0 B8R1.8 BrCCN1C=CC=N1 SY032735 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 C#CCC1=NC=CN1 SY283980 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CCCC1=NC=CN1 SY021502 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 CCCC1=NNC=C1 SY147130 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 CCCN1C=CC=N1 SY023536 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.8 CCCN1C=CN=C1 SY029323 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.8 CNCC1=CC=CS1 SY002432 [0,0,0,0,0,0|1,1,0]=2 7 B8R1.8 CNCC1=CC=CS1 SY002436 [0,0,0,0,0,0|1,1,0]=2 8 B8R1.8 CNCC1=COC=C1 SY014265 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.8 COCC1=CN=CN1 SY159476 [0,0,0,0,0,0|2,1,0]=3 10 B8R1.8 COCC1=NNC=C1 SY262778 [0,0,0,0,0,0|2,1,0]=3 11 B8R1.8 ClCCC1=CNC=N1 SY019470 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.8 N#CCC1=CC=CN1 SY017222 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.8 N#CCC1=CC=NO1 SY233661 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.8 N#CCC1=CN=CO1 SY232342 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.8 N#CCC1=CNC=N1 SY041793 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.8 N#CCC1=NNC=C1 SY012822 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.8 NCCC1=CC=CN1 SY010719 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.8 NCCC1=CC=CN1 SY011737 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.8 NCCC1=CC=CO1 SY021981 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.8 NCCC1=CC=CS1 SY004316 [0,0,0,0,0,0|2,1,0]=3 21 B8R1.8 NCCC1=CNC=N1 SY012860 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.8 NCCC1=CNC=N1 SY041787 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 NCCC1=CSC=C1 SY034366 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.8 NCCC1=NC=CN1 SY010697 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.8 NCCC1=NC=CN1 SY059809 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.8 NCCC1=NNC=C1 SY021017 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.8 NCCC1=NNC=C1 SY040011 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.8 NCCN1C=CC=N1 SY014106 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.8 NOCC1=CSC=C1 SY281788 [0,0,0,0,0,0|3,1,0]=4 30 B8R1.8 NOCC1=CSC=C1 SY281789 [0,0,0,0,0,0|3,1,0]=4 31 B8R1.8 OCCC1=CSC=C1 SY003714 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.8 OCCC1=NC=CN1 SY009459 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.8 OCCN1C=CC=N1 SY006325 [0,0,0,0,0,0|4,0,0]=4 34 B7R1.1 BrCC1=CSC=C1 SY021673 [1,0,0,0,0,0|3,0,0]=4 35 B7R1.1 BrCC1=NC=CN1 SY024828 [1,0,0,0,0,0|3,0,0]=4 36 B7R1.1 BrCC1=NC=CO1 SY024822 [1,0,0,0,0,0|2,0,0]=3 37 B7R1.1 C#CC1=CC=CN1 SY281703 [1,0,0,0,0,0|1,0,2]=4 38 B7R1.1 C#CC1=CC=CO1 SY253025 [1,0,0,0,0,0|0,0,2]=3 39 B7R1.1 C#CC1=CC=CS1 SY021631 [1,0,0,0,0,0|0,1,2]=4 40 B7R1.1 C=CC1=CC=CS1 SY024253 [1,0,0,0,0,0|0,1,2]=4 41 B7R1.1 CCC1=CC=CS1 SY048489 [1,0,0,0,0,0|0,1,0]=2 42 B7R1.1 CCC1=CNC=N1 SY055411 [1,0,0,0,0,0|2,0,0]=3 43 B7R1.1 CCC1=CSC=C1 SY036406 [1,0,0,0,0,0|2,0,0]=3 44 B7R1.1 CCN1C=CC=N1 SY014479 [1,0,0,0,0,0|2,0,0]=3 45 B7R1.1 CNC1=NC=CS1 SY104581 [1,0,0,0,0,0|2,1,0]=4 46 B7R1.1 COC1=NNC=C1 SY147600 [1,0,0,0,0,0|2,1,0]=4 47 B7R1.1 CSC1=NC=CN1 SY025774 [1,0,0,0,0,0|2,0,0]=3 48 B7R1.1 ClCC1=CN=CO1 SY232319 [1,0,0,0,0,0|2,0,0]=3 49 B7R1.1 ClCC1=NC=CO1 SY016952 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.1 ClCC1=NC=CS1 SY031528 [1,0,0,0,0,0|2,1,0]=4 51 B7R1.1 ClCC1=NNC=C1 SY012821 [1,0,0,0,0,0|3,0,0]=4 52 B7R1.1 N#CC1=CC=CN1 SY012801 [1,0,0,0,0,0|2,0,1]=4 53 B7R1.1 N#CC1=CC=CO1 SY048410 [1,0,0,0,0,0|1,0,1]=3 54 B7R1.1 NCC1=CC=CN1 SY032090 [1,0,0,0,0,0|2,0,0]=3 55 B7R1.1 NCC1=CC=NO1 SY021529 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.1 NCC1=CNC=N1 SY018114 [1,0,0,0,0,0|3,0,0]=4 57 B7R1.1 NCC1=COC=C1 SY002989 [1,0,0,0,0,0|3,0,0]=4 58 B7R1.1 NCC1=COC=N1 SY026493 [1,0,0,0,0,0|3,0,0]=4 59 B7R1.1 NCC1=COC=N1 SY043130 [1,0,0,0,0,0|3,0,0]=4 60 B7R1.1 NCC1=CSC=C1 SY006774 [1,0,0,0,0,0|3,0,0]=4 61 B7R1.1 NCC1=CSC=C1 SY018599 [1,0,0,0,0,0|3,0,0]=4 62 B7R1.1 NCC1=CSC=N1 SY021530 [1,0,0,0,0,0|3,0,0]=4 63 B7R1.1 NCC1=CSC=N1 SY023202 [1,0,0,0,0,0|3,0,0]=4 64 B7R1.1 NCC1=NC=CN1 SY025359 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.1 NCC1=NC=CO1 SY026394 [1,0,0,0,0,0|2,0,0]=3 66 B7R1.1 NCC1=NC=CS1 SY005679 [1,0,0,0,0,0|2,1,0]=4 67 B7R1.1 NCC1=NC=CS1 SY005981 [1,0,0,0,0,0|2,1,0]=4 68 B7R1.1 NCC1=NNC=C1 SY005508 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.1 NCC1=NOC=C1 SY024118 [1,0,0,0,0,0|3,0,0]=4 70 B7R1.1 NCC1=NOC=C1 SY034799 [1,0,0,0,0,0|3,0,0]=4 71 B7R1.1 O=CC1=CC=CN1 SY001497 [1,0,0,0,0,0|1,1,1]=4 72 B7R1.1 O=CC1=CN=CO1 SY025934 [1,0,0,0,0,0|1,1,1]=4 73 B7R1.1 OCC1=CC=CS1 SY036796 [1,0,0,0,0,0|0,2,0]=3 74 B7R1.1 OCC1=CC=NO1 SY179337 [1,0,0,0,0,0|1,1,0]=3 75 B7R1.1 OCC1=CN=CO1 SY025391 [1,0,0,0,0,0|1,1,0]=3 76 B7R1.1 OCC1=CN=CS1 SY002035 [1,0,0,0,0,0|1,2,0]=4 77 B7R1.1 OCC1=CNC=N1 SY003265 [1,0,0,0,0,0|2,1,0]=4 78 B7R1.1 OCC1=COC=C1 SY033055 [1,0,0,0,0,0|2,1,0]=4 79 B7R1.1 OCC1=COC=N1 SY012558 [1,0,0,0,0,0|2,1,0]=4 80 B7R1.1 OCC1=CSC=C1 SY017648 [1,0,0,0,0,0|2,1,0]=4 81 B7R1.1 OCC1=NC=CN1 SY041704 [1,0,0,0,0,0|2,1,0]=4 82 B7R1.1 OCC1=NC=CS1 SY017208 [1,0,0,0,0,0|1,2,0]=4 83 B7R1.1 OCC1=NNC=C1 SY012820 [1,0,0,0,0,0|2,1,0]=4 84 B9R1.7 CC1=CC=C(CCN)S1 SY024090 [0,1,0,0,0,0|2,1,0]=4 85 B9R1.7 CC1=CC=C(CCN)S1 SY024091 [0,1,0,0,0,0|2,1,0]=4 86 B9R1.7 CCCC1=CC(=O)NO1 SY248527 [0,1,0,0,0,0|2,0,0]=3 87 B9R1.7 CCCC1=CC(N)=NN1 SY014078 [0,1,0,0,0,0|3,0,0]=4 88 B9R1.7 CCCC1=NOC(N)=C1 SY077214 [0,1,0,0,0,0|3,0,0]=4 89 B9R1.7 CCCN1C=C(N)C=N1 SY263353 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.7 CCCN1C=CC(O)=N1 SY249519 [0,1,0,0,0,0|3,0,0]=4 91 B9R1.7 CCOC1=CC(N)=NO1 SY007098 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.7 COCC1=CC(N)=NN1 SY098367 [0,1,0,0,0,0|2,1,0]=4 93 B9R1.7 COCN1C=C(N)C=N1 SY014285 [0,1,0,0,0,0|2,1,0]=4 94 B9R1.7 COCN1C=CC(Br)=N1 SY300508 [0,1,0,0,0,0|2,1,0]=4 95 B9R1.7 N#CCC1=CC=C(Cl)O1 SY262145 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.7 N#CCC1=CC=C(Cl)S1 SY186530 [0,1,0,0,0,0|2,1,0]=4 97 B9R1.7 NCCC1=CC(Br)=CS1 SY059871 [0,1,0,0,0,0|2,1,0]=4 98 B9R1.7 NCCC1=CC=C(Br)S1 SY058795 [0,1,0,0,0,0|2,1,0]=4 99 B9R1.7 [C-]#[N+]CC1=CC=C(C)O1 SY263040 [0,1,0,0,0,0|1,0,1]=3 100 B9R1.11 CCC(=O)C1=CC=CS1 SY031388 [0,1,0,0,0,0|1,1,1]=4 101 B9R1.11 COC(=O)C1=CC=CN1 SY001201 [0,1,0,0,0,0|1,1,1]=4 102 B9R1.11 COC(=O)C1=CC=CS1 SY048432 [0,1,0,0,0,0|0,2,1]=4 103 B9R1.11 COC(=O)C1=CC=NO1 SY078826 [0,1,0,0,0,0|1,1,1]=4 104 B9R1.11 NC(CO)C1=NC=CO1 SY291774 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.11 NNC(=O)C1=CC=CO1 SY048471 [0,1,0,0,0,0|2,0,1]=4 106 B9R1.11 O=C(CBr)C1=CC=CO1 SY040209 [0,1,0,0,0,0|2,0,1]=4 107 B9R1.11 O=C(CO)C1=CC=CO1 SY131034 [0,1,0,0,0,0|2,0,1]=4 108 B9R1.12 CCCCC1=NC=CN1 SY032916 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.12 CCNCC1=CC=CS1 SY002526 [0,1,0,0,0,0|1,1,0]=3 110 B9R1.12 ICCCC1=CC=CS1 SY249459 [0,1,0,0,0,0|1,1,0]=3 111 B9R1.12 NCCCC1=CC=CS1 SY035928 [0,1,0,0,0,0|1,1,0]=3 112 B9R1.12 OCCCC1=CC=CS1 SY003289 [0,1,0,0,0,0|1,1,0]=3 113 B9R1.12 OCCCC1=CSC=C1 SY026504 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.12 OCCCN1C=CC=N1 SY003679 [0,1,0,0,0,0|3,0,0]=4 115 B9R1.13 CC(C)CC1=NNC=C1 SY025165 [0,1,0,0,0,0|3,0,0]=4 116 B9R1.13 CC(N)CC1=CSC=N1 SY271542 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.13 CC(O)CC1=CC=CO1 SY021784 [0,1,0,0,0,0|1,0,0]=2 118 B9R1.13 CN(C)CC1=CC=CN1 SY017221 [0,1,0,0,0,0|2,0,0]=3 119 B9R1.13 CN(C)CC1=CNC=C1 SY274531 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.13 CN(C)CC1=CNC=N1 SY262771 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.13 CN(C)CC1=NNC=C1 SY262772 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.13 O=C(O)CC1=CC=CN1 SY010732 [0,1,0,0,0,0|3,0,0]=4 123 B9R1.13 O=C(O)CC1=CC=NO1 SY226123 [0,1,0,0,0,0|3,0,0]=4 124 B9R1.13 O=C(O)CC1=CN=CO1 SY129690 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.33 CC1=C(CC#N)OC=N1 SY233046 [0,1,0,0,0,0|3,0,0]=4 126 B9R2.2 C1=CN(C2CC2)N=C1 SY057500 [0,0,0,1,0,0|3,0,0]=4 127 B9R2.2 C1=CNC(C2CC2)=N1 SY014881 [0,0,0,1,0,0|3,0,0]=4 128 B9R2.2 C1=NC(C2CC2)=CS1 SY023291 [0,0,0,1,0,0|3,0,0]=4 129 B9R2.2 C1=NC=C(C2CC2)N1 SY059794 [0,0,0,1,0,0|3,0,0]=4 130 B9R2.2 C1=NNC(C2CC2)=C1 SY004983 [0,0,0,1,0,0|3,0,0]=4 131 B9R2.3 C1=CC2=C(CSC2)S1 SY246818 [0,0,0,1,0,0|0,1,0]=2 132 B9R2.3 C1=CC2=CSC=C2S1 SY238332 [0,0,0,1,0,0|0,1,2]=4 133 B9R2.3 C1=CN2CCCC2=N1 SY040307 [0,0,0,1,0,0|3,0,0]=4 134 B9R2.3 C1=NC2=C(CNC2)S1 SY018654 [0,0,0,1,0,0|2,1,0]=4 135 B9R2.3 C1=NC2=C(CNC2)S1 SY023812 [0,0,0,1,0,0|2,1,0]=4 136 B9R2.3 C1=NNC2=C1CNC2 SY018657 [0,0,0,1,0,0|3,0,0]=4 137 B9R1.8 BrCCC1=NC=CC=C1 SY004999 [0,0,0,0,0,1|3,0,0]=4 138 B9R1.8 CC#CC1=CC=CC=C1 SY048557 [0,0,0,0,0,1|2,0,1]=4 139 B9R1.8 CCCC1=CC=CCC1 SY292099 [0,0,0,0,0,1|2,0,0]=3 140 B9R1.8 CCCC1=NC=CC=C1 SY035538 [0,0,0,0,0,1|2,0,0]=3 141 B9R1.8 CNCC1=CC=CN=C1 SY002368 [0,0,0,0,0,1|2,0,0]=3 142 B9R1.8 CNCC1=CC=NC=C1 SY002386 [0,0,0,0,0,1|2,0,0]=3 143 B9R1.8 CNCC1=NC=CC=C1 SY003781 [0,0,0,0,0,1|2,0,0]=3 144 B9R1.8 COCC1=CC=CC=C1 SY049310 [0,0,0,0,0,1|1,1,0]=3 145 B9R1.8 N#CCC1=CC=NC=C1 SY012818 [0,0,0,0,0,1|3,0,0]=4 146 B9R1.8 N#CCC1=NC=CC=N1 SY097474 [0,0,0,0,0,1|3,0,0]=4 147 B9R1.8 NCCC1=CC=CN=C1 SY003234 [0,0,0,0,0,1|3,0,0]=4 148 B9R1.8 NNCC1=CC=CC=C1 SY004756 [0,0,0,0,0,1|3,0,0]=4 149 B9R1.8 NNCC1=CC=CC=C1 SY004764 [0,0,0,0,0,1|3,0,0]=4 150 B9R1.8 NNCC1=NC=CC=C1 SY042125 [0,0,0,0,0,1|3,0,0]=4 151 B9R1.8 NOCC1=CC=CC=C1 SY005671 [0,0,0,0,0,1|2,1,0]=4 152 B9R1.8 NOCC1=CC=CC=C1 SY018100 [0,0,0,0,0,1|2,1,0]=4 153 B9R1.8 NOCC1=CC=CN=C1 SY029692 [0,0,0,0,0,1|2,1,0]=4 154 B9R1.8 NOCC1=CC=CN=C1 SY281597 [0,0,0,0,0,1|2,1,0]=4 155 B9R1.8 NOCC1=CC=NC=C1 SY281602 [0,0,0,0,0,1|2,1,0]=4 156 B9R1.8 NOCC1=CC=NC=C1 SY281603 [0,0,0,0,0,1|2,1,0]=4 157 B9R1.8 NOCC1=NC=CC=C1 SY281576 [0,0,0,0,0,1|2,1,0]=4 158 B9R1.8 NOCC1=NC=CC=C1 SY281577 [0,0,0,0,0,1|2,1,0]=4 159 B9R1.8 OCCC1=CC=CN=C1 SY004170 [0,0,0,0,0,1|3,0,0]=4 160 B9R1.8 OCCC1=CC=NC=C1 SY001138 [0,0,0,0,0,1|3,0,0]=4 161 B9R1.8 OCCC1=NC=CN=C1 SY025413 [0,0,0,0,0,1|3,0,0]=4 162 B9R1.8 ONCC1=CC=CC=C1 SY019534 [0,0,0,0,0,1|3,0,0]=4 163 B9R1.8 ONCC1=CC=CC=C1 SY024088 [0,0,0,0,0,1|3,0,0]=4 164 B9R1.8 SCCC1=CC=CC=C1 SY039368 [0,0,0,0,0,1|3,0,0]=4 165 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 SY263029 [0,0,0,0,0,1|2,0,1]=4 166 B6R0.1 C=CC(O)CCC SY048915 [1,0,1,0,0,0|1,0,1]=4 167 B6R1.2 CC1=CC=CN1 SY004787 [2,0,0,0,0,0|1,0,0]=3 168 B6R1.2 CC1=CC=NO1 SY038700 [2,0,0,0,0,0|1,0,0]=3 169 B6R1.2 CC1=CNC=C1 SY014135 [2,0,0,0,0,0|2,0,0]=4 170 B6R1.2 CC1=COC=N1 SY046619 [2,0,0,0,0,0|2,0,0]=4 171 B6R1.2 CC1=CSC=N1 SY004152 [2,0,0,0,0,0|2,0,0]=4 172 B6R1.2 CC1=NC=CS1 SY009541 [2,0,0,0,0,0|1,1,0]=4 173 B6R1.2 IC1=CC=CS1 SY001504 [2,0,0,0,0,0|1,1,0]=4 174 B6R1.2 IC1=NC=CO1 SY098116 [2,0,0,0,0,0|2,0,0]=4 175 B6R1.2 NC1=NC=CO1 SY004397 [2,0,0,0,0,0|2,0,0]=4 176 B6R1.2 O=C1C=CCO1 SY017893 [2,0,0,0,0,0|0,1,1]=4 177 B6R1.2 O=C1OC=CO1 SY001314 [2,0,0,0,0,0|1,1,0]=4 178 B6R1.2 OC1=CC=CS1 SY248518 [2,0,0,0,0,0|0,2,0]=4 179 B8R1.1 BrCC1=CC=C(Br)S1 SY257749 [1,1,0,0,0,0|1,1,0]=4 180 B8R1.1 C#CC1=CC=C(C)O1 SY284949 [1,1,0,0,0,0|0,0,2]=4 181 B8R1.1 CC1=CC=C(C=O)O1 SY001535 [1,1,0,0,0,0|0,1,1]=4 182 B8R1.1 CC1=CC=C(CN)S1 SY031087 [1,1,0,0,0,0|1,1,0]=4 183 B8R1.1 CC1=CC=C(CO)O1 SY046643 [1,1,0,0,0,0|0,1,0]=3 184 B8R1.1 CC1=NOC(CBr)=C1 SY036655 [1,1,0,0,0,0|2,0,0]=4 185 B8R1.1 CCC1=CC(N)=NN1 SY008703 [1,1,0,0,0,0|2,0,0]=4 186 B8R1.1 CCC1=CC(O)=NO1 SY248522 [1,1,0,0,0,0|1,0,0]=3 187 B8R1.1 CCC1=CCC(C)=C1 SY308291 [1,1,0,0,0,0|1,0,1]=4 188 B8R1.1 CCC1=CN=C(N)S1 SY106256 [1,1,0,0,0,0|1,1,0]=4 189 B8R1.1 CCC1=NC(C)=CN1 SY036797 [1,1,0,0,0,0|2,0,0]=4 190 B8R1.1 CCN1C=C(Br)C=N1 SY012330 [1,1,0,0,0,0|2,0,0]=4 191 B8R1.1 CCN1C=C(I)C=N1 SY026014 [1,1,0,0,0,0|2,0,0]=4 192 B8R1.1 CCN1C=C(N)C=N1 SY024886 [1,1,0,0,0,0|2,0,0]=4 193 B8R1.1 COC1=CC(N)=NO1 SY006835 [1,1,0,0,0,0|1,1,0]=4 194 B8R1.1 CSC1=NNC(N)=C1 SY240081 [1,1,0,0,0,0|2,0,0]=4 195 B8R1.1 NCC1=CC=C(Br)O1 SY019914 [1,1,0,0,0,0|1,0,0]=3 196 B8R1.1 NCC1=CC=C(Br)S1 SY019897 [1,1,0,0,0,0|1,1,0]=4 197 B8R1.1 NCC1=CC=C(F)S1 SY098666 [1,1,0,0,0,0|1,1,0]=4 198 B8R1.1 O=C1C=CC(CBr)O1 SY247740 [1,1,0,0,0,0|1,0,1]=4 199 B8R1.1 O=CC1=CC=C(Br)O1 SY008053 [1,1,0,0,0,0|0,1,1]=4 200 B8R1.1 O=CC1=CC=C(Cl)O1 SY031372 [1,1,0,0,0,0|0,1,1]=4 201 B8R1.1 OCC1=CC(Br)=CS1 SY023657 [1,1,0,0,0,0|0,2,0]=4 202 B8R1.1 OCC1=CC=C(Cl)O1 SY251088 [1,1,0,0,0,0|0,1,0]=3 203 B8R1.1 OCC1=CC=C(I)O1 SY264013 [1,1,0,0,0,0|0,1,0]=3 204 B8R1.7 C=C(C)C1=CC=CO1 SY225341 [1,1,0,0,0,0|0,0,1]=3 205 B8R1.7 C=C(C)C1=CC=CS1 SY225340 [1,1,0,0,0,0|0,1,1]=4 206 B8R1.7 CC(=O)C1=CC=CN1 SY011279 [1,1,0,0,0,0|1,0,1]=4 207 B8R1.7 CC(=O)C1=NC=CO1 SY148104 [1,1,0,0,0,0|1,0,1]=4 208 B8R1.7 CC(C)C1=CNC=N1 SY037472 [1,1,0,0,0,0|2,0,0]=4 209 B8R1.7 CC(C)C1=NNC=C1 SY025107 [1,1,0,0,0,0|2,0,0]=4 210 B8R1.7 CC(C)N1C=CC=C1 SY300558 [1,1,0,0,0,0|2,0,0]=4 211 B8R1.7 CC(C)N1C=CC=N1 SY024130 [1,1,0,0,0,0|2,0,0]=4 212 B8R1.7 CC(N)C1=NC=CS1 SY006409 [1,1,0,0,0,0|1,1,0]=4 213 B8R1.7 CC(N)C1=NC=CS1 SY020075 [1,1,0,0,0,0|1,1,0]=4 214 B8R1.7 C[C@@H](N)C1=CC=CS1 SY193850 [1,1,0,0,0,0|0,1,0]=3 215 B8R1.7 C[C@@H](N)C1=CNC=N1 SY307692 [1,1,0,0,0,0|2,0,0]=4 216 B8R1.7 C[C@H](N)C1=CNC=N1 SY307691 [1,1,0,0,0,0|2,0,0]=4 217 B8R1.7 FC(F)C1=CC=CS1 SY265629 [1,1,0,0,0,0|1,1,0]=4 218 B8R1.7 OB(O)C1=CC=CO1 SY013494 [1,1,0,0,0,0|1,1,0]=4 219 B8R1.11 CC1=C(CCl)OC=N1 SY233036 [1,1,0,0,0,0|2,0,0]=4 220 B8R1.11 CC1=C(CO)ON=C1 SY226579 [1,1,0,0,0,0|1,1,0]=4 221 B8R1.11 CCC1=CN=CN1C SY268701 [1,1,0,0,0,0|2,0,0]=4 222 B8R1.11 CCC1=NNC=C1I SY247711 [1,1,0,0,0,0|2,0,0]=4 223 B8R1.11 CCN1N=CC=C1N SY042021 [1,1,0,0,0,0|2,0,0]=4 224 B8R1.11 NC1=C(CO)SC=C1 SY269223 [1,1,0,0,0,0|0,2,0]=4 225 B8R1.11 O=CC1=C(Cl)C=CO1 SY236778 [1,1,0,0,0,0|0,1,1]=4 226 B10R1.1 CCCC1=CC=C(Br)C=C1 SY016468 [0,1,0,0,0,1|2,0,0]=4 227 B10R1.1 CNCC1=CC=C(Br)C=C1 SY002627 [0,1,0,0,0,1|2,0,0]=4 228 B10R1.1 CNCC1=CC=C(Br)C=C1 SY006057 [0,1,0,0,0,1|2,0,0]=4 229 B10R1.1 CNCC1=CC=C(C)C=C1 SY004191 [0,1,0,0,0,1|2,0,0]=4 230 B10R1.1 CNCC1=CC=C(C)C=C1 SY016090 [0,1,0,0,0,1|2,0,0]=4 231 B10R1.1 CNCC1=CC=C(Cl)C=C1 SY002430 [0,1,0,0,0,1|2,0,0]=4 232 B10R1.1 CNCC1=CC=C(Cl)C=C1 SY002434 [0,1,0,0,0,1|2,0,0]=4 233 B10R1.1 CNCC1=CC=C(F)C=C1 SY002630 [0,1,0,0,0,1|2,0,0]=4 234 B10R1.1 CNCC1=CC=C(N)C=C1 SY003698 [0,1,0,0,0,1|2,0,0]=4 235 B10R1.1 CNCC1=CC=C(O)C=C1 SY018667 [0,1,0,0,0,1|2,0,0]=4 236 B10R1.1 CNCC1=CN=C(C)C=C1 SY031591 [0,1,0,0,0,1|2,0,0]=4 237 B10R1.1 COCC1=CC=C(N)C=C1 SY003771 [0,1,0,0,0,1|1,1,0]=4 238 B10R1.1 COCC1=CC=C(O)C=C1 SY026430 [0,1,0,0,0,1|1,1,0]=4 239 B10R1.4 CNCC1=C(Br)C=CC=C1 SY005450 [0,1,0,0,0,1|2,0,0]=4 240 B10R1.4 CNCC1=CC=CC=C1C SY021461 [0,1,0,0,0,1|2,0,0]=4 241 B10R1.4 CNCC1=CC=CC=C1Cl SY023323 [0,1,0,0,0,1|2,0,0]=4 242 B10R1.4 CNCC1=CC=CC=C1F SY005451 [0,1,0,0,0,1|2,0,0]=4 243 B10R1.4 CNCC1=CC=CN=C1C SY031590 [0,1,0,0,0,1|2,0,0]=4 244 B10R1.4 COCC1=CC=CC=C1O SY026429 [0,1,0,0,0,1|1,1,0]=4 245 B10R1.10 CNCC1=CC(Br)=NC=C1 SY292039 [0,1,0,0,0,1|2,0,0]=4 246 B10R1.10 CNCC1=CC=CC(Br)=C1 SY002048 [0,1,0,0,0,1|2,0,0]=4 247 B10R1.10 CNCC1=CC=CC(Br)=C1 SY002435 [0,1,0,0,0,1|2,0,0]=4 248 B10R1.10 CNCC1=CC=CC(Cl)=C1 SY104087 [0,1,0,0,0,1|2,0,0]=4 249 B10R1.10 CNCC1=CC=CC(F)=C1 SY002641 [0,1,0,0,0,1|2,0,0]=4 250 B10R1.10 CNCC1=CC=CC(O)=C1 SY018671 [0,1,0,0,0,1|2,0,0]=4 251 B10R1.10 COCC1=CC=CC(N)=C1 SY003772 [0,1,0,0,0,1|1,1,0]=4 252 B10R1.10 COCC1=CN=CC(Br)=C1 SY250264 [0,1,0,0,0,1|1,1,0]=4 253 B10R1.10 COCC1=NC=CC(N)=N1 SY021957 [0,1,0,0,0,1|1,1,0]=4 254 B10R1.10 CSCC1=CC(N)=NC=C1 SY073684 [0,1,0,0,0,1|1,0,0]=3 255 B10R1.15 CCC(N)C1=CC=CN=C1 SY014378 [0,1,0,0,0,1|2,0,0]=4 256 B10R1.15 CCC(N)C1=CC=CN=C1 SY023048 [0,1,0,0,0,1|2,0,0]=4 257 B10R1.15 CCC(N)C1=CC=NC=C1 SY011556 [0,1,0,0,0,1|2,0,0]=4 258 B10R1.15 CCC(N)C1=NC=CC=C1 SY014377 [0,1,0,0,0,1|2,0,0]=4 259 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [0,1,0,0,0,1|2,0,0]=4 260 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [0,1,0,0,0,1|2,0,0]=4 261 B10R1.17 CCNCC1=CC=CN=C1 SY005910 [0,1,0,0,0,1|2,0,0]=4 262 B10R1.17 CCNCC1=CC=NC=C1 SY009304 [0,1,0,0,0,1|2,0,0]=4 263 B10R1.17 CCNCC1=NC=CC=C1 SY005911 [0,1,0,0,0,1|2,0,0]=4 264 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [0,1,0,0,0,1|2,0,0]=4 265 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [0,1,0,0,0,1|2,0,0]=4 266 B10R1.17 ClCOCC1=CC=CC=C1 SY003069 [0,1,0,0,0,1|1,1,0]=4 267 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [0,1,0,0,0,1|2,0,0]=4 268 B10R1.17 ICCCC1=CC=CN=C1 SY250698 [0,1,0,0,0,1|2,0,0]=4 269 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [0,1,0,0,0,1|2,0,0]=4 270 B10R1.17 NCCCC1=CC=CN=C1 SY022422 [0,1,0,0,0,1|2,0,0]=4 271 B10R1.17 NCCCC1=CC=NC=C1 SY022421 [0,1,0,0,0,1|2,0,0]=4 272 B10R1.17 NCCCC1=NC=CC=C1 SY022423 [0,1,0,0,0,1|2,0,0]=4 273 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [0,1,0,0,0,1|2,0,0]=4 274 B10R1.17 OCCCC1=CC=CN=C1 SY129435 [0,1,0,0,0,1|2,0,0]=4 275 B10R1.17 OCCCC1=CC=NC=C1 SY003677 [0,1,0,0,0,1|2,0,0]=4 276 B10R1.17 OCCCC1=NC=CC=C1 SY023125 [0,1,0,0,0,1|2,0,0]=4 277 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [0,1,0,0,0,1|2,0,0]=4 278 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [0,1,0,0,0,1|2,0,0]=4 279 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [0,1,0,0,0,1|2,0,0]=4 280 B10R1.18 CC(C)CC1=CC=NC=C1 SY028398 [0,1,0,0,0,1|2,0,0]=4 281 B10R1.18 CC(O)CC1=CC=CC=C1 SY051093 [0,1,0,0,0,1|2,0,0]=4 282 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 SY245167 [0,2,0,0,0,0|1,0,0]=3 283 B10R1.14 COC(=O)C1=CC(Br)=CO1 SY023052 [0,2,0,0,0,0|0,1,1]=4 284 B10R1.14 COC(=O)C1=CC(N)=CO1 SY269578 [0,2,0,0,0,0|0,1,1]=4 285 B10R1.14 COC(=O)C1=CC=C(Br)O1 SY022677 [0,2,0,0,0,0|0,1,1]=4 286 B10R1.14 COC(=O)C1=CC=C(Cl)O1 SY030840 [0,2,0,0,0,0|0,1,1]=4 287 B10R1.14 COC(=O)C1=CC=C(N)O1 SY036521 [0,2,0,0,0,0|0,1,1]=4 288 B10R1.16 CC1=CC=C(CNC=O)O1 SY266774 [0,2,0,0,0,0|1,0,1]=4 289 B10R1.6 COC(C)(C)C1=CC=CS1 SY233048 [0,2,0,0,0,0|0,2,0]=4 290 B10R1.11 CCOC(=O)C1=CC=CO1 SY013608 [0,2,0,0,0,0|0,1,1]=4 291 B10R1.149 COC(=O)C1=C(C)C=CO1 SY048278 [0,2,0,0,0,0|0,1,1]=4 292 B10R1.149 COC(=O)C1=C(F)C=CO1 SY236188 [0,2,0,0,0,0|0,1,1]=4 293 B10R1.149 COC(=O)C1=C(N)C=CO1 SY056887 [0,2,0,0,0,0|0,1,1]=4 294 B10R1.21 CCCCCC1=CC=CS1 SY034123 [0,2,0,0,0,0|1,1,0]=4 295 B10R1.27 COC(=O)CC1=CC=CS1 SY233030 [0,2,0,0,0,0|0,2,0]=4 296 B10R1.64 O=C(O)CC1=C(Cl)C=CO1 SY233430 [0,2,0,0,0,0|2,0,0]=4 297 B10R1.281 C[N+](C)(C)CC1=CC=CN1 SY262601 [0,2,0,0,0,0|2,0,0]=4 298 B8R1.2 CSC1=NC=CC=C1 SY015557 [0,0,1,1,0,0|1,0,1]=4 299 B8R1.5 CC1=C(O)C=CC=N1 SY007645 [0,0,1,1,0,0|2,0,0]=4 300 B8R1.4 CC1=NC(O)=CC=C1 SY009294 [0,0,1,1,0,0|2,0,0]=4 301 B10R2.6 C1=CC(C2CC2)=CC=N1 SY275036 [0,0,0,1,0,1|2,0,0]=4 302 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 SY033347 [0,0,0,1,0,1|1,1,0]=4 303 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 SY032955 [0,0,0,1,0,1|1,1,0]=4 304 B10R2.7 C1=CC2=C(C=C1)CNC2 SY006502 [0,0,0,1,0,1|2,0,0]=4 305 B10R2.7 C1=CC2=C(C=N1)CNC2 SY016749 [0,0,0,1,0,1|2,0,0]=4 306 B10R2.7 C1=CC=C2CNCC2=C1 SY006104 [0,0,0,1,0,1|2,0,0]=4 307 B10R2.7 C1=CC=C2CSCC2=C1 SY143431 [0,0,0,1,0,1|1,0,0]=3 308 B10R2.7 C1=CN=C2CCCC2=C1 SY005163 [0,0,0,1,0,1|2,0,0]=4 309 B10R2.7 C1=CN=C2CNCC2=C1 SY002978 [0,0,0,1,0,1|2,0,0]=4 310 B10R2.7 C1=CN=C2CNCC2=C1 SY005549 [0,0,0,1,0,1|2,0,0]=4 311 B10R2.7 C1=CN=C2CNCC2=N1 SY018653 [0,0,0,1,0,1|2,0,0]=4 312 B10R2.7 C1=CN=C2CNCC2=N1 SY031903 [0,0,0,1,0,1|2,0,0]=4 313 B10R2.7 C1=NC=C2CNCC2=C1 SY006966 [0,0,0,1,0,1|2,0,0]=4 314 B10R2.7 C1=NC=C2CNCC2=N1 SY006962 [0,0,0,1,0,1|2,0,0]=4 315 B10R2.7 C1=NC=C2CNCC2=N1 SY018652 [0,0,0,1,0,1|2,0,0]=4 316 B10R2.2 CC1=NC2=C(CNC2)O1 SY291678 [0,1,0,1,0,0|2,0,0]=4