=CC=C(OC)C=C1 CS-D0566 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.83 COC1=CC=C(CNN)C=C1 CS-W018557 [0,2,0,0,0,0|1,0,0]=3 222 B11R1.192 CNCC1=CC=C(O)C(O)=C1 CS-0059168 [0,2,0,0,0,0|2,0,0]=4 223 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 CS-W010737 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.41 CNCC1=CC=CC=C1OC CS-W023049 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.86 CC(=O)CC1=CC=CC=C1Cl CS-0043797 [0,2,0,0,0,0|1,0,1]=4 226 B11R1.86 CC(C)OC1=CC=CC=C1Br CS-W014904 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.86 CC(C)SC1=CC=CC=C1N CS-0010898 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.86 FC(F)OC1=CC=CC=C1Br CS-W007867 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.86 O=C(O)CC1=CC=CC=C1Br CS-W007544 [0,2,0,0,0,0|1,0,1]=4 230 B11R1.605 N#CCC1=C(Cl)C=CC=C1F CS-W017714 [0,2,0,0,0,0|0,0,2]=4 231 B11R1.605 N#CCC1=C(F)C=CC=C1F CS-W008404 [0,2,0,0,0,0|0,0,2]=4 232 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 CS-0089919 [0,2,0,0,0,0|1,0,0]=3 233 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 CS-W010776 [0,2,0,0,0,0|1,0,1]=4 234 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 CS-W020717 [0,2,0,0,0,0|1,0,0]=3 235 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 CS-0095532 [0,2,0,0,0,0|1,0,0]=3 236 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 CS-W020718 [0,2,0,0,0,0|1,0,0]=3 237 B11R1.23 N\N=C(/O)C1=CC(Br)=CC=C1 CS-W014905 [0,2,0,0,0,0|1,0,1]=4 238 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 CS-W012301 [0,2,0,0,0,0|1,0,1]=4 239 B11R1.24 CC1=CC=CC(CCCO)=C1 CS-M2099 [0,2,0,0,0,0|1,0,0]=3 240 B11R1.24 CCNCC1=CC=CC(Cl)=C1 CS-0045368 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 CS-D0594 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 CS-W019487 [0,2,0,0,0,0|0,0,2]=4 243 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 CS-W018079 [0,2,0,0,0,0|0,0,2]=4 244 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 CS-B0132 [0,2,0,0,0,0|1,0,1]=4 245 B11R1.157 CC1=CC=CC(OC(C)C)=C1 CS-0046837 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.157 FC(F)OC1=CC=CC(Br)=C1 CS-W007939 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 CS-W010777 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 CS-W004799 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.189 CNCC1=CC(OC)=CC=C1 CS-D0558 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.189 COC1=CC(CCO)=CC=C1 CS-W008146 [0,2,0,0,0,0|1,0,0]=3 251 B11R1.189 COC1=CC=CC(CC#N)=C1 CS-W007963 [0,2,0,0,0,0|0,0,2]=4 252 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 CS-0067905 [0,2,0,0,0,0|0,0,2]=4 253 B11R1.7 CC(C)(CN)C1=CC=CC=C1 CS-D0358 [0,2,0,0,0,0|0,0,0]=2 254 B11R1.12 OCC(CO)C1=CC=CC=C1 CS-W004830 [0,2,0,0,0,0|1,0,0]=3 255 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 CS-W019696 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 CS-0040300 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 CS-0040396 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.28 BrCCCOC1=CC=CC=C1 CS-0030579 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.28 BrCCOCC1=CC=CC=C1 CS-W007388 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.28 CCOCCC1=CC=CC=N1 CS-W018112 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.28 NCCOCC1=CC=CC=C1 CS-W018620 [0,2,0,0,0,0|0,0,0]=2 262 B11R1.28 OCCCCC1=CC=CC=C1 CS-W018137 [0,2,0,0,0,0|1,0,0]=3 263 B11R1.40 COC(=O)CC1=CC=CC=C1 CS-W018528 [0,2,0,0,0,0|1,0,1]=4 264 B11R1.40 NCC(O)CC1=CC=CC=C1 CS-D0131 [0,2,0,0,0,0|0,0,0]=2 265 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 CS-D1142 [0,2,0,0,0,0|0,0,0]=2 266 B11R1.40 O=C(CBr)NC1=CC=CC=C1 CS-D0368 [0,2,0,0,0,0|1,0,1]=4 267 B11R1.91 N=C(O)OCC1=CC=CC=C1 CS-W004984 [0,2,0,0,0,0|0,0,2]=4 268 B11R1.91 O=C(O)CNC1=CC=CC=C1 CS-W016312 [0,2,0,0,0,0|1,0,1]=4 269 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS-D1532 [0,2,0,0,0,0|2,0,0]=4 270 B9R2.50 C1=CC=C2CCC2=C1 CS-W016636 [1,0,0,1,0,0|0,0,0]=2 271 B11R2.34 FC1=NC=C(C2CC2)C=C1 CS-B1134 [0,1,0,1,0,0|2,0,0]=4 272 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS-W022173 [0,1,0,1,0,0|1,0,0]=3 273 B11R2.34 NC1=NC=C(C2CC2)C=C1 CS-W022369 [0,1,0,1,0,0|2,0,0]=4 274 B11R2.36 BrC1=CC2=C(C=C1)C=NN2 CS-D0757 [0,1,0,1,0,0|1,0,1]=4 275 B11R2.36 BrC1=CC2=C(C=C1)CNC2 CS-B0832 [0,1,0,1,0,0|2,0,0]=4 276 B11R2.36 BrC1=CC2=C(C=C1)N=CN2 CS-W007490 [0,1,0,1,0,0|1,0,1]=4 277 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 CS-D0617 [0,1,0,1,0,0|0,0,2]=4 278 B11R2.36 BrC1=CC2=C(CCN2)N=C1 CS-0075298 [0,1,0,1,0,0|1,0,0]=3 279 B11R2.36 BrC1=CC=C2C=CNC2=C1 CS-D1020 [0,1,0,1,0,0|0,0,2]=4 280 B11R2.36 BrC1=CC=C2N=NNC2=C1 CS-0030413 [0,1,0,1,0,0|2,0,0]=4 281 B11R2.36 BrC1=CC=C2OCOC2=C1 CS-W008826 [0,1,0,1,0,0|2,0,0]=4 282 B11R2.36 CC1=CC2=C(C=C1)OCO2 CS-M1002 [0,1,0,1,0,0|2,0,0]=4 283 B11R2.36 ClC1=CC2=C(C=C1)NN=C2 CS-W019896 [0,1,0,1,0,0|1,0,1]=4 284 B11R2.36 FC1=CC2=C(C=C1)N=CN2 CS-W005827 [0,1,0,1,0,0|1,0,1]=4 285 B11R2.36 FC1=CC2=C(C=C1)NN=C2 CS-W009120 [0,1,0,1,0,0|1,0,1]=4 286 B11R2.36 FC1=CC=C2N=NNC2=C1 CS-B1115 [0,1,0,1,0,0|2,0,0]=4 287 B11R2.36 FC1=CC=C2NC=CC2=C1 CS-D0680 [0,1,0,1,0,0|0,0,2]=4 288 B11R2.36 IC1=CC2=C(C=C1)N=CN2 CS-W006895 [0,1,0,1,0,0|1,0,1]=4 289 B11R2.36 IC1=CC2=C(C=C1)NN=C2 CS-D1249 [0,1,0,1,0,0|1,0,1]=4 290 B11R2.36 IC1=CC=C2OCOC2=C1 CS-W022396 [0,1,0,1,0,0|2,0,0]=4 291 B11R2.36 NC1=CC2=C(C=C1)NN=C2 CS-W008621 [0,1,0,1,0,0|1,0,1]=4 292 B11R2.36 NC1=CC=C2N=NNC2=C1 CS-0033872 [0,1,0,1,0,0|2,0,0]=4 293 B11R2.36 OC1=CC=C2CCOC2=C1 CS-W009275 [0,1,0,1,0,0|1,0,0]=3 294 B11R2.10 BrC1=NC2=CC=CC=C2N1 CS-B1157 [0,1,0,1,0,0|1,0,1]=4 295 B11R2.10 CC1=NC2=CC=CC=C2N1 CS-W013410 [0,1,0,1,0,0|1,0,1]=4 296 B11R2.10 N=C1NC2=CC=CC=C2O1 CS-W007637 [0,1,0,1,0,0|1,0,1]=4 297 B11R2.10 NC1=NC2=CC=CC=C2N1 CS-D1373 [0,1,0,1,0,0|1,0,1]=4 298 B11R2.10 O=C1CC2=CC=CC=C2O1 CS-M0764 [0,1,0,1,0,0|1,0,1]=4 299 B11R2.10 O=C1CC2=CC=CN=C2N1 CS-W019704 [0,1,0,1,0,0|1,0,1]=4 300 B11R2.10 O=C1NC2=C(C=CC=C2)S1 CS-W019496 [0,1,0,1,0,0|1,0,1]=4 301 B11R2.10 OC1CC2=CC=CC=C2C1 CS-W004877 [0,1,0,1,0,0|1,0,0]=3 302 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS-W005893 [0,1,0,1,0,0|1,0,0]=3 303 B11R2.20 C1=CC2=C(CNCC2)N=C1 CS-D0063 [0,1,0,1,0,0|1,0,0]=3 304 B11R2.20 C1=CC=C2NCCNC2=C1 CS-W013368 [0,1,0,1,0,0|0,0,0]=2 305 B11R2.20 C1=CC=C2OCCNC2=C1 CS-W004783 [0,1,0,1,0,0|0,0,0]=2 306 B11R2.20 C1=CC=C2SCCNC2=C1 CS-0006415 [0,1,0,1,0,0|0,0,0]=2 307 B11R2.20 C1=CN=C2CCCNC2=C1 CS-W006541 [0,1,0,1,0,0|1,0,0]=3 308 B11R2.20 C1=CN=C2NCCOC2=C1 CS-0039841 [0,1,0,1,0,0|1,0,0]=3 309 B11R2.106 BrC1=CC=CC2=C1C=CN2 CS-D1365 [0,1,0,1,0,0|0,0,2]=4 310 B11R2.106 BrC1=CC=CC2=C1C=NN2 CS-W018550 [0,1,0,1,0,0|1,0,1]=4 311 B11R2.106 CC1=C2NC=CC2=CC=C1 CS-W007670 [0,1,0,1,0,0|0,0,2]=4 312 B11R2.106 CC1=C2NN=CC2=CC=C1 CS-W022552 [0,1,0,1,0,0|1,0,1]=4 313 B11R2.106 CC1=CC=CC2=C1C=NN2 CS-D0853 [0,1,0,1,0,0|1,0,1]=4 314 B11R2.106 ClC1=C2CCCC2=NC=C1 CS-W019784 [0,1,0,1,0,0|2,0,0]=4 315 B11R2.106 ClC1=CC=CC2=C1NN=C2 CS-0044712 [0,1,0,1,0,0|1,0,1]=4 316 B11R2.106 IC1=C2C=NNC2=CC=C1 CS-0037666 [0,1,0,1,0,0|1,0,1]=4 317 B11R2.106 NC1=C2OCCC2=CC=C1 CS-B1184 [0,1,0,1,0,0|1,0,0]=3 318 B11R2.106 NC1=C2OCOC2=CC=C1 CS-W019676 [0,1,0,1,0,0|2,0,0]=4 319 B11R2.106 OC1=C2CCNC2=NC=C1 CS-0093336 [0,1,0,1,0,0|1,0,0]=3 320 B11R2.106 OC1=CC=CC2=C1CCC2 CS-W006868 [0,1,0,1,0,0|1,0,0]=3 321 B11R2.106 OC1=CC=CC2=C1NC=C2 CS-W005047 [0,1,0,1,0,0|0,0,2]=4 322 B11R2.35 BrC1=CC(C2CC2)=CN=C1 CS-0042831 [0,1,0,1,0,0|2,0,0]=4 323 B11R2.35 BrC1=CC=CC(C2CC2)=C1 CS-W005479 [0,1,0,1,0,0|1,0,0]=3 324 B11R2.1 CC1=NNC2=C1C=CC=C2 CS-W019873 [0,1,0,1,0,0|1,0,1]=4 325 B11R2.1 CN1C=CC2=C1C=CC=C2 CS-W008981 [0,1,0,1,0,0|0,0,2]=4 326 B11R2.1 NC1CCC2=C1C=CC=C2 CS-D1386 [0,1,0,1,0,0|0,0,0]=2 327 B11R2.1 NN1C=CC2=C1C=CC=C2 CS-D0779 [0,1,0,1,0,0|0,0,2]=4 328 B11R2.1 OB1OCC2=CC=CC=C12 CS-0078606 [0,1,0,1,0,0|2,0,0]=4 329 B11R2.1 OC1=NCC2=CC=CC=C21 CS-W004767 [0,1,0,1,0,0|1,0,1]=4 330 B11R2.1 OC1CCC2=C1C=CC=C2 CS-0017842 [0,1,0,1,0,0|1,0,0]=3 331 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 CS-W013378 [0,1,0,1,0,0|1,0,0]=3 332 B11R2.1 [C@@H]1(N)CCC2=CC=CC=C21 CS-W005779 [0,1,0,1,0,0|0,0,0]=2 333 B11R2.40 NC1(C2=NC=CC=C2)CC1 CS-0044500 [0,1,0,1,0,0|2,0,0]=4 334 B7R1.1 BrCC1=CSC=C1 CS-0019157 [1,0,0,0,1,0|2,0,0]=4 335 B7R1.1 COC1=CSC=C1 CS-W008023 [1,0,0,0,1,0|2,0,0]=4 336 B7R1.1 NCC1=CC=CS1 CS-W007649 [1,0,0,0,1,0|1,0,0]=3 337 B7R1.1 NCC1=CN=CN1 CS-W019760 [1,0,0,0,1,0|2,0,0]=4 338 B7R1.1 NCC1=CN=CN1 CS-W020523 [1,0,0,0,1,0|2,0,0]=4 339 B7R1.1 NCC1=CNN=C1 CS-0052529 [1,0,0,0,1,0|2,0,0]=4 340 B7R1.1 NCC1=COC=N1 CS-W022227 [1,0,0,0,1,0|2,0,0]=4 341 B7R1.1 OCC1=COC=C1 CS-W007708 [1,0,0,0,1,0|2,0,0]=4