0 B8R1.8 BrCCN1C=CC=C1 11545 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 C#CCN1C=CC=N1 W16053 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CCCC1=CC=CS1 F17557 [0,0,0,0,0,0|1,1,0]=2 3 B8R1.8 CCCC1=CSC=C1 T71823 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 CCCC1=NC=CN1 AC7723 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.8 CCCC1=NC=CS1 D84132 [0,0,0,0,0,0|2,1,0]=3 6 B8R1.8 CCCN1C=CC=N1 31937 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.8 CCCN1C=CN=C1 D70905 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.8 CCNC1=NC=CS1 D82871 [0,0,0,0,0,0|3,1,0]=4 9 B8R1.8 CCOC1=NC=CS1 D84242 [0,0,0,0,0,0|3,1,0]=4 10 B8R1.8 CNCC1=CC=CO1 74988 [0,0,0,0,0,0|1,0,0]=1 11 B8R1.8 CNCC1=CC=CS1 27064 [0,0,0,0,0,0|1,1,0]=2 12 B8R1.8 CNCC1=CC=CS1 76689 [0,0,0,0,0,0|1,1,0]=2 13 B8R1.8 CNCC1=CSC=C1 C73993 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.8 COCN1C=CN=C1 36028 [0,0,0,0,0,0|3,1,0]=4 15 B8R1.8 CSCC1=CC=CO1 D90650 [0,0,0,0,0,0|0,0,0]=0 16 B8R1.8 ClCCN1C=CC=C1 11544 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.8 ClCCN1C=CC=N1 F11115 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.8 N#CCC1=CC=CN1 AC1364 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.8 N#CCC1=CC=CS1 D71260 [0,0,0,0,0,0|2,1,0]=3 20 B8R1.8 N#CCC1=CN=CN1 37557 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.8 N#CCC1=CNC=N1 71077 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.8 N#CCC1=CSC=C1 70757 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 NCCC1=CC=CO1 51136 [0,0,0,0,0,0|2,0,0]=2 24 B8R1.8 NCCC1=CC=CS1 28447 [0,0,0,0,0,0|2,1,0]=3 25 B8R1.8 NCCC1=CN=CN1 73730 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.8 NCCC1=CN=CN1 D90807 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.8 NCCC1=CNC=N1 D97233 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.8 NCCC1=CNC=N1 F10913 [0,0,0,0,0,0|4,0,0]=4 29 B8R1.8 NCCC1=CSC=C1 51624 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.8 NCCN1C=CC=C1 C74522 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.8 OCCC1=CC=CS1 P10012 [0,0,0,0,0,0|2,1,0]=3 32 B8R1.8 OCCC1=CN=CN1 25474 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.8 OCCC1=CN=CN1 C73445 [0,0,0,0,0,0|4,0,0]=4 34 B8R1.8 OCCC1=CSC=C1 62948 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.8 OCCC1=NC=CN1 29051 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.8 OCCN1C=CC=N1 28722 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.8 O\N=C\C1=CC=CS1 66648 [0,0,0,0,0,0|2,1,1]=4 38 B7R1.1 BrCC1=CSC=C1 54789 [1,0,0,0,0,0|3,0,0]=4 39 B7R1.1 BrCC1=NC=CN1 O10503 [1,0,0,0,0,0|3,0,0]=4 40 B7R1.1 C#CC1=CC=CS1 75533 [1,0,0,0,0,0|0,1,2]=4 41 B7R1.1 CCC1=CC=CO1 S10154 [1,0,0,0,0,0|0,0,0]=1 42 B7R1.1 CCC1=CC=CS1 D90498 [1,0,0,0,0,0|0,1,0]=2 43 B7R1.1 CCC1=CCC=C1 F14114 [1,0,0,0,0,0|1,0,1]=3 44 B7R1.1 CCC1=CN=CN1 32046 [1,0,0,0,0,0|2,0,0]=3 45 B7R1.1 CCC1=CSC=C1 F14946 [1,0,0,0,0,0|2,0,0]=3 46 B7R1.1 CCC1=NC=CN1 D77759 [1,0,0,0,0,0|2,0,0]=3 47 B7R1.1 CCC1=NC=CS1 D90524 [1,0,0,0,0,0|1,1,0]=3 48 B7R1.1 CCC1=NNC=N1 D70507 [1,0,0,0,0,0|3,0,0]=4 49 B7R1.1 CCN1C=CC=N1 28726 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.1 CCN1C=CN=C1 D70860 [1,0,0,0,0,0|3,0,0]=4 51 B7R1.1 CCN1C=CN=N1 D80212 [1,0,0,0,0,0|3,0,0]=4 52 B7R1.1 COC1=CC=CS1 F14921 [1,0,0,0,0,0|0,2,0]=3 53 B7R1.1 COC1=CSC=C1 63554 [1,0,0,0,0,0|2,1,0]=4 54 B7R1.1 COC1=NC=CS1 O10826 [1,0,0,0,0,0|1,2,0]=4 55 B7R1.1 CSC1=CSC=C1 D97361 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.1 CSC1=NC=CS1 H10071 [1,0,0,0,0,0|1,1,0]=3 57 B7R1.1 ClCC1=CN=CN1 70852 [1,0,0,0,0,0|3,0,0]=4 58 B7R1.1 ClCC1=CN=CS1 27423 [1,0,0,0,0,0|2,1,0]=4 59 B7R1.1 ClCC1=CSC=N1 CL2524 [1,0,0,0,0,0|3,0,0]=4 60 B7R1.1 ClCC1=NC=CO1 24216 [1,0,0,0,0,0|2,0,0]=3 61 B7R1.1 ClCC1=NNC=C1 29752 [1,0,0,0,0,0|3,0,0]=4 62 B7R1.1 N#CC1=CC=CN1 57004 [1,0,0,0,0,0|2,0,1]=4 63 B7R1.1 N#CC1=CC=CO1 67660 [1,0,0,0,0,0|1,0,1]=3 64 B7R1.1 N#CC1=CC=CS1 11864 [1,0,0,0,0,0|1,1,1]=4 65 B7R1.1 NCC1=CC=CN1 24683 [1,0,0,0,0,0|2,0,0]=3 66 B7R1.1 NCC1=CC=CS1 77953 [1,0,0,0,0,0|1,1,0]=3 67 B7R1.1 NCC1=CC=NN1 79202 [1,0,0,0,0,0|3,0,0]=4 68 B7R1.1 NCC1=CN=CO1 34684 [1,0,0,0,0,0|2,0,0]=3 69 B7R1.1 NCC1=CN=CO1 38284 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.1 NCC1=CN=CS1 20220 [1,0,0,0,0,0|2,1,0]=4 71 B7R1.1 NCC1=CN=CS1 P15769 [1,0,0,0,0,0|2,1,0]=4 72 B7R1.1 NCC1=CNC=N1 71831 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.1 NCC1=COC=C1 F14683 [1,0,0,0,0,0|3,0,0]=4 74 B7R1.1 NCC1=COC=N1 AC7758 [1,0,0,0,0,0|3,0,0]=4 75 B7R1.1 NCC1=CSC=C1 23759 [1,0,0,0,0,0|3,0,0]=4 76 B7R1.1 NCC1=CSC=C1 84938 [1,0,0,0,0,0|3,0,0]=4 77 B7R1.1 NCC1=NC=CN1 71597 [1,0,0,0,0,0|3,0,0]=4 78 B7R1.1 NCC1=NC=CN1 C90135 [1,0,0,0,0,0|3,0,0]=4 79 B7R1.1 NCC1=NC=CO1 64820 [1,0,0,0,0,0|2,0,0]=3 80 B7R1.1 NCC1=NC=CS1 20218 [1,0,0,0,0,0|2,1,0]=4 81 B7R1.1 NCC1=NC=CS1 38316 [1,0,0,0,0,0|2,1,0]=4 82 B7R1.1 NCC1=NC=CS1 38317 [1,0,0,0,0,0|2,1,0]=4 83 B7R1.1 O=CC1=CC=CN1 61406 [1,0,0,0,0,0|1,1,1]=4 84 B7R1.1 O=CC1=CC=CS1 AC8106 [1,0,0,0,0,0|0,2,1]=4 85 B7R1.1 O=CC1=NC=CO1 64760 [1,0,0,0,0,0|1,1,1]=4 86 B7R1.1 OCC1=CC=CS1 P10010 [1,0,0,0,0,0|0,2,0]=3 87 B7R1.1 OCC1=CCC=C1 F14117 [1,0,0,0,0,0|1,1,1]=4 88 B7R1.1 OCC1=CN=CN1 71235 [1,0,0,0,0,0|2,1,0]=4 89 B7R1.1 OCC1=CN=CO1 25731 [1,0,0,0,0,0|1,1,0]=3 90 B7R1.1 OCC1=CN=CS1 28400 [1,0,0,0,0,0|1,2,0]=4 91 B7R1.1 OCC1=CNC=N1 62333 [1,0,0,0,0,0|2,1,0]=4 92 B7R1.1 OCC1=COC=C1 35423 [1,0,0,0,0,0|2,1,0]=4 93 B7R1.1 OCC1=COC=N1 38413 [1,0,0,0,0,0|2,1,0]=4 94 B7R1.1 OCC1=CSC=C1 33113 [1,0,0,0,0,0|2,1,0]=4 95 B7R1.1 OCC1=CSC=N1 24603 [1,0,0,0,0,0|2,1,0]=4 96 B7R1.1 OCC1=NC=CN1 28922 [1,0,0,0,0,0|2,1,0]=4 97 B7R1.1 OCC1=NC=CO1 50737 [1,0,0,0,0,0|1,1,0]=3 98 B7R1.1 OCC1=NC=CS1 52484 [1,0,0,0,0,0|1,2,0]=4 99 B7R1.1 OCC1=NNC=C1 29405 [1,0,0,0,0,0|2,1,0]=4 100 B7R1.1 OCC1=NOC=C1 26711 [1,0,0,0,0,0|2,1,0]=4 101 B7R1.1 OCN1C=CC=N1 23685 [1,0,0,0,0,0|2,1,0]=4 102 B9R1.7 CCCC1=CC(=O)OC1 E70333 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.7 CCCC1=CC(N)=NN1 29762 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.7 CCCC1=CC=C(Br)S1 F17551 [0,1,0,0,0,0|1,1,0]=3 105 B9R1.7 CCCC1=CSC(N)=N1 O11283 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.7 CCCC1=NOC(N)=C1 71511 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.7 CCCN1C=C(Br)C=N1 P15307 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.7 CCCN1C=C(N)C=N1 AT10306 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.7 CNCC1=CN=C(Cl)S1 36645 [0,1,0,0,0,0|2,1,0]=4 110 B9R1.7 COCN1C=C(N)C=N1 31904 [0,1,0,0,0,0|2,1,0]=4 111 B9R1.7 NCCC1=CC=C(Br)S1 AC1431 [0,1,0,0,0,0|2,1,0]=4 112 B9R1.11 CCC(=O)C1=CC=CN1 71325 [0,1,0,0,0,0|2,0,1]=4 113 B9R1.11 CCC(=O)C1=CC=CS1 I10171 [0,1,0,0,0,0|1,1,1]=4 114 B9R1.11 CC[C@H](C)C1=NC=CS1 A11127 [0,1,0,0,0,0|2,1,0]=4 115 B9R1.11 COC(=O)C1=CC=CN1 CL2801 [0,1,0,0,0,0|1,1,1]=4 116 B9R1.11 COC(=O)C1=CC=CO1 D78223 [0,1,0,0,0,0|0,1,1]=3 117 B9R1.11 COC(=O)C1=CC=CS1 20523 [0,1,0,0,0,0|0,2,1]=4 118 B9R1.11 COC(=O)C1=CN=CO1 78384 [0,1,0,0,0,0|1,1,1]=4 119 B9R1.11 CSC(=N)C1=CC=CS1 77278 [0,1,0,0,0,0|0,1,1]=3 120 B9R1.11 CSC(=O)C1=CC=CO1 D91534 [0,1,0,0,0,0|0,0,1]=2 121 B9R1.11 NC[C@H](O)C1=CC=CO1 71472 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.11 NNC(=O)C1=CC=CO1 F10405 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.12 CCCCC1=CC=CO1 D88935 [0,1,0,0,0,0|1,0,0]=2 124 B9R1.12 CCCCC1=CC=CS1 F15458 [0,1,0,0,0,0|1,1,0]=3 125 B9R1.12 CCCCC1=CSC=C1 F10859 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.12 CCCCC1=NC=CN1 AC7925 [0,1,0,0,0,0|3,0,0]=4 127 B9R1.12 CCCCN1C=CC=N1 D83149 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.12 CCNCC1=CC=CS1 29339 [0,1,0,0,0,0|1,1,0]=3 129 B9R1.12 CCOCC1=CC=CO1 O10522 [0,1,0,0,0,0|0,1,0]=2 130 B9R1.12 CSSCC1=CC=CO1 D90679 [0,1,0,0,0,0|0,0,0]=1 131 B9R1.12 NCCCC1=CC=CS1 F20202 [0,1,0,0,0,0|1,1,0]=3 132 B9R1.12 O=C\C=C\C1=CC=CO1 O10885 [0,1,0,0,0,0|1,0,2]=4 133 B9R1.12 OCCCC1=CC=CS1 30464 [0,1,0,0,0,0|1,1,0]=3 134 B9R1.12 OCCCN1C=CC=C1 79041 [0,1,0,0,0,0|3,0,0]=4 135 B9R1.12 OCCCN1C=CC=N1 30976 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.13 CC(C)CC1=NC=CS1 O10809 [0,1,0,0,0,0|2,1,0]=4 137 B9R1.13 C[C@H](O)CC1=CC=CO1 31846 [0,1,0,0,0,0|1,0,0]=2 138 B9R1.13 NC(=O)CC1=CC=CS1 D85917 [0,1,0,0,0,0|2,1,0]=4 139 B9R1.13 O=C(Cl)CC1=CC=CS1 D78176 [0,1,0,0,0,0|2,1,0]=4 140 B9R1.13 O=C(O)CC1=CC=CS1 P10011 [0,1,0,0,0,0|2,1,0]=4 141 B9R1.33 CCOC1=C(C)N=CO1 C75335 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.33 CSSC1=C(C)OC=C1 D91538 [0,1,0,0,0,0|3,0,0]=4 143 B7R0.1 C=CCOCCCC D88441 [0,0,1,0,0,0|1,0,2]=4 144 B7R0.1 CCCC\C=C\C=O 39424 [0,0,1,0,0,0|1,0,2]=4 145 B7R0.1 CC\C=C\C=C\C=O D90931 [0,0,1,0,0,0|1,0,2]=4 146 B7R0.7 CCOC(=O)CSC I10203 [0,0,1,0,0,0|1,0,2]=4 147 B9R2.2 C1=CC(C2CC2)=NN1 33946 [0,0,0,1,0,0|3,0,0]=4 148 B9R2.2 C1=NC(C2CC2)=CS1 31626 [0,0,0,1,0,0|3,0,0]=4 149 B9R2.3 C1=CN2CCCC2=N1 Y10189 [0,0,0,1,0,0|3,0,0]=4 150 B9R2.3 C1=NNC2=C1CCC2 70841 [0,0,0,1,0,0|3,0,0]=4 151 B9R2.3 C1=NNC2=C1CNC2 P10591 [0,0,0,1,0,0|3,0,0]=4 152 B9R2.3 C1=NNC2=C1CNC2 SC3301 [0,0,0,1,0,0|3,0,0]=4 153 B9R1.8 BrCCC1=CC=CC=C1 S12296 [0,0,0,0,0,1|3,0,0]=4 154 B9R1.8 BrCCC1=NC=CC=C1 54525 [0,0,0,0,0,1|3,0,0]=4 155 B9R1.8 C#CCC1=CC=CC=C1 A11825 [0,0,0,0,0,1|2,0,1]=4 156 B9R1.8 C=CCC1=CC=CC=C1 FD14063 [0,0,0,0,0,1|2,0,1]=4 157 B9R1.8 CC#CC1=CC=CC=C1 D71012 [0,0,0,0,0,1|2,0,1]=4 158 B9R1.8 CCCC1=CC=CC=C1 F10002 [0,0,0,0,0,1|2,0,0]=3 159 B9R1.8 CCCC1=CC=NC=C1 D86491 [0,0,0,0,0,1|2,0,0]=3 160 B9R1.8 CCCC1=NC=CC=C1 A10924 [0,0,0,0,0,1|2,0,0]=3 161 B9R1.8 CCCC1=NC=CN=C1 D70525 [0,0,0,0,0,1|2,0,0]=3 162 B9R1.8 CCNC1=NC=CC=C1 H11775 [0,0,0,0,0,1|3,0,0]=4 163 B9R1.8 CCOC1=CC=CC=C1 D78866 [0,0,0,0,0,1|3,0,0]=4 164 B9R1.8 CCOC1=NC=CC=C1 28909 [0,0,0,0,0,1|3,0,0]=4 165 B9R1.8 CCOC1=NC=CN=C1 AC1594 [0,0,0,0,0,1|3,0,0]=4 166 B9R1.8 CCSC1=CC=CC=C1 H10383 [0,0,0,0,0,1|3,0,0]=4 167 B9R1.8 CNCC1=CC=CC=C1 AR1001 [0,0,0,0,0,1|2,0,0]=3 168 B9R1.8 CNCC1=CC=CN=C1 28981 [0,0,0,0,0,1|2,0,0]=3 169 B9R1.8 CNCC1=CC=CN=C1 AR1268 [0,0,0,0,0,1|2,0,0]=3 170 B9R1.8 CNCC1=CC=NC=C1 30756 [0,0,0,0,0,1|2,0,0]=3 171 B9R1.8 CNCC1=NC=CC=C1 29930 [0,0,0,0,0,1|2,0,0]=3 172 B9R1.8 CNCC1=NC=CC=C1 AR1010 [0,0,0,0,0,1|2,0,0]=3 173 B9R1.8 COCC1=CC=CC=C1 D88644 [0,0,0,0,0,1|1,1,0]=3 174 B9R1.8 COCC1=NC=CC=C1 23564 [0,0,0,0,0,1|1,1,0]=3 175 B9R1.8 C\N=C\C1=CC=CC=C1 D94771 [0,0,0,0,0,1|2,0,1]=4 176 B9R1.8 ClCCC1=CC=CC=C1 D70839 [0,0,0,0,0,1|3,0,0]=4 177 B9R1.8 ICCC1=CC=CC=C1 D70924 [0,0,0,0,0,1|3,0,0]=4 178 B9R1.8 N#CCC1=CC=NC=C1 74034 [0,0,0,0,0,1|3,0,0]=4 179 B9R1.8 N#CCC1=CC=NC=C1 81779 [0,0,0,0,0,1|3,0,0]=4 180 B9R1.8 N#CCC1=CN=CC=C1 24086 [0,0,0,0,0,1|3,0,0]=4 181 B9R1.8 N#CCC1=NC=CC=C1 73694 [0,0,0,0,0,1|3,0,0]=4 182 B9R1.8 N#CCC1=NC=NC=C1 88775 [0,0,0,0,0,1|3,0,0]=4 183 B9R1.8 NCCC1=CC=CC=C1 D78532 [0,0,0,0,0,1|3,0,0]=4 184 B9R1.8 NCCC1=CC=CN=C1 51507 [0,0,0,0,0,1|3,0,0]=4 185 B9R1.8 NCCC1=CC=CN=C1 51508 [0,0,0,0,0,1|3,0,0]=4 186 B9R1.8 NCCC1=CC=NC=C1 51916 [0,0,0,0,0,1|3,0,0]=4 187 B9R1.8 NCCC1=CC=NC=C1 N12034 [0,0,0,0,0,1|3,0,0]=4 188 B9R1.8 NCCC1=NC=CC=C1 AB1583 [0,0,0,0,0,1|3,0,0]=4 189 B9R1.8 NNCC1=CC=CC=C1 53542 [0,0,0,0,0,1|3,0,0]=4 190 B9R1.8 NNCC1=CC=CC=C1 53594 [0,0,0,0,0,1|3,0,0]=4 191 B9R1.8 NNCC1=CC=CC=C1 78678 [0,0,0,0,0,1|3,0,0]=4 192 B9R1.8 NNCC1=CC=CN=C1 37010 [0,0,0,0,0,1|3,0,0]=4 193 B9R1.8 NNCC1=CC=CN=C1 71680 [0,0,0,0,0,1|3,0,0]=4 194 B9R1.8 NNCC1=NC=CC=C1 37011 [0,0,0,0,0,1|3,0,0]=4 195 B9R1.8 NOCC1=CC=CC=C1 54239 [0,0,0,0,0,1|2,1,0]=4 196 B9R1.8 NOCC1=CC=CC=C1 N10409 [0,0,0,0,0,1|2,1,0]=4 197 B9R1.8 O=CCC1=CC=CC=C1 D78329 [0,0,0,0,0,1|3,0,0]=4 198 B9R1.8 OCCC1=CC=CC=C1 D70868 [0,0,0,0,0,1|3,0,0]=4 199 B9R1.8 OCCC1=CC=NC=C1 27360 [0,0,0,0,0,1|3,0,0]=4 200 B9R1.8 OCCC1=CN=CC=C1 29643 [0,0,0,0,0,1|3,0,0]=4 201 B9R1.8 OCCC1=NC=CC=C1 D70485 [0,0,0,0,0,1|3,0,0]=4 202 B9R1.8 OCCC1=NC=CN=C1 26585 [0,0,0,0,0,1|3,0,0]=4 203 B9R1.8 ONCC1=CC=CC=C1 23229 [0,0,0,0,0,1|3,0,0]=4 204 B9R1.8 ONCC1=CC=CC=C1 70488 [0,0,0,0,0,1|3,0,0]=4 205 B9R1.8 SCCC1=CC=CC=C1 AC9387 [0,0,0,0,0,1|3,0,0]=4 206 B9R1.8 SCCC1=CC=NC=C1 H11399 [0,0,0,0,0,1|3,0,0]=4 207 B9R1.8 SCCC1=NC=CN=C1 T72349 [0,0,0,0,0,1|3,0,0]=4 208 B6R0.6 CCCC=CC=O D78252 [1,0,1,0,0,0|0,0,2]=4 209 B6R0.6 CCC\C=C\CO D78301 [1,0,1,0,0,0|0,0,2]=4 210 B6R0.6 CC\C=C/CCO 73722 [1,0,1,0,0,0|0,0,2]=4 211 B6R0.6 C\C=C\C=C\C=O D90909 [1,0,1,0,0,0|0,0,2]=4 212 B6R0.6 C\C=C\C=C\CO D77844 [1,0,1,0,0,0|0,0,2]=4 213 B6R0.1 C=COC(=O)CCl D95397 [1,0,1,0,0,0|2,0,0]=4 214 B6R0.1 C=C[C@@H](O)CCC D90922 [1,0,1,0,0,0|1,0,1]=4 215 B6R0.1 COC(=O)CSC D87959 [1,0,1,0,0,0|1,0,1]=4 216 B6R0.1 C\C=C\C(=O)CC 74326 [1,0,1,0,0,0|0,0,2]=4 217 B6R1.2 BrC1=CC=CO1 29495 [2,0,0,0,0,0|1,0,0]=3 218 B6R1.2 BrC1=CC=CS1 D77872 [2,0,0,0,0,0|1,1,0]=4 219 B6R1.2 CC1=CC=CS1 F10310 [2,0,0,0,0,0|0,1,0]=3 220 B6R1.2 CC1=CC=NN1 FD18008 [2,0,0,0,0,0|2,0,0]=4 221 B6R1.2 CC1=CC=NO1 F14932 [2,0,0,0,0,0|1,0,0]=3 222 B6R1.2 CC1=CCC=C1 F13190 [2,0,0,0,0,0|1,0,1]=4 223 B6R1.2 CC1=CN=CS1 35579 [2,0,0,0,0,0|1,1,0]=4 224 B6R1.2 CC1=CNC=N1 73319 [2,0,0,0,0,0|2,0,0]=4 225 B6R1.2 CC1=COC=N1 P11074 [2,0,0,0,0,0|2,0,0]=4 226 B6R1.2 CC1=CSC=C1 28845 [2,0,0,0,0,0|2,0,0]=4 227 B6R1.2 CC1=CSC=N1 P16589 [2,0,0,0,0,0|2,0,0]=4 228 B6R1.2 CC1=NC=CN1 D77862 [2,0,0,0,0,0|2,0,0]=4 229 B6R1.2 CC1=NC=CS1 26127 [2,0,0,0,0,0|1,1,0]=4 230 B6R1.2 CC1=NN=CO1 F13450 [2,0,0,0,0,0|2,0,0]=4 231 B6R1.2 CN1C=CC=C1 D78235 [2,0,0,0,0,0|2,0,0]=4 232 B6R1.2 CN1C=CC=N1 39204 [2,0,0,0,0,0|2,0,0]=4 233 B6R1.2 ClC1=CC=CS1 F10317 [2,0,0,0,0,0|1,1,0]=4 234 B6R1.2 IC1=CC=CS1 20438 [2,0,0,0,0,0|1,1,0]=4 235 B6R1.2 NC1=NC=CO1 52234 [2,0,0,0,0,0|2,0,0]=4 236 B6R1.2 O=C1C=CCO1 20453 [2,0,0,0,0,0|0,1,1]=4 237 B6R1.2 O=C1OC=CO1 28756 [2,0,0,0,0,0|1,1,0]=4 238 B6R1.2 SC1=NC=CN1 78654 [2,0,0,0,0,0|2,0,0]=4 239 B6R1.2 SC1=NC=CS1 23031 [2,0,0,0,0,0|1,1,0]=4 240 B6R1.2 [Fe]C1=CC=CC1 D78443 [2,0,0,0,0,0|2,0,0]=4 241 B8R0.4 CCC\C=C\C=C\C=O D71091 [0,1,1,0,0,0|1,0,1]=4 242 B8R0.7 CCCC\C=C\C(=O)O D90864 [0,1,1,0,0,0|1,0,1]=4 243 B8R1.1 CC1=CC=C(C#N)O1 AT17405 [1,1,0,0,0,0|1,0,1]=4 244 B8R1.1 CC1=CC=C(C=O)O1 AC7802 [1,1,0,0,0,0|0,1,1]=4 245 B8R1.1 CC1=CC=C(CN)O1 AT17190 [1,1,0,0,0,0|1,0,0]=3 246 B8R1.1 CC1=CC=C(CN)S1 71910 [1,1,0,0,0,0|1,1,0]=4 247 B8R1.1 CC1=CC=C(CO)O1 55257 [1,1,0,0,0,0|0,1,0]=3 248 B8R1.1 CC1=CN=C(CN)O1 P17743 [1,1,0,0,0,0|2,0,0]=4 249 B8R1.1 CC1=CSC(CN)=C1 71583 [1,1,0,0,0,0|1,1,0]=4 250 B8R1.1 CC1=CSC(CO)=C1 30206 [1,1,0,0,0,0|0,2,0]=4 251 B8R1.1 CC1=NOC(CO)=C1 F52509 [1,1,0,0,0,0|1,1,0]=4 252 B8R1.1 CCC1=CC=C(Br)S1 AT16365 [1,1,0,0,0,0|0,1,0]=3 253 B8R1.1 CCC1=CC=C(C)S1 D82487 [1,1,0,0,0,0|0,1,0]=3 254 B8R1.1 CCC1=NC(C)=CN1 AC1597 [1,1,0,0,0,0|2,0,0]=4 255 B8R1.1 CCC1=NC(C)=CS1 D90521 [1,1,0,0,0,0|1,1,0]=4 256 B8R1.1 CCC1=NNC(N)=C1 50999 [1,1,0,0,0,0|2,0,0]=4 257 B8R1.1 CCC1=NOC(N)=C1 Y10432 [1,1,0,0,0,0|2,0,0]=4 258 B8R1.1 CCN1C=C(Br)C=N1 86991 [1,1,0,0,0,0|2,0,0]=4 259 B8R1.1 CCN1C=C(N)C=N1 80697 [1,1,0,0,0,0|2,0,0]=4 260 B8R1.1 CCN1C=C(N)C=N1 A51019 [1,1,0,0,0,0|2,0,0]=4 261 B8R1.1 CCN1C=CC(N)=N1 P20590 [1,1,0,0,0,0|2,0,0]=4 262 B8R1.1 COC1=CC(N)=NO1 24049 [1,1,0,0,0,0|1,1,0]=4 263 B8R1.1 CSC1=NC(Br)=CS1 78704 [1,1,0,0,0,0|1,1,0]=4 264 B8R1.1 ClCC1=CC=C(Cl)S1 33094 [1,1,0,0,0,0|1,1,0]=4 265 B8R1.1 NCC1=CC(Br)=CS1 P10529 [1,1,0,0,0,0|1,1,0]=4 266 B8R1.1 NCC1=CC(Br)=CS1 SC1761 [1,1,0,0,0,0|1,1,0]=4 267 B8R1.1 NCC1=CC=C(Br)S1 73366 [1,1,0,0,0,0|1,1,0]=4 268 B8R1.1 O=CC1=CC(Br)=CO1 54612 [1,1,0,0,0,0|0,1,1]=4 269 B8R1.1 O=CC1=CC=C(Br)O1 FD17060 [1,1,0,0,0,0|0,1,1]=4 270 B8R1.1 O=CC1=CC=C(Cl)O1 55259 [1,1,0,0,0,0|0,1,1]=4 271 B8R1.1 O=CC1=CC=C(I)O1 F12254 [1,1,0,0,0,0|0,1,1]=4 272 B8R1.1 OCC1=CC(Br)=CS1 81437 [1,1,0,0,0,0|0,2,0]=4 273 B8R1.1 OCC1=CC=C(Br)S1 29963 [1,1,0,0,0,0|0,2,0]=4 274 B8R1.1 OCC1=CC=C(Cl)S1 29526 [1,1,0,0,0,0|0,2,0]=4 275 B8R1.7 CC(=O)C1=CC=CN1 F14878 [1,1,0,0,0,0|1,0,1]=4 276 B8R1.7 CC(=O)C1=CC=CO1 55774 [1,1,0,0,0,0|0,0,1]=3 277 B8R1.7 CC(=O)C1=CC=CS1 W18336 [1,1,0,0,0,0|0,1,1]=4 278 B8R1.7 CC(C)=C1C=CC=C1 A10651 [1,1,0,0,0,0|1,0,1]=4 279 B8R1.7 CC(C)C1=NC=CN1 AC7942 [1,1,0,0,0,0|2,0,0]=4 280 B8R1.7 CC(C)C1=NNC=C1 84161 [1,1,0,0,0,0|2,0,0]=4 281 B8R1.7 CC(C)N1C=CC=N1 29359 [1,1,0,0,0,0|2,0,0]=4 282 B8R1.7 C[C@H](N)C1=CC=CS1 F50504 [1,1,0,0,0,0|0,1,0]=3 283 B8R1.7 C[C@H](N)C1=COC=C1 N12469 [1,1,0,0,0,0|2,0,0]=4 284 B8R1.7 C[C@H](N)C1=CSC=N1 N12430 [1,1,0,0,0,0|2,0,0]=4 285 B8R1.7 C[C@H](N)C1=NC=CS1 30731 [1,1,0,0,0,0|1,1,0]=4 286 B8R1.7 C[C@H](N)C1=NC=CS1 SC2951 [1,1,0,0,0,0|1,1,0]=4 287 B8R1.7 C[C@H](O)C1=CC=CO1 C74444 [1,1,0,0,0,0|0,0,0]=2 288 B8R1.7 C[C@H](O)C1=CCC=C1 F13266 [1,1,0,0,0,0|1,0,1]=4 289 B8R1.7 C[C@H](O)C1=NC=CS1 AT14680 [1,1,0,0,0,0|1,1,0]=4 290 B8R1.7 NC(=O)C1=CC=CO1 A51100 [1,1,0,0,0,0|0,1,1]=4 291 B8R1.7 OB(O)C1=CC=CO1 30157 [1,1,0,0,0,0|1,1,0]=4 292 B8R1.11 CC1=C(CO)SC=C1 71542 [1,1,0,0,0,0|0,2,0]=4 293 B8R1.11 CCN1N=CC=C1N 61440 [1,1,0,0,0,0|2,0,0]=4 294 B8R1.11 CN1C=CC=C1CN 71394 [1,1,0,0,0,0|2,0,0]=4 295 B8R1.11 CSC1=C(C)OC=C1 H11351 [1,1,0,0,0,0|2,0,0]=4 296 B8R1.11 CSC1=NC=CN1C SC5098 [1,1,0,0,0,0|2,0,0]=4 297 B8R1.11 O=CC1=C(Br)C=CO1 65861 [1,1,0,0,0,0|0,1,1]=4 298 B8R1.11 OCC1=C(Br)C=CS1 P10336 [1,1,0,0,0,0|0,2,0]=4 299 B8R1.11 OCC1=C(Cl)C=CS1 38403 [1,1,0,0,0,0|0,2,0]=4 300 B10R1.1 CCCC1=CC=C(Br)C=C1 36843 [0,1,0,0,0,1|2,0,0]=4 301 B10R1.1 CCCC1=CC=C(Cl)C=C1 D89488 [0,1,0,0,0,1|2,0,0]=4 302 B10R1.1 CCCC1=CC=C(N)C=C1 F11809 [0,1,0,0,0,1|2,0,0]=4 303 B10R1.1 CCCC1=CC=C(O)C=C1 F16572 [0,1,0,0,0,1|2,0,0]=4 304 B10R1.1 CNCC1=CC=C(Br)C=C1 30718 [0,1,0,0,0,1|2,0,0]=4 305 B10R1.1 CNCC1=CC=C(Br)C=C1 34885 [0,1,0,0,0,1|2,0,0]=4 306 B10R1.1 CNCC1=CC=C(C)C=C1 31931 [0,1,0,0,0,1|2,0,0]=4 307 B10R1.1 CNCC1=CC=C(C)C=C1 35837 [0,1,0,0,0,1|2,0,0]=4 308 B10R1.1 CNCC1=CC=C(Cl)C=C1 23650 [0,1,0,0,0,1|2,0,0]=4 309 B10R1.1 CNCC1=CC=C(Cl)C=C1 32294 [0,1,0,0,0,1|2,0,0]=4 310 B10R1.1 CNCC1=CC=C(F)C=C1 48475 [0,1,0,0,0,1|2,0,0]=4 311 B10R1.1 CNCC1=CC=C(N)C=C1 28703 [0,1,0,0,0,1|2,0,0]=4 312 B10R1.1 CNCC1=CN=C(C)C=C1 AC2520 [0,1,0,0,0,1|2,0,0]=4 313 B10R1.1 CNCC1=CN=C(Cl)C=C1 F12001 [0,1,0,0,0,1|2,0,0]=4 314 B10R1.1 COCC1=CC=C(Br)C=C1 N10190 [0,1,0,0,0,1|1,1,0]=4 315 B10R1.1 COCC1=CC=C(Cl)C=C1 N10137 [0,1,0,0,0,1|1,1,0]=4 316 B10R1.1 COCC1=CC=C(N)C=C1 29846 [0,1,0,0,0,1|1,1,0]=4 317 B10R1.4 CCCC1=C(N)C=CC=C1 65648 [0,1,0,0,0,1|2,0,0]=4 318 B10R1.4 CNCC1=C(Br)C=CC=C1 29110 [0,1,0,0,0,1|2,0,0]=4 319 B10R1.4 CNCC1=C(C)C=CC=C1 I12011 [0,1,0,0,0,1|2,0,0]=4 320 B10R1.4 CNCC1=C(Cl)C=CC=C1 30117 [0,1,0,0,0,1|2,0,0]=4 321 B10R1.4 CNCC1=C(F)C=CC=C1 29111 [0,1,0,0,0,1|2,0,0]=4 322 B10R1.4 CNCC1=C(O)C=CC=C1 D91425 [0,1,0,0,0,1|2,0,0]=4 323 B10R1.4 CNCC1=CC=CN=C1Cl 68594 [0,1,0,0,0,1|2,0,0]=4 324 B10R1.4 CSCC1=C(Br)C=CC=C1 W18565 [0,1,0,0,0,1|1,0,0]=3 325 B10R1.4 CSCC1=C(F)C=CC=C1 W18462 [0,1,0,0,0,1|1,0,0]=3 326 B10R1.4 N#CCC1=CC=CO[C@@H]1O D72551 [0,1,0,0,0,1|2,0,0]=4 327 B10R1.10 CCCC1=CC=CC(N)=N1 79666 [0,1,0,0,0,1|2,0,0]=4 328 B10R1.10 CCCC1=NC=CC(Br)=C1 S10806 [0,1,0,0,0,1|2,0,0]=4 329 B10R1.10 CNCC1=CC(Br)=CN=C1 C76339 [0,1,0,0,0,1|2,0,0]=4 330 B10R1.10 CNCC1=CC(N)=CC=C1 D84175 [0,1,0,0,0,1|2,0,0]=4 331 B10R1.10 CNCC1=CC=CC(Br)=C1 31843 [0,1,0,0,0,1|2,0,0]=4 332 B10R1.10 CNCC1=CC=CC(Br)=C1 55408 [0,1,0,0,0,1|2,0,0]=4 333 B10R1.10 CNCC1=CC=CC(Cl)=C1 F16150 [0,1,0,0,0,1|2,0,0]=4 334 B10R1.10 CNCC1=CC=CC(F)=C1 36788 [0,1,0,0,0,1|2,0,0]=4 335 B10R1.10 CNCC1=CC=CC(F)=C1 FD7354 [0,1,0,0,0,1|2,0,0]=4 336 B10R1.10 CNCC1=CC=CC(O)=C1 30625 [0,1,0,0,0,1|2,0,0]=4 337 B10R1.10 COCC1=CC=CC(Br)=C1 N10086 [0,1,0,0,0,1|1,1,0]=4 338 B10R1.10 COCC1=NC=NC(O)=C1 92040 [0,1,0,0,0,1|1,1,0]=4 339 B10R1.15 CC[C@H](N)C1=CC=CC=C1 A11524 [0,1,0,0,0,1|2,0,0]=4 340 B10R1.15 CC[C@H](N)C1=CC=CC=C1 F11436 [0,1,0,0,0,1|2,0,0]=4 341 B10R1.15 CC[C@H](N)C1=CC=CN=C1 30679 [0,1,0,0,0,1|2,0,0]=4 342 B10R1.15 CC[C@H](N)C1=NC=CC=C1 D80730 [0,1,0,0,0,1|2,0,0]=4 343 B10R1.15 CC[C@H](O)C1=CC=CC=C1 S11247 [0,1,0,0,0,1|2,0,0]=4 344 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 30941 [0,1,0,0,0,1|2,0,0]=4 345 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 D82152 [0,1,0,0,0,1|2,0,0]=4 346 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 N12133 [0,1,0,0,0,1|2,0,0]=4 347 B10R1.17 BrCCCC1=CC=CC=C1 D78162 [0,1,0,0,0,1|2,0,0]=4 348 B10R1.17 CCCCC1=CC=CC=C1 H11923 [0,1,0,0,0,1|2,0,0]=4 349 B10R1.17 CCCCC1=CC=CN=C1 F20500 [0,1,0,0,0,1|2,0,0]=4 350 B10R1.17 CCCNC1=CC=CC=C1 D91987 [0,1,0,0,0,1|2,0,0]=4 351 B10R1.17 CCNCC1=CC=CN=C1 30943 [0,1,0,0,0,1|2,0,0]=4 352 B10R1.17 CCNCC1=CC=NC=C1 12139 [0,1,0,0,0,1|2,0,0]=4 353 B10R1.17 CCNCC1=NC=CC=C1 29981 [0,1,0,0,0,1|2,0,0]=4 354 B10R1.17 CCOCC1=CC=CC=C1 F30115 [0,1,0,0,0,1|1,1,0]=4 355 B10R1.17 CNCCC1=CC=CC=C1 AR1058 [0,1,0,0,0,1|2,0,0]=4 356 B10R1.17 CNCCC1=CC=NC=C1 64165 [0,1,0,0,0,1|2,0,0]=4 357 B10R1.17 CNCCC1=CC=NC=C1 AR3935 [0,1,0,0,0,1|2,0,0]=4 358 B10R1.17 CNCCC1=NC=CC=C1 23018 [0,1,0,0,0,1|2,0,0]=4 359 B10R1.17 CNCCC1=NC=CC=C1 AR1013 [0,1,0,0,0,1|2,0,0]=4 360 B10R1.17 CNCCC1=NC=CC=C1 D87714 [0,1,0,0,0,1|2,0,0]=4 361 B10R1.17 COCSC1=CC=CC=C1 D91464 [0,1,0,0,0,1|1,1,0]=4 362 B10R1.17 ClCCCC1=CC=CC=C1 S12344 [0,1,0,0,0,1|2,0,0]=4 363 B10R1.17 ClCOCC1=CC=CC=C1 76478 [0,1,0,0,0,1|1,1,0]=4 364 B10R1.17 ClCSCC1=CC=CC=C1 D88878 [0,1,0,0,0,1|1,0,0]=3 365 B10R1.17 NCCCC1=CC=CC=C1 S10208 [0,1,0,0,0,1|2,0,0]=4 366 B10R1.17 NCCCC1=NC=CC=C1 70884 [0,1,0,0,0,1|2,0,0]=4 367 B10R1.17 OCCCC1=CC=CC=C1 AC1807 [0,1,0,0,0,1|2,0,0]=4 368 B10R1.17 OCCCC1=CC=NC=C1 65430 [0,1,0,0,0,1|2,0,0]=4 369 B10R1.17 OCCCC1=CN=CC=C1 D84150 [0,1,0,0,0,1|2,0,0]=4 370 B10R1.17 OCCCC1=NC=CC=C1 31622 [0,1,0,0,0,1|2,0,0]=4 371 B10R1.17 OCCCC1=NC=CC=C1 38162 [0,1,0,0,0,1|2,0,0]=4 372 B10R1.18 CC(=O)CC1=CC=NC=C1 32302 [0,1,0,0,0,1|2,0,0]=4 373 B10R1.18 CC(=O)CC1=CC=NC=C1 65526 [0,1,0,0,0,1|2,0,0]=4 374 B10R1.18 CC(=O)CC1=NC=CC=C1 65544 [0,1,0,0,0,1|2,0,0]=4 375 B10R1.18 C[C@H](O)CC1=CC=CC=C1 D71014 [0,1,0,0,0,1|2,0,0]=4 376 B10R1.18 C[Si](C)CC1=CC=CC=C1 D89172 [0,1,0,0,0,1|2,0,0]=4 377 B10R1.14 CCC(=O)C1=CC=C(C)O1 N10391 [0,2,0,0,0,0|1,0,1]=4 378 B10R1.14 COC(=O)C1=CC(Br)=CO1 25677 [0,2,0,0,0,0|0,1,1]=4 379 B10R1.14 COC(=O)C1=CC=C(Br)O1 33174 [0,2,0,0,0,0|0,1,1]=4 380 B10R1.14 COC(=O)C1=CC=C(C)O1 Y10250 [0,2,0,0,0,0|0,1,1]=4 381 B10R1.14 COC(=O)C1=CC=C(N)O1 38243 [0,2,0,0,0,0|0,1,1]=4 382 B10R1.16 CC1=CC=C(CCC=O)O1 D82231 [0,2,0,0,0,0|1,0,1]=4 383 B10R1.16 CC1=NOC(CCCO)=C1 O10866 [0,2,0,0,0,0|2,0,0]=4 384 B10R1.96 COCC1=CC=C(C=O)O1 67727 [0,2,0,0,0,0|0,1,0]=3 385 B10R1.11 CCC[C@H](N)C1=CC=CS1 N17049 [0,2,0,0,0,0|1,1,0]=4 386 B10R1.11 CCOC(=O)C1=CC=CO1 H11621 [0,2,0,0,0,0|0,1,1]=4 387 B10R1.11 N#CCC(=O)C1=CC=CO1 W11912 [0,2,0,0,0,0|2,0,0]=4 388 B10R1.23 CN(O)C(=O)C1=CC=CO1 T70076 [0,2,0,0,0,0|1,0,1]=4 389 B10R1.149 COC(=O)C1=C(C)C=CO1 F16312 [0,2,0,0,0,0|0,1,1]=4 390 B10R1.149 COC(=O)C1=C(N)C=CO1 59870 [0,2,0,0,0,0|0,1,1]=4 391 B10R1.149 COC(=O)C1=C(N)C=CO1 P16240 [0,2,0,0,0,0|0,1,1]=4 392 B10R1.21 CCCCCC1=CC=CO1 H11330 [0,2,0,0,0,0|1,0,0]=3 393 B10R1.21 CCCCCC1=CC=CS1 F15453 [0,2,0,0,0,0|1,1,0]=4 394 B10R1.21 OCCNCC1=CC=CS1 W12722 [0,2,0,0,0,0|1,1,0]=4 395 B10R1.21 [NH3+]CCSCC1=CC=CO1 D90669 [0,2,0,0,0,0|0,0,0]=2 396 B10R1.27 COC(=O)CC1=CC=CS1 D70882 [0,2,0,0,0,0|0,2,0]=4 397 B10R1.66 CC(=O)OCC1=CC=CO1 F14839 [0,2,0,0,0,0|0,1,0]=3 398 B10R1.66 CC(=O)\C=C\C1=CC=CO1 D90647 [0,2,0,0,0,0|1,0,1]=4 399 B10R1.66 CC(C)SCC1=CC=CO1 D90686 [0,2,0,0,0,0|0,0,0]=2 400 B10R1.66 NC(=S)NCC1=CC=CO1 D85860 [0,2,0,0,0,0|1,0,1]=4 401 B10R1.66 O=C(O)CCC1=CC=CO1 68597 [0,2,0,0,0,0|1,0,1]=4 402 B8R1.2 CSC1=CC=CC=C1 D72508 [0,0,1,1,0,0|1,0,1]=4 403 B8R1.2 CSC1=NC=CC=C1 75585 [0,0,1,1,0,0|1,0,1]=4 404 B8R1.5 CC1=C(O)C=CC=N1 CL0055 [0,0,1,1,0,0|2,0,0]=4 405 B8R1.49 C1=CCCCCC=C1 D89259 [0,0,1,1,0,0|2,0,0]=4 406 B8R1.4 CC1=CC=CC(O)=N1 W10567 [0,0,1,1,0,0|2,0,0]=4 407 B8R1.4 O=C1C=C(O)CCC1 D81514 [0,0,1,1,0,0|2,0,0]=4 408 B8R1.4 O=C1C=C(O)COC1 38542 [0,0,1,1,0,0|1,1,0]=4 409 B8R1.4 O=C1CSCC(=O)O1 H10798 [0,0,1,1,0,0|2,0,0]=4 410 B10R2.6 C1=CC=C(C2CC2)C=C1 59390 [0,0,0,1,0,1|2,0,0]=4 411 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 AC8296 [0,0,0,1,0,1|1,1,0]=4 412 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 F20441 [0,0,0,1,0,1|1,1,0]=4 413 B10R2.7 C1=CC2=C(C=C1)CCC2 D97393 [0,0,0,1,0,1|2,0,0]=4 414 B10R2.7 C1=CC2=C(C=C1)CNC2 62864 [0,0,0,1,0,1|2,0,0]=4 415 B10R2.7 C1=CC2=C(C=C1)CNC2 SC3601 [0,0,0,1,0,1|2,0,0]=4 416 B10R2.7 C1=CC2=C(C=C1)COC2 D77530 [0,0,0,1,0,1|1,1,0]=4 417 B10R2.7 C1=CC2=C(C=N1)COC2 D84120 [0,0,0,1,0,1|1,1,0]=4 418 B10R2.7 C1=CN=C2CCCC2=C1 85228 [0,0,0,1,0,1|2,0,0]=4 419 B10R2.7 C1=CN=C2CNCC2=C1 F15050 [0,0,0,1,0,1|2,0,0]=4