0 B8R1.8 CCCC1=NC=CN1 Z1201043633 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.8 CCCC1=NN=NN1 Z335295252 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.8 CCCC1=NNC=N1 Z803077816 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 CCNC1=NC=CN1 Z1463350447 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.8 CCNC1=NC=CS1 Z86243266 [0,0,0,0,0,0|1,0,0]=1 5 B8R1.8 CCNC1=NC=NN1 Z1203735308 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.8 CCNC1=NN=CO1 Z1823617731 [0,0,0,0,0,0|2,1,0]=3 7 B8R1.8 CCNC1=NN=CS1 Z1082872548 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.8 CCOC1=CNN=C1 Z1726113833 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.8 CCOC1=NNC=C1 Z1416187675 [0,0,0,0,0,0|2,0,0]=2 10 B8R1.8 CNCC1=CC=CN1 Z102767010 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.8 CNCC1=CC=CO1 Z57051072 [0,0,0,0,0,0|3,1,0]=4 12 B8R1.8 CNCC1=CC=CS1 Z56948283 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.8 CNCC1=CSC=N1 Z138108610 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.8 CNCC1=NC=CN1 Z445210554 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.8 CNCC1=NC=CO1 Z5810628036 [0,0,0,0,0,0|2,1,0]=3 16 B8R1.8 CNCC1=NC=CS1 Z802607826 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.8 CNCC1=NN=CN1 Z1575082063 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.8 CNCC1=NN=CS1 Z4663887855 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.8 CNCC1=NNC=C1 Z445185804 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.8 CNCC1=NOC=C1 Z802903302 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.8 CNCC1=NOC=N1 Z2143572220 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.8 COCC1=CNC=N1 Z1203733599 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 COCC1=NC=CN1 Z1203733422 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.8 COCC1=NNC=C1 Z1270114780 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.8 COCC1=NNC=N1 Z1201627056 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.8 N#CCC1=NC=CN1 Z331689878 [0,0,0,0,0,0|3,0,1]=4 27 B8R1.8 N#CNC1=NN=CS1 Z1198155469 [0,0,0,0,0,0|3,0,1]=4 28 B8R1.8 NCCC1=CC=CN1 Z810507730 [0,0,0,0,0,0|3,0,1]=4 29 B8R1.8 NCCC1=CC=CO1 Z1694636467 [0,0,0,0,0,0|3,1,0]=4 30 B8R1.8 NCCC1=CC=CS1 Z90662945 [0,0,0,0,0,0|3,0,0]=3 31 B8R1.8 NCCC1=CC=NS1 Z2768432862 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.8 NCCC1=CNC=N1 Z1267773750 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.8 NCCC1=NC=CO1 Z4925106850 [0,0,0,0,0,0|2,1,0]=3 34 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,0,0,0,0,0|2,0,0]=2 35 B8R1.8 NCCC1=NN=CN1 Z1687906395 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.8 NCCC1=NN=CS1 Z3067374940 [0,0,0,0,0,0|3,0,0]=3 37 B8R1.8 NCCC1=NNC=C1 Z2867120994 [0,0,0,0,0,0|4,0,0]=4 38 B8R1.8 NCCC1=NOC=N1 Z1262691677 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.8 NCCN1C=CC=N1 Z271005714 [0,0,0,0,0,0|4,0,0]=4 40 B8R1.8 O/N=C/C1=CC=CS1 Z49568302 [0,0,0,0,0,0|4,0,0]=4 41 B8R1.8 O=CCC1=CC=CS1 Z993017816 [0,0,0,0,0,0|3,0,1]=4 42 B8R1.8 OCCC1=CC=CO1 Z1179944660 [0,0,0,0,0,0|3,1,0]=4 43 B8R1.8 OCCC1=CC=CS1 Z397587354 [0,0,0,0,0,0|3,0,0]=3 44 B8R1.8 OCCC1=CN=CS1 Z1198334159 [0,0,0,0,0,0|4,0,0]=4 45 B8R1.8 OCCC1=CSC=N1 Z1263714384 [0,0,0,0,0,0|4,0,0]=4 46 B8R1.8 OCCN1C=CC=N1 Z425794824 [0,0,0,0,0,0|4,0,0]=4 47 B7R1.1 C#CC1=NC=CS1 Z1255400696 [1,0,0,0,0,0|0,0,2]=3 48 B7R1.1 CCC1=CC=CO1 Z640169748 [1,0,0,0,0,0|1,1,0]=3 49 B7R1.1 CCC1=CNC=N1 Z1203731354 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.1 CCC1=NC=CN1 Z803154382 [1,0,0,0,0,0|1,0,0]=2 51 B7R1.1 CCC1=NN=CN1 Z2065464313 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.1 CCC1=NN=NN1 Z335291070 [1,0,0,0,0,0|3,0,0]=4 53 B7R1.1 CCC1=NNC=C1 Z1238571110 [1,0,0,0,0,0|2,0,0]=3 54 B7R1.1 CCN1C=CC=N1 Z600618624 [1,0,0,0,0,0|2,0,0]=3 55 B7R1.1 CCN1C=CN=N1 Z4497103939 [1,0,0,0,0,0|3,0,0]=4 56 B7R1.1 CNC1=NC=CS1 Z336483296 [1,0,0,0,0,0|1,0,0]=2 57 B7R1.1 CNC1=NCCS1 Z744843656 [1,0,0,0,0,0|1,0,2]=4 58 B7R1.1 CNC1=NN=CO1 Z235540568 [1,0,0,0,0,0|2,1,0]=4 59 B7R1.1 CNC1=NN=CS1 Z1082870996 [1,0,0,0,0,0|2,0,0]=3 60 B7R1.1 CNC1=NOC=C1 Z2489381644 [1,0,0,0,0,0|3,0,0]=4 61 B7R1.1 COC1=NCCC1 Z147641734 [1,0,0,0,0,0|1,0,2]=4 62 B7R1.1 COC1=NN=CS1 Z1642058386 [1,0,0,0,0,0|1,0,0]=2 63 B7R1.1 COC1=NNC=C1 Z2130657375 [1,0,0,0,0,0|2,0,0]=3 64 B7R1.1 COC1=NSC=C1 Z1198333966 [1,0,0,0,0,0|2,0,0]=3 65 B7R1.1 CSC1=NC=CN1 Z1203730949 [1,0,0,0,0,0|1,1,0]=3 66 B7R1.1 N#CC1=CC=CS1 Z56946090 [1,0,0,0,0,0|2,0,1]=4 67 B7R1.1 N#CC1=NC=CN1 Z1198180312 [1,0,0,0,0,0|2,0,1]=4 68 B7R1.1 N#CC1=NC=CS1 Z1198221374 [1,0,0,0,0,0|1,0,1]=3 69 B7R1.1 NCC1=CC=CN1 Z976631692 [1,0,0,0,0,0|2,0,1]=4 70 B7R1.1 NCC1=CC=CS1 Z104485908 [1,0,0,0,0,0|2,0,0]=3 71 B7R1.1 NCC1=CC=NS1 Z2310716170 [1,0,0,0,0,0|3,0,0]=4 72 B7R1.1 NCC1=NC=CN1 Z1962341939 [1,0,0,0,0,0|2,0,0]=3 73 B7R1.1 NCC1=NC=CO1 Z4774639311 [1,0,0,0,0,0|1,1,0]=3 74 B7R1.1 NCC1=NC=CS1 Z1198107502 [1,0,0,0,0,0|1,0,0]=2 75 B7R1.1 NCC1=NC=NO1 Z2310727797 [1,0,0,0,0,0|2,1,0]=4 76 B7R1.1 NCC1=NN=CO1 Z104505014 [1,0,0,0,0,0|2,1,0]=4 77 B7R1.1 NCC1=NN=CS1 Z2738360224 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.1 NCC1=NOC=C1 Z802903300 [1,0,0,0,0,0|3,0,0]=4 79 B7R1.1 NCC1=NOC=N1 Z1266854926 [1,0,0,0,0,0|3,0,0]=4 80 B7R1.1 O=CC1=CC=CS1 Z104472120 [1,0,0,0,0,0|2,0,1]=4 81 B7R1.1 OCC1=CC=CO1 Z104472794 [1,0,0,0,0,0|2,1,0]=4 82 B7R1.1 OCC1=CC=CS1 Z104478586 [1,0,0,0,0,0|2,0,0]=3 83 B7R1.1 OCC1=CNC=N1 Z234898057 [1,0,0,0,0,0|3,0,0]=4 84 B7R1.1 OCC1=NC=CN1 Z825761068 [1,0,0,0,0,0|2,0,0]=3 85 B7R1.1 OCC1=NC=CS1 Z57161013 [1,0,0,0,0,0|1,0,0]=2 86 B7R1.1 OCC1=NN=CN1 Z2574360328 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.1 OCC1=NOC=C1 Z875021162 [1,0,0,0,0,0|3,0,0]=4 88 B7R1.1 OCN1C=CC=N1 Z1198155714 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.7 CC1=CN=C(S1)CC#N Z57980485 [0,1,0,0,0,0|2,0,1]=4 91 B9R1.7 CC1=CN=C(S1)CCN Z994267436 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.7 CC1=CSC(=N1)CC#N Z48848958 [0,1,0,0,0,0|2,0,1]=4 93 B9R1.7 CC1=NN=C(S1)CCN Z1201628633 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.7 CCCC1=CN=C(S1)N Z1203578740 [0,1,0,0,0,0|3,0,0]=4 95 B9R1.7 CCCC1=CSC(=N1)N Z1582264042 [0,1,0,0,0,0|3,0,0]=4 96 B9R1.7 CCCC1=NC(=N)SN1 Z1262398408 [0,1,0,0,0,0|3,0,0]=4 97 B9R1.7 CCCC1=NC(=NN1)C Z385478576 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.7 CCCC1=NN=C(N1)S Z56921538 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.7 CCCC1=NN=C(O1)N Z285233902 [0,1,0,0,0,0|2,1,0]=4 100 B9R1.7 CCCC1=NN=C(S1)Br Z1136468837 [0,1,0,0,0,0|2,0,0]=3 101 B9R1.7 CCCC1=NN=C(S1)N Z56768598 [0,1,0,0,0,0|2,0,0]=3 102 B9R1.7 CCCC1=NNC(=C1)N Z1266854936 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.7 CCCC1=NNC(=O)O1 Z1206172050 [0,1,0,0,0,0|2,1,0]=4 104 B9R1.7 CCCC1=NOC(=C1)N Z56979375 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.7 CCNC1=NC(=CS1)C Z48854598 [0,1,0,0,0,0|1,0,0]=2 106 B9R1.7 CCNC1=NN=C(S1)S Z104520992 [0,1,0,0,0,0|2,0,0]=3 107 B9R1.7 CCOC1=CC(=NN1)C Z1198153548 [0,1,0,0,0,0|2,0,1]=4 108 B9R1.7 CCOC1=NC(=CS1)Cl Z1581816962 [0,1,0,0,0,0|0,0,0]=1 109 B9R1.7 CCOC1=NC(=NN1)N Z1203590921 [0,1,0,0,0,0|2,0,0]=3 110 B9R1.7 CCOC1=NN=C(S1)N Z1203579762 [0,1,0,0,0,0|1,0,0]=2 111 B9R1.7 CCOC1=NN=C(S1)S Z734607132 [0,1,0,0,0,0|1,0,0]=2 112 B9R1.7 CCOC1=NNC(=C1)N Z2755865748 [0,1,0,0,0,0|2,0,0]=3 113 B9R1.7 CCSC1=NN=C(N1)N Z18356876 [0,1,0,0,0,0|2,1,0]=4 114 B9R1.7 CCSC1=NN=C(S1)N Z18452636 [0,1,0,0,0,0|1,1,0]=3 115 B9R1.7 CCSC1=NN=C(S1)S Z56960232 [0,1,0,0,0,0|1,1,0]=3 116 B9R1.7 CNCC1=CC=C(S1)C Z198747904 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.7 CNCC1=CC=C(S1)Cl Z57057714 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.7 CNCC1=NN=C(S1)C Z1267853185 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.7 COCC1=NN=C(S1)S Z1201622481 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.7 CSCC1=NN=C(S1)O Z1723839483 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.7 NC1=NN=C(S1)CCCl Z1205658599 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [0,1,0,0,0,0|3,0,0]=4 123 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [0,1,0,0,0,0|3,0,0]=4 124 B9R1.7 NCCC1=NN=C(S1)N Z3234882070 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.11 C/N=C(\Cl)/C1=CC=CS1 Z104378174 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.11 CC(C#N)C1=NC=CS1 Z1255451210 [0,1,0,0,0,0|2,0,1]=4 127 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.11 CC(CN)C1=NC=CN1 Z3205686355 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.11 CC(CN)C1=NC=CS1 Z994266314 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.11 CCC(=O)C1=CC=CO1 Z274774438 [0,1,0,0,0,0|2,1,0]=4 131 B9R1.11 CCC(=O)C1=NC=CN1 Z1198180339 [0,1,0,0,0,0|2,0,0]=3 132 B9R1.11 CCC(=O)C1=NN=CN1 Z1259213773 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.11 CCC(=O)C1=NNC=C1 Z1513630191 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.11 CCC(N)C1=CC=CS1 Z744593088 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.11 CCC(N)C1=COC=N1 Z3594983524 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.11 CCC(N)C1=NC=CN1 Z1723549294 [0,1,0,0,0,0|2,0,0]=3 137 B9R1.11 CCC(N)C1=NC=CS1 Z803082570 [0,1,0,0,0,0|1,0,0]=2 138 B9R1.11 CCC(N)C1=NN=CN1 Z1255523392 [0,1,0,0,0,0|3,0,0]=4 139 B9R1.11 CCC(O)C1=NC=CN1 Z1889917109 [0,1,0,0,0,0|2,0,0]=3 140 B9R1.11 CNC(=O)C1=CC=CS1 Z32016662 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.11 CNC(C)C1=CC=CS1 Z57206120 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.11 CNC(C)C1=NC=CS1 Z4945980708 [0,1,0,0,0,0|2,0,0]=3 143 B9R1.11 COC(=O)C1=NC=CN1 Z2680007886 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.11 COC(=O)C1=NC=CS1 Z1198724057 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.11 O=C(CCl)C1=CC=CS1 Z285150724 [0,1,0,0,0,0|3,0,0]=4 146 B9R1.12 C#CCNC1=NC=CS1 Z86338486 [0,1,0,0,0,0|1,0,1]=3 147 B9R1.12 CCNCC1=CC=CO1 Z90513169 [0,1,0,0,0,0|2,1,0]=4 148 B9R1.12 CCNCC1=CN=CS1 Z3268542028 [0,1,0,0,0,0|3,0,0]=4 149 B9R1.12 CCNCC1=NC=CS1 Z2186882255 [0,1,0,0,0,0|1,0,0]=2 150 B9R1.12 CCNCC1=NNC=C1 Z3300346845 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.12 CCOCC1=NC=CN1 Z1203819044 [0,1,0,0,0,0|1,0,0]=2 152 B9R1.12 CNCCC1=CC=CS1 Z162416950 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.12 CNCCC1=NNC=C1 Z2686452658 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.12 CNCCC1=NOC=N1 Z2889975619 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.12 COCCN1C=CC=N1 Z1157794076 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.12 N#CCSC1=NN=CS1 Z25107526 [0,1,0,0,0,0|1,1,1]=4 157 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,1,0,0,0,0|1,1,0]=3 160 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,1,0,0,0,0|1,0,0]=2 161 B9R1.12 NCCCC1=NC=NO1 Z1429378655 [0,1,0,0,0,0|2,1,0]=4 162 B9R1.12 NCCCC1=NN=CS1 Z4327155967 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,1,0,0,0,0|3,0,0]=4 164 B9R1.12 OCCCC1=CNC=N1 Z1142681983 [0,1,0,0,0,0|3,0,0]=4 165 B9R1.12 OCCCC1=CSC=N1 Z1270133079 [0,1,0,0,0,0|3,0,0]=4 166 B9R1.12 OCCCC1=NC=CN1 Z2771661063 [0,1,0,0,0,0|2,0,0]=3 167 B9R1.12 OCCCC1=NC=NN1 Z5356836398 [0,1,0,0,0,0|3,0,0]=4 168 B9R1.12 OCCCN1C=CC=N1 Z425794826 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.13 CC(=O)NC1=CC=CS1 Z1198150448 [0,1,0,0,0,0|2,0,1]=4 170 B9R1.13 CC(=O)NC1=NC=CS1 Z28173610 [0,1,0,0,0,0|1,0,1]=3 171 B9R1.13 CC(=O)NC1=NN=CS1 Z56871630 [0,1,0,0,0,0|2,0,1]=4 172 B9R1.13 CC(C)CN1C=CC=N1 Z431509688 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.13 CC(C)SC1=NC=CN1 Z1203735020 [0,1,0,0,0,0|1,1,0]=3 174 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [0,1,0,0,0,0|2,1,0]=4 175 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [0,1,0,0,0,0|2,0,0]=3 176 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.13 CC(O)CN1C=CC=N1 Z600458296 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.13 CN(C)NC1=NC=CS1 Z1562177195 [0,1,0,0,0,0|2,0,0]=3 179 B9R1.13 O=C([O-])CC1=NC=CS1 Z2472857693 [0,1,0,0,0,0|2,0,1]=4 180 B9R1.33 CN1C=CN=C1CCN Z2805865782 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.33 CN1C=CN=C1CCO Z1183455332 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.33 CNCC1=C(C=CS1)Br Z1342208365 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.33 CNCC1=C(C=CS1)C Z85956636 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.33 CNCC1=NC=CN1C Z94601315 [0,1,0,0,0,0|3,0,0]=4 185 B7R0.7 C/C=C/C(=O)OCC Z2327209524 [0,0,1,0,0,0|1,1,1]=4 186 B7R0.7 C=C=CC(=O)OCC Z1255488905 [0,0,1,0,0,0|1,1,1]=4 187 B7R0.7 CCOC(=N)CSC Z4498865780 [0,0,1,0,0,0|2,0,1]=4 188 B9R2.2 C1=CC(=NN1)C2CC2 Z336080424 [0,0,0,1,0,0|3,0,0]=4 189 B9R2.2 C1=NN=C(N1)C2CC2 Z2130641619 [0,0,0,1,0,0|3,0,0]=4 190 B9R2.3 C1=CN2CCCC2=N1 Z1255492142 [0,0,0,1,0,0|2,0,0]=3 191 B9R2.3 C1=CN2CCN=C2N1 Z2177030595 [0,0,0,1,0,0|2,0,1]=4 192 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,0,0,0,0,1|3,0,0]=4 193 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [0,0,0,0,0,1|2,0,0]=3 194 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [0,0,0,0,0,1|2,0,0]=3 195 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [0,0,0,0,0,1|3,0,0]=4 196 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [0,0,0,0,0,1|3,0,0]=4 197 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [0,0,0,0,0,1|2,0,0]=3 198 B9R1.8 CCNC1=NN=CC=C1 Z991530898 [0,0,0,0,0,1|2,0,0]=3 199 B9R1.8 CCOC1CCC=CO1 Z104478848 [0,0,0,0,0,1|1,1,1]=4 200 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [0,0,0,0,0,1|2,1,0]=4 201 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [0,0,0,0,0,1|3,0,0]=4 202 B9R1.8 CNCC1=NC=CC=N1 Z2310727788 [0,0,0,0,0,1|3,0,0]=4 203 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [0,0,0,0,0,1|3,0,0]=4 204 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [0,0,0,0,0,1|3,0,0]=4 205 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [0,0,0,0,0,1|3,0,0]=4 206 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [0,0,0,0,0,1|3,0,0]=4 207 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [0,0,0,0,0,1|3,0,0]=4 208 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [0,0,0,0,0,1|3,0,0]=4 209 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [0,0,0,0,0,1|3,0,0]=4 210 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,0,0,0,0,1|3,0,0]=4 211 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,0,0,0,0,1|3,0,0]=4 212 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [0,0,0,0,0,1|3,0,0]=4 213 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [0,0,0,0,0,1|3,0,0]=4 214 B6R0.1 CCOC(=N)CC Z3033961910 [1,0,1,0,0,0|0,0,2]=4 215 B6R1.2 CC1=CC=CN1 Z594218440 [2,0,0,0,0,0|1,0,1]=4 216 B6R1.2 CC1=CC=CO1 Z104472456 [2,0,0,0,0,0|1,1,0]=4 217 B6R1.2 CC1=COC=N1 Z1198313432 [2,0,0,0,0,0|2,0,0]=4 218 B6R1.2 CC1=NC=CN1 Z104494990 [2,0,0,0,0,0|1,0,0]=3 219 B6R1.2 CC1=NCCS1 Z104480256 [2,0,0,0,0,0|0,0,2]=4 220 B6R1.2 CC1=NNC=C1 Z450469310 [2,0,0,0,0,0|2,0,0]=4 221 B6R1.2 CC1=NNC=N1 Z939944658 [2,0,0,0,0,0|2,0,0]=4 222 B6R1.2 CN1C=CC=N1 Z336081430 [2,0,0,0,0,0|2,0,0]=4 223 B6R1.2 NC1=NC=CN1 Z1262237195 [2,0,0,0,0,0|2,0,0]=4 224 B6R1.2 NC1=NC=CO1 Z939904646 [2,0,0,0,0,0|1,1,0]=4 225 B6R1.2 NC1=NC=CS1 Z104472798 [2,0,0,0,0,0|1,0,0]=3 226 B6R1.2 NC1=NC=NS1 Z1827897976 [2,0,0,0,0,0|2,0,0]=4 227 B6R1.2 NC1=NN=CS1 Z56899142 [2,0,0,0,0,0|2,0,0]=4 228 B6R1.2 O=C1NC=CS1 Z445210514 [2,0,0,0,0,0|0,0,2]=4 229 B6R1.2 OC1=NN=CS1 Z1238571564 [2,0,0,0,0,0|1,0,0]=3 230 B6R1.2 OC1=NOC=C1 Z1255501207 [2,0,0,0,0,0|2,0,0]=4 231 B6R1.2 ON1C=CC=N1 Z1198342489 [2,0,0,0,0,0|2,0,0]=4 232 B6R1.2 SC1=NC=CN1 Z1198723329 [2,0,0,0,0,0|1,1,0]=4 233 B6R1.2 SC1=NN=CS1 Z104503476 [2,0,0,0,0,0|1,1,0]=4 234 B8R1.1 CC1=CC=C(S1)CO Z381678056 [1,1,0,0,0,0|2,0,0]=4 235 B8R1.1 CC1=CN=C(O1)CN Z1198236438 [1,1,0,0,0,0|1,1,0]=4 236 B8R1.1 CC1=CN=C(O1)CO Z1198313418 [1,1,0,0,0,0|1,1,0]=4 237 B8R1.1 CC1=CN=C(S1)C#N Z1198312937 [1,1,0,0,0,0|1,0,1]=4 238 B8R1.1 CC1=CN=C(S1)C=O Z1037606518 [1,1,0,0,0,0|1,0,1]=4 239 B8R1.1 CC1=CN=C(S1)CN Z994267440 [1,1,0,0,0,0|1,0,0]=3 240 B8R1.1 CC1=CNC(=N1)CO Z3015789123 [1,1,0,0,0,0|2,0,0]=4 241 B8R1.1 CC1=CSC(=C1)CN Z2235810231 [1,1,0,0,0,0|2,0,0]=4 242 B8R1.1 CC1=CSC(=N1)C#N Z1255395879 [1,1,0,0,0,0|1,0,1]=4 243 B8R1.1 CC1=CSC(=N1)C=O Z1037606426 [1,1,0,0,0,0|1,0,1]=4 244 B8R1.1 CC1=CSC(=N1)CO Z1037609598 [1,1,0,0,0,0|1,0,0]=3 245 B8R1.1 CC1=CSC(=N1)NN Z57980667 [1,1,0,0,0,0|2,0,0]=4 246 B8R1.1 CC1=NN=C(S1)CN Z1198280045 [1,1,0,0,0,0|2,0,0]=4 247 B8R1.1 CCC1=CC(=CS1)Br Z1255374735 [1,1,0,0,0,0|1,0,0]=3 248 B8R1.1 CCC1=CN=C(S1)N Z851799002 [1,1,0,0,0,0|2,0,0]=4 249 B8R1.1 CCC1=CSC(=N1)Cl Z1037582854 [1,1,0,0,0,0|2,0,0]=4 250 B8R1.1 CCC1=CSC(=N1)N Z1263824431 [1,1,0,0,0,0|2,0,0]=4 251 B8R1.1 CCC1=NC(=NS1)N Z1203581808 [1,1,0,0,0,0|1,0,0]=3 252 B8R1.1 CCC1=NN=C(O1)N Z285233906 [1,1,0,0,0,0|1,1,0]=4 253 B8R1.1 CCC1=NN=C(S1)N Z57052870 [1,1,0,0,0,0|1,0,0]=3 254 B8R1.1 CCC1=NN=C(S1)S Z1198171110 [1,1,0,0,0,0|1,0,0]=3 255 B8R1.1 CCC1=NNC(=C1)N Z360168062 [1,1,0,0,0,0|2,0,0]=4 256 B8R1.1 CCC1=NNC(=N1)C Z1271843082 [1,1,0,0,0,0|2,0,0]=4 257 B8R1.1 CCC1=NNC(=N1)N Z1431904363 [1,1,0,0,0,0|2,0,0]=4 258 B8R1.1 CCC1=NNC(=N1)S Z55982179 [1,1,0,0,0,0|2,0,0]=4 259 B8R1.1 CCC1=NOC(=C1)N Z360168622 [1,1,0,0,0,0|2,0,0]=4 260 B8R1.1 CCC1=NOC(=N1)N Z991477732 [1,1,0,0,0,0|2,0,0]=4 261 B8R1.1 CCN1C=C(C=N1)O Z1165304366 [1,1,0,0,0,0|2,0,0]=4 262 B8R1.1 CCN1C=CC(=N1)C Z2696515582 [1,1,0,0,0,0|2,0,0]=4 263 B8R1.1 CCN1C=CC(=N1)O Z2941655720 [1,1,0,0,0,0|2,0,0]=4 264 B8R1.1 CCN1N=CC(=N1)N Z3244908712 [1,1,0,0,0,0|2,0,0]=4 265 B8R1.1 CNC1=NC(=CS1)C Z48860943 [1,1,0,0,0,0|1,0,0]=3 266 B8R1.1 CNC1=NC(=NS1)C Z1203731956 [1,1,0,0,0,0|2,0,0]=4 267 B8R1.1 CNC1=NC(=O)CS1 Z1203731442 [1,1,0,0,0,0|1,0,1]=4 268 B8R1.1 CNC1=NC=C(S1)C Z3333486563 [1,1,0,0,0,0|1,0,0]=3 269 B8R1.1 CNC1=NN=C(S1)C Z274417684 [1,1,0,0,0,0|2,0,0]=4 270 B8R1.1 CNC1=NN=C(S1)S Z90662867 [1,1,0,0,0,0|2,0,0]=4 271 B8R1.1 COC1=NC(=NN1)N Z1203581724 [1,1,0,0,0,0|2,0,0]=4 272 B8R1.1 COC1=NNC(=C1)N Z2658869770 [1,1,0,0,0,0|2,0,0]=4 273 B8R1.1 COC1=NSC(=C1)N Z3004727765 [1,1,0,0,0,0|2,0,0]=4 274 B8R1.1 CSC1=NN=C(S1)N Z18452635 [1,1,0,0,0,0|1,1,0]=4 275 B8R1.1 CSC1=NN=C(S1)S Z56940989 [1,1,0,0,0,0|1,1,0]=4 276 B8R1.1 ClCC1=CC=C(S1)Cl Z57039589 [1,1,0,0,0,0|2,0,0]=4 277 B8R1.1 N#CC1=NC=C(S1)Br Z1255388447 [1,1,0,0,0,0|1,0,1]=4 278 B8R1.1 NC1=NN=C(S1)CO Z600620432 [1,1,0,0,0,0|2,0,0]=4 279 B8R1.1 NCC1=CC(=CS1)Br Z234895215 [1,1,0,0,0,0|2,0,0]=4 280 B8R1.1 NCC1=CC=C(S1)Br Z336481666 [1,1,0,0,0,0|2,0,0]=4 281 B8R1.1 NCC1=CC=C(S1)Cl Z426041582 [1,1,0,0,0,0|2,0,0]=4 282 B8R1.1 NCC1=NN=C(S1)N Z3234882069 [1,1,0,0,0,0|2,0,0]=4 283 B8R1.1 NCC1=NN=C(S1)S Z4201725041 [1,1,0,0,0,0|2,0,0]=4 284 B8R1.1 O=CC1=NC(=CS1)Cl Z1216838518 [1,1,0,0,0,0|1,0,1]=4 285 B8R1.1 O=CC1=NC=C(S1)Cl Z1201624665 [1,1,0,0,0,0|1,0,1]=4 286 B8R1.1 OCC1=CC(=CS1)Br Z362636152 [1,1,0,0,0,0|2,0,0]=4 287 B8R1.1 OCC1=CC=C(S1)Cl Z381678198 [1,1,0,0,0,0|2,0,0]=4 288 B8R1.1 OCC1=NC=C(S1)Br Z1270530467 [1,1,0,0,0,0|1,0,0]=3 289 B8R1.1 OCC1=NN=C(S1)Cl Z1136468630 [1,1,0,0,0,0|2,0,0]=4 290 B8R1.7 CC(=O)C1=CC=CS1 Z57127896 [1,1,0,0,0,0|1,0,1]=4 291 B8R1.7 CC(=O)C1=NC=CN1 Z2768175711 [1,1,0,0,0,0|1,0,1]=4 292 B8R1.7 CC(=O)C1=NC=CO1 Z1198173545 [1,1,0,0,0,0|0,1,1]=4 293 B8R1.7 CC(=O)C1=NC=CS1 Z1069877574 [1,1,0,0,0,0|0,0,1]=3 294 B8R1.7 CC(C)C1=CC=CS1 Z1198727220 [1,1,0,0,0,0|1,0,0]=3 295 B8R1.7 CC(C)C1=NC=CN1 Z335243296 [1,1,0,0,0,0|1,0,0]=3 296 B8R1.7 CC(C)C1=NN=CN1 Z2130643548 [1,1,0,0,0,0|2,0,0]=4 297 B8R1.7 CC(C)C1=NNC=C1 Z815437700 [1,1,0,0,0,0|2,0,0]=4 298 B8R1.7 CC(C)N1C=CC=N1 Z802540402 [1,1,0,0,0,0|2,0,0]=4 299 B8R1.7 CC(N)C1=CC=CN1 Z1198171808 [1,1,0,0,0,0|1,0,1]=4 300 B8R1.7 CC(N)C1=CC=CO1 Z89283368 [1,1,0,0,0,0|1,1,0]=4 301 B8R1.7 CC(N)C1=CC=CS1 Z119974474 [1,1,0,0,0,0|1,0,0]=3 302 B8R1.7 CC(N)C1=CC=NS1 Z2687575410 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.7 CC(N)C1=CNC=N1 Z1198180341 [1,1,0,0,0,0|2,0,0]=4 304 B8R1.7 CC(N)C1=COC=N1 Z3629373018 [1,1,0,0,0,0|2,0,0]=4 305 B8R1.7 CC(N)C1=NC=CO1 Z1962224571 [1,1,0,0,0,0|0,1,0]=3 306 B8R1.7 CC(N)C1=NC=CS1 Z803082278 [1,1,0,0,0,0|0,0,0]=2 307 B8R1.7 CC(N)C1=NN=CS1 Z4435730071 [1,1,0,0,0,0|1,0,0]=3 308 B8R1.7 CC(N)C1=NNC=N1 Z1274177567 [1,1,0,0,0,0|2,0,0]=4 309 B8R1.7 CC(O)C1=CC=CS1 Z335245078 [1,1,0,0,0,0|1,0,0]=3 310 B8R1.7 CC(O)C1=CNC=N1 Z1198180340 [1,1,0,0,0,0|2,0,0]=4 311 B8R1.7 CC(O)C1=NC=CN1 Z4326395573 [1,1,0,0,0,0|1,0,0]=3 312 B8R1.7 CC(O)C1=NC=CS1 Z1069884516 [1,1,0,0,0,0|0,0,0]=2 313 B8R1.7 CC(O)C1=NN=CN1 Z2587997232 [1,1,0,0,0,0|2,0,0]=4 314 B8R1.7 CC(O)C1=NNC=C1 Z655071084 [1,1,0,0,0,0|2,0,0]=4 315 B8R1.7 C[C@@H](N)C1=NC=CN1 Z2472857467 [1,1,0,0,0,0|1,0,0]=3 316 B8R1.7 C[C@@H](O)C1=CN=CS1 Z1217177234 [1,1,0,0,0,0|2,0,0]=4 317 B8R1.7 C[C@H](N)C1=CC=CO1 Z1407007556 [1,1,0,0,0,0|1,1,0]=4 318 B8R1.7 C[C@H](N)C1=NC=CN1 Z2205958486 [1,1,0,0,0,0|1,0,0]=3 319 B8R1.7 N=C(N)C1=NC=CS1 Z1198733885 [1,1,0,0,0,0|1,0,1]=4 320 B8R1.7 NC(=O)C1=NC=CS1 Z1198177216 [1,1,0,0,0,0|1,0,1]=4 321 B8R1.11 CC1=C(SC=C1)CN Z235352157 [1,1,0,0,0,0|2,0,0]=4 322 B8R1.11 CCC1=NN=CN1C Z992282430 [1,1,0,0,0,0|2,0,0]=4 323 B8R1.11 CCC1=NSC=C1N Z5711193458 [1,1,0,0,0,0|2,0,0]=4 324 B8R1.11 CCN1N=CC=C1N Z56347291 [1,1,0,0,0,0|2,0,0]=4 325 B8R1.11 CN1C=CN=C1CCl Z90122361 [1,1,0,0,0,0|2,0,0]=4 326 B8R1.11 CN1C=CN=C1CN Z235536854 [1,1,0,0,0,0|2,0,0]=4 327 B8R1.11 CN1C=CN=C1CO Z212169576 [1,1,0,0,0,0|2,0,0]=4 328 B8R1.11 COC1=NNC=C1C Z2943419549 [1,1,0,0,0,0|2,0,0]=4 329 B8R1.11 COC1=NSC=C1N Z2768512024 [1,1,0,0,0,0|2,0,0]=4 330 B8R1.11 CSC1=NC=CN1C Z18499760 [1,1,0,0,0,0|1,1,0]=4 331 B8R1.11 NCC1=C(C=CS1)Cl Z3244521023 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [0,1,0,0,0,1|2,0,0]=4 333 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [0,1,0,0,0,1|2,0,0]=4 334 B10R1.1 CCNC1=NN=C(C=C1)C Z802821712 [0,1,0,0,0,1|2,0,0]=4 335 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [0,1,0,0,0,1|2,0,0]=4 336 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [0,1,0,0,0,1|2,0,0]=4 337 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [0,1,0,0,0,1|2,0,0]=4 338 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [0,1,0,0,0,1|1,0,0]=3 339 B10R1.1 CCOC1=NC=C(C=N1)Cl Z1222423631 [0,1,0,0,0,1|1,0,0]=3 340 B10R1.1 CCOC1=NN=C(C=C1)Cl Z291235530 [0,1,0,0,0,1|1,0,0]=3 341 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [0,1,0,0,0,1|1,1,0]=4 342 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [0,1,0,0,0,1|1,1,0]=4 343 B10R1.4 CCCC1=C(N=CC=N1)Cl Z1504680268 [0,1,0,0,0,1|2,0,0]=4 344 B10R1.4 CCNC1=C(C=CC=N1)C Z968907586 [0,1,0,0,0,1|2,0,0]=4 345 B10R1.4 CCNC1=C(C=CC=N1)N Z803145254 [0,1,0,0,0,1|2,0,0]=4 346 B10R1.4 CCNC1=C(C=CN=C1)C Z1946684572 [0,1,0,0,0,1|2,0,0]=4 347 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [0,1,0,0,0,1|2,0,0]=4 348 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [0,1,0,0,0,1|2,0,0]=4 349 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [0,1,0,0,0,1|2,0,0]=4 350 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [0,1,0,0,0,1|2,0,0]=4 351 B10R1.4 CCOC1=C(C=CC=N1)N Z240084312 [0,1,0,0,0,1|1,0,0]=3 352 B10R1.4 CCOC1=C(N=CC=C1)N Z362783900 [0,1,0,0,0,1|1,0,0]=3 353 B10R1.10 CCCC1=NC(=CC=N1)N Z856211250 [0,1,0,0,0,1|2,0,0]=4 354 B10R1.10 CCNC1=NC(=NC=N1)N Z1203580120 [0,1,0,0,0,1|2,0,0]=4 355 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [0,1,0,0,0,1|2,0,0]=4 356 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [0,1,0,0,0,1|2,0,0]=4 357 B10R1.10 CCOC1=CC(=NC=C1)N Z1198157310 [0,1,0,0,0,1|2,0,0]=4 358 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [0,1,0,0,0,1|1,0,0]=3 359 B10R1.10 CCOC1=NC(=CC=C1)N Z1139188017 [0,1,0,0,0,1|1,0,0]=3 360 B10R1.10 CCOC1=NC(=CN=C1)Cl Z291235528 [0,1,0,0,0,1|1,0,0]=3 361 B10R1.10 CCOC1=NC(=CN=C1)N Z1198727889 [0,1,0,0,0,1|1,0,0]=3 362 B10R1.10 CCOC1=NC(=NC=C1)N Z1203581620 [0,1,0,0,0,1|1,0,0]=3 363 B10R1.10 CCSC1=NC(=CN=C1)Cl Z408197356 [0,1,0,0,0,1|1,1,0]=4 364 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,1,0,0,0,1|2,0,0]=4 365 B10R1.17 C#CCOC1=NC=CC=N1 Z1198278527 [0,1,0,0,0,1|1,0,1]=4 366 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,1,0,0,0,1|2,0,0]=4 367 B10R1.17 CCCOC1=NC=CN=C1 Z2182020100 [0,1,0,0,0,1|1,0,0]=3 368 B10R1.17 CCCSC1=NC=CC=N1 Z18380759 [0,1,0,0,0,1|1,1,0]=4 369 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [0,1,0,0,0,1|2,0,0]=4 370 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [0,1,0,0,0,1|1,1,0]=4 371 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,1,0,0,0,1|2,0,0]=4 372 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,1,0,0,0,1|2,0,0]=4 373 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [0,1,0,0,0,1|2,0,0]=4 374 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,1,0,0,0,1|2,0,0]=4 375 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,1,0,0,0,1|2,0,0]=4 376 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,1,0,0,0,1|2,0,0]=4 377 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,1,0,0,0,1|2,0,0]=4 378 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,1,0,0,0,1|2,0,0]=4 379 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,1,0,0,0,1|2,0,0]=4 380 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,1,0,0,0,1|2,0,0]=4 381 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [0,1,0,0,0,1|2,0,0]=4 382 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,1,0,0,0,1|1,0,0]=3 383 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,1,0,0,0,1|1,0,0]=3 384 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [0,1,0,0,0,1|1,0,1]=4 385 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,1,0,0,0,1|2,0,0]=4 386 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,1,0,0,0,1|2,0,0]=4 387 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [0,1,0,0,0,1|2,0,0]=4 388 B10R1.17 OCCNC1=NC=CC=N1 Z31212160 [0,1,0,0,0,1|2,0,0]=4 389 B10R1.17 OCCNC1=NC=CN=C1 Z31212301 [0,1,0,0,0,1|2,0,0]=4 390 B10R1.17 OCCNC1=NN=CC=C1 Z991531008 [0,1,0,0,0,1|2,0,0]=4 391 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,1,0,0,0,1|2,0,0]=4 392 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,1,0,0,0,1|1,0,0]=3 393 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [0,1,0,0,0,1|2,0,0]=4 394 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [0,1,0,0,0,1|2,0,0]=4 395 B10R1.18 CC(C)NC1=NC=CC=N1 Z31190928 [0,1,0,0,0,1|2,0,0]=4 396 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,1,0,0,0,1|2,0,0]=4 397 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [0,1,0,0,0,1|2,0,0]=4 398 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [0,1,0,0,0,1|2,0,0]=4 399 B10R1.18 FC(F)OC1=CN=CC=C1 Z808605476 [0,1,0,0,0,1|2,0,0]=4 400 B10R1.14 CC1=CN=C(S1)C(C)CN Z994267508 [0,2,0,0,0,0|2,0,0]=4 401 B10R1.14 CCC(=O)C1=CC=C(S1)Cl Z275168444 [0,2,0,0,0,0|2,0,0]=4 402 B10R1.14 CCC(N)C1=CC=C(S1)Cl Z359503512 [0,2,0,0,0,0|2,0,0]=4 403 B10R1.14 CCC(N)C1=NC(=CS1)C Z803082480 [0,2,0,0,0,0|1,0,0]=3 404 B10R1.14 CCC(N)C1=NC=C(N1)C Z2442102859 [0,2,0,0,0,0|2,0,0]=4 405 B10R1.14 CCC(N)C1=NC=C(S1)C Z431954100 [0,2,0,0,0,0|1,0,0]=3 406 B10R1.16 C=CCOC1=NN=C(S1)C Z3013895138 [0,2,0,0,0,0|1,0,1]=4 407 B10R1.16 CC1=CSC(=N1)CCCN Z994258928 [0,2,0,0,0,0|1,0,0]=3 408 B10R1.16 CC1=CSC(=N1)NCCN Z2242043614 [0,2,0,0,0,0|1,0,0]=3 409 B10R1.16 CC1=NN=C(S1)CCCN Z3069856930 [0,2,0,0,0,0|2,0,0]=4 410 B10R1.16 CC1=NN=C(S1)SCCO Z71200404 [0,2,0,0,0,0|1,1,0]=4 411 B10R1.16 CCCCC1=NN=C(S1)N Z56769166 [0,2,0,0,0,0|2,0,0]=4 412 B10R1.16 CCCNC1=NN=C(S1)S Z90670272 [0,2,0,0,0,0|2,0,0]=4 413 B10R1.16 CCNCC1=CC=C(S1)Br Z85920474 [0,2,0,0,0,0|2,0,0]=4 414 B10R1.16 CCNCC1=CC=C(S1)Cl Z57051062 [0,2,0,0,0,0|2,0,0]=4 415 B10R1.16 CCOCC1=NN=C(O1)N Z351731400 [0,2,0,0,0,0|1,1,0]=4 416 B10R1.16 CCONC1=NCC(S1)C Z56872125 [0,2,0,0,0,0|0,0,2]=4 417 B10R1.16 CNCCC1=NC=C(S1)C Z994267504 [0,2,0,0,0,0|1,0,0]=3 418 B10R1.16 COCCC1=NN=C(S1)N Z3220190930 [0,2,0,0,0,0|2,0,0]=4 419 B10R1.16 CSCCC1=NN=C(S1)N Z1201679509 [0,2,0,0,0,0|2,0,0]=4 420 B10R1.16 NCCCC1=NN=C(S1)N Z3234882071 [0,2,0,0,0,0|2,0,0]=4 421 B10R1.16 OCCCC1=CC(=CS1)Br Z993012592 [0,2,0,0,0,0|2,0,0]=4 422 B10R1.16 OCCSC1=NN=C(S1)S Z1198218634 [0,2,0,0,0,0|1,1,0]=4 423 B10R1.54 CC(=O)NC1=NC(=CS1)C Z30820114 [0,2,0,0,0,0|1,0,1]=4 424 B10R1.54 CC(C)CC1=NN=C(S1)N Z56791573 [0,2,0,0,0,0|2,0,0]=4 425 B10R1.54 CC(C)NC1=NN=C(S1)S Z56985820 [0,2,0,0,0,0|2,0,0]=4 426 B10R1.54 CC(C)SC1=NN=C(S1)S Z57040486 [0,2,0,0,0,0|1,1,0]=4 427 B10R1.54 CC1=CC=C(S1)CC(C)N Z381678020 [0,2,0,0,0,0|2,0,0]=4 428 B10R1.96 CCC1=CN=C(S1)CNC Z994289008 [0,2,0,0,0,0|2,0,0]=4 429 B10R1.96 CCCC1=CC=C(S1)C=O Z1198171732 [0,2,0,0,0,0|2,0,0]=4 430 B10R1.96 CCCC1=NC(=CO1)C#N Z1943832258 [0,2,0,0,0,0|1,1,0]=4 431 B10R1.96 CCCC1=NC(=CS1)CCl Z254526242 [0,2,0,0,0,0|1,0,0]=3 432 B10R1.96 CCCC1=NC=C(S1)C=O Z802592208 [0,2,0,0,0,0|1,0,0]=3 433 B10R1.96 CCNC1=NN=C(S1)SC Z114023892 [0,2,0,0,0,0|2,0,0]=4 434 B10R1.96 CCOC1=CC=C(O1)C=O Z1309664832 [0,2,0,0,0,0|1,1,0]=4 435 B10R1.96 CCOC1=NC=C(S1)C=O Z1198220938 [0,2,0,0,0,0|0,0,0]=2 436 B10R1.96 CCSC1=NN=C(S1)NC Z92638736 [0,2,0,0,0,0|1,1,0]=4 437 B10R1.96 COCC1=NC(=CS1)C=O Z825741958 [0,2,0,0,0,0|2,0,0]=4 438 B10R1.131 CC1=C(SC(=N1)CCN)C Z803066586 [0,2,0,0,0,0|2,0,0]=4 439 B10R1.131 CCNC1=NN(C(=S)S1)C Z235264025 [0,2,0,0,0,0|2,0,0]=4 440 B10R1.6 CCC(C)(N)C1=NC=CS1 Z803083898 [0,2,0,0,0,0|1,0,0]=3 441 B10R1.9 CCN(CC)C1=NC=CS1 Z56347338 [0,2,0,0,0,0|1,0,0]=3 442 B10R1.11 CCCC(O)C1=NC=CS1 Z1198723669 [0,2,0,0,0,0|1,0,0]=3 443 B10R1.11 CCOC(=O)C1=CC=CN1 Z292815334 [0,2,0,0,0,0|1,0,1]=4 444 B10R1.11 CCOC(=O)C1=CN=CS1 Z293196510 [0,2,0,0,0,0|2,0,0]=4 445 B10R1.11 CCOC(=O)C1=COC=N1 Z1083217768 [0,2,0,0,0,0|2,0,0]=4 446 B10R1.11 CCOC(=O)C1=CSC=N1 Z851814010 [0,2,0,0,0,0|2,0,0]=4 447 B10R1.11 CCOC(=O)C1=NN=CS1 Z1255421060 [0,2,0,0,0,0|1,0,0]=3 448 B10R1.11 CCOC(=O)C1=NNC=N1 Z1124756565 [0,2,0,0,0,0|2,0,0]=4 449 B10R1.11 CCOC(=O)C1=NOC=N1 Z1136435576 [0,2,0,0,0,0|2,0,0]=4 450 B10R1.11 CCOC(C)C1=NC=CN1 Z1263531006 [0,2,0,0,0,0|1,0,0]=3 451 B10R1.11 COCC(O)C1=NC=CS1 Z1198727607 [0,2,0,0,0,0|1,0,0]=3 452 B10R1.11 NC(CCO)C1=CC=CS1 Z979743758 [0,2,0,0,0,0|2,0,0]=4 453 B10R1.23 CC(C)C(N)C1=NC=CN1 Z1813098660 [0,2,0,0,0,0|2,0,0]=4 454 B10R1.23 CC(C)C(O)C1=NC=CN1 Z4957133876 [0,2,0,0,0,0|2,0,0]=4 455 B10R1.149 CCC(=O)C1=C(C=CS1)Cl Z1412890361 [0,2,0,0,0,0|2,0,0]=4 456 B10R1.21 CCNCCC1=CC=CS1 Z162417018 [0,2,0,0,0,0|2,0,0]=4 457 B10R1.21 CCNCCC1=NC=CS1 Z1104861381 [0,2,0,0,0,0|1,0,0]=3 458 B10R1.21 N#CCCNC1=NN=CS1 Z57069633 [0,2,0,0,0,0|2,0,0]=4 459 B10R1.21 N#CCCSC1=NN=CS1 Z25107573 [0,2,0,0,0,0|1,1,0]=4 460 B10R1.21 NCCCCC1=NC=CS1 Z1263529637 [0,2,0,0,0,0|1,0,0]=3 461 B10R1.21 NCCCSC1=NC=CS1 Z764962842 [0,2,0,0,0,0|0,1,0]=3 462 B10R1.21 OCCCCC1=NC=CS1 Z1346130460 [0,2,0,0,0,0|1,0,0]=3 463 B10R1.27 CC(CN)CC1=CC=CS1 Z992308868 [0,2,0,0,0,0|2,0,0]=4 464 B10R1.27 CCC(=O)CC1=CC=CS1 Z734152558 [0,2,0,0,0,0|2,0,0]=4 465 B10R1.27 CCC(=O)NC1=NC=CS1 Z28173656 [0,2,0,0,0,0|1,0,0]=3 466 B10R1.27 COC(=O)CC1=NC=CS1 Z803104020 [0,2,0,0,0,0|1,0,1]=4 467 B10R1.27 NC(CO)CC1=NC=CS1 Z3004013658 [0,2,0,0,0,0|1,0,0]=3 468 B10R1.27 NCC(=O)NC1=NC=CS1 Z802671572 [0,2,0,0,0,0|1,0,1]=4 469 B10R1.27 O=C(CCl)NC1=NC=CS1 Z56887742 [0,2,0,0,0,0|1,0,1]=4 470 B10R1.29 CN1C=CN=C1CCCO Z1198265515 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.66 CC(C)NCC1=CC=CS1 Z90502193 [0,2,0,0,0,0|2,0,0]=4 472 B10R1.66 FC(F)COC1=NNC=C1 Z3678314047 [0,2,0,0,0,0|2,0,0]=4 473 B10R1.66 FC(F)CSC1=NC=CN1 Z1273007569 [0,2,0,0,0,0|1,1,0]=4 474 B10R1.66 O=C(O)CCC1=NC=CS1 Z381407426 [0,2,0,0,0,0|1,0,1]=4 475 B10R1.66 O=C(O)CNC1=NC=CS1 Z316100440 [0,2,0,0,0,0|1,0,1]=4 476 B10R1.66 O=C(O)CSC1=NC=CS1 Z295404488 [0,2,0,0,0,0|0,1,1]=4 477 B10R1.64 CC(C)NC1=NC=CN1C Z959381410 [0,2,0,0,0,0|2,0,0]=4 478 B10R1.281 CC(C)(C)NC1=NC=CS1 Z86237247 [0,2,0,0,0,0|1,0,0]=3 479 B10R1.5 CCSC1=NC=CN1CC Z223726444 [0,2,0,0,0,0|1,1,0]=4 480 B8R1.2 CCC1=CN=CC=C1 Z104476778 [0,0,1,1,0,0|2,0,0]=4 481 B8R1.2 CCC1=NC=CC=C1 Z113558650 [0,0,1,1,0,0|2,0,0]=4 482 B8R1.4 CC1=CC(=NC=C1)S Z851791760 [0,0,1,1,0,0|1,0,1]=4 483 B8R1.18 CC1=C(OC(=N1)S)C Z234904536 [0,0,1,1,0,0|0,0,2]=4 484 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [0,0,0,1,0,1|2,0,0]=4 485 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [0,0,0,1,0,1|2,0,0]=4 486 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [0,0,0,1,0,1|2,0,0]=4 487 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [0,0,0,1,0,1|2,0,0]=4 488 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [0,0,0,1,0,1|2,0,0]=4 489 B10R2.2 NC1CC2=NC=CN2C1 Z1416167525 [0,1,0,1,0,0|2,0,0]=4 490 B10R2.14 BrC1=NN=C(S1)C2CC2 Z1136468883 [0,1,0,1,0,0|2,0,0]=4 491 B10R2.14 NC1=NN=C(S1)C2CC2 Z56899104 [0,1,0,1,0,0|2,0,0]=4 492 B10R2.14 NC1=NSC(=N1)C2CC2 Z1235956342 [0,1,0,1,0,0|2,0,0]=4 493 B10R2.14 OC1=NN=C(S1)C2CC2 Z3303738990 [0,1,0,1,0,0|2,0,0]=4 494 B10R2.32 NC1=CN=C2N1CCC2 Z2310732320 [0,1,0,1,0,0|2,0,0]=4 495 B10R2.32 NC1CCN2C1=NC=C2 Z1216842580 [0,1,0,1,0,0|2,0,0]=4 496 B10R2.32 O=C1CCN2C1=NC=C2 Z1216843610 [0,1,0,1,0,0|2,0,0]=4 497 B10R2.32 OC1CCN2C1=NC=C2 Z1216842582 [0,1,0,1,0,0|2,0,0]=4 498 B10R2.16 NC1(CC1)C2=CC=CS2 Z3247608708 [0,1,0,1,0,0|2,0,0]=4 499 B10R2.16 NC1(CC1)C2=NC=CN2 Z3088310013 [0,1,0,1,0,0|2,0,0]=4 500 B10R2.16 NC1(CC1)C2=NC=CO2 Z5002992539 [0,1,0,1,0,0|1,1,0]=4 501 B10R2.136 C1=CNC(=N1)C2CCC2 Z1203748783 [0,1,0,1,0,0|2,0,0]=4 502 B10R2.136 C1=CNC(=N1)C2CNC2 Z2867705708 [0,1,0,1,0,0|2,0,0]=4 503 B10R2.193 C1=CSC(=N1)NC2CC2 Z86250855 [0,1,0,1,0,0|1,0,0]=3