0 B8R1.8 C#CCN1C=CN=C1 Z1258992451 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.8 C=CCN1C=CN=C1 Z104477560 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CCCC1=CNN=C1 Z1263714332 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 CCCC1=NC=CN1 Z1201043633 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 CCCC1=NN=NN1 Z335295252 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.8 CCCC1=NNC=N1 Z803077816 [0,0,0,0,0,0|2,0,2]=4 6 B8R1.8 CCNC1=NC=CN1 Z1463350447 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.8 CCNC1=NC=NN1 Z1203735308 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.8 CCNC1=NN=CO1 Z1823617731 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.8 CCNC1=NN=CS1 Z1082872548 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.8 CCOC1=CNN=C1 Z1726113833 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.8 CNCC1=CC=CN1 Z102767010 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.8 CNCC1=CC=CO1 Z57051072 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.8 CNCC1=CC=CS1 Z56948283 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.8 CNCC1=CNN=C1 Z1267881670 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.8 CNCC1=COC=C1 Z385447092 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.8 CNCC1=CSC=C1 Z57206125 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.8 CNCC1=CSC=N1 Z138108610 [0,0,0,0,0,0|3,0,1]=4 18 B8R1.8 CNCC1=NC=CN1 Z445210554 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.8 CNCC1=NN=CN1 Z1575082063 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.8 CNCC1=NN=CS1 Z4663887855 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.8 COCC1=CNC=N1 Z1203733599 [0,0,0,0,0,0|2,0,2]=4 22 B8R1.8 COCC1=NC=CN1 Z1203733422 [0,0,0,0,0,0|4,0,0]=4 23 B8R1.8 COCC1=NN=NN1 Z1000888 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.8 ClCCN1C=CN=C1 Z94599643 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.8 N#CCC1=CC=CN1 Z810507734 [0,0,0,0,0,0|1,0,2]=3 26 B8R1.8 N#CCC1=CC=NO1 Z90662868 [0,0,0,0,0,0|2,0,2]=4 27 B8R1.8 N#CCC1=CN=CN1 Z1198166128 [0,0,0,0,0,0|0,0,2]=2 28 B8R1.8 N#CCC1=CNN=C1 Z875024638 [0,0,0,0,0,0|2,0,2]=4 29 B8R1.8 N#CCC1=CON=C1 Z600429582 [0,0,0,0,0,0|2,0,2]=4 30 B8R1.8 N#CCC1=CSC=C1 Z111869576 [0,0,0,0,0,0|2,0,2]=4 31 B8R1.8 N#CCC1=CSC=N1 Z164707272 [0,0,0,0,0,0|1,0,3]=4 32 B8R1.8 N#CCC1=NC=CN1 Z331689878 [0,0,0,0,0,0|2,0,2]=4 33 B8R1.8 N#CCC1=NN=CN1 Z1201622614 [0,0,0,0,0,0|1,0,2]=3 34 B8R1.8 N#CCN1C=NC=N1 Z295205188 [0,0,0,0,0,0|1,0,3]=4 35 B8R1.8 NCCC1=CC=CN1 Z810507730 [0,0,0,0,0,0|1,0,0]=1 36 B8R1.8 NCCC1=CC=CO1 Z1694636467 [0,0,0,0,0,0|2,0,0]=2 37 B8R1.8 NCCC1=CC=CS1 Z90662945 [0,0,0,0,0,0|2,0,0]=2 38 B8R1.8 NCCC1=CC=NS1 Z2768432862 [0,0,0,0,0,0|2,0,0]=2 39 B8R1.8 NCCC1=CNC=N1 Z1267773750 [0,0,0,0,0,0|0,0,2]=2 40 B8R1.8 NCCC1=CNN=C1 Z336080532 [0,0,0,0,0,0|2,0,0]=2 41 B8R1.8 NCCC1=CNN=N1 Z3005762594 [0,0,0,0,0,0|1,0,2]=3 42 B8R1.8 NCCC1=COC=C1 Z2310701825 [0,0,0,0,0,0|2,0,0]=2 43 B8R1.8 NCCC1=NC=CO1 Z4925106850 [0,0,0,0,0,0|2,0,1]=3 44 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,0,0,0,0,0|2,0,1]=3 45 B8R1.8 NCCC1=NN=CN1 Z1687906395 [0,0,0,0,0,0|1,0,0]=1 46 B8R1.8 NCCC1=NN=CS1 Z3067374940 [0,0,0,0,0,0|2,0,0]=2 47 B8R1.8 NCCC1=NN=NN1 Z1160899439 [0,0,0,0,0,0|2,0,0]=2 48 B8R1.8 NCCC1=NNC=C1 Z2867120994 [0,0,0,0,0,0|2,0,1]=3 49 B8R1.8 NCCC1=NOC=N1 Z1262691677 [0,0,0,0,0,0|2,0,1]=3 50 B8R1.8 NCCC1CC=CC1 Z2310699161 [0,0,0,0,0,0|2,0,2]=4 51 B8R1.8 NCCN1C=CC=N1 Z271005714 [0,0,0,0,0,0|2,0,1]=3 52 B8R1.8 NCCN1C=CN=C1 Z147642864 [0,0,0,0,0,0|2,0,0]=2 53 B8R1.8 NCCN1C=CN=N1 Z2491107416 [0,0,0,0,0,0|3,0,0]=3 54 B8R1.8 NCCN1C=NC=N1 Z381061410 [0,0,0,0,0,0|1,0,1]=2 55 B8R1.8 NCCN1C=NN=N1 Z2065464306 [0,0,0,0,0,0|2,0,1]=3 56 B8R1.8 NCCN1N=CN=N1 Z2070537934 [0,0,0,0,0,0|2,0,1]=3 57 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [0,0,0,0,0,0|3,0,1]=4 58 B8R1.8 O=CCC1=CC=CS1 Z993017816 [0,0,0,0,0,0|3,0,1]=4 59 B8R1.8 O=CCC1=CSC=C1 Z1079442684 [0,0,0,0,0,0|3,0,1]=4 60 B8R1.8 OCCC1=CC=CO1 Z1179944660 [0,0,0,0,0,0|3,0,0]=3 61 B8R1.8 OCCC1=CC=CS1 Z397587354 [0,0,0,0,0,0|3,0,0]=3 62 B8R1.8 OCCC1=CN=CS1 Z1198334159 [0,0,0,0,0,0|2,0,0]=2 63 B8R1.8 OCCC1=CNN=C1 Z1333876037 [0,0,0,0,0,0|3,0,0]=3 64 B8R1.8 OCCC1=CNN=N1 Z982120080 [0,0,0,0,0,0|2,0,2]=4 65 B8R1.8 OCCC1=COC=C1 Z1179944659 [0,0,0,0,0,0|3,0,0]=3 66 B8R1.8 OCCC1=CSC=C1 Z397587098 [0,0,0,0,0,0|3,0,0]=3 67 B8R1.8 OCCC1=CSC=N1 Z1263714384 [0,0,0,0,0,0|2,0,1]=3 68 B8R1.8 OCCN1C=CC=N1 Z425794824 [0,0,0,0,0,0|3,0,1]=4 69 B8R1.8 OCCN1C=NC=N1 Z234898253 [0,0,0,0,0,0|2,0,1]=3 70 B7R1.1 CCC1=CC=CO1 Z640169748 [1,0,0,0,0,0|2,0,0]=3 71 B7R1.1 CCC1=CNC=N1 Z1203731354 [1,0,0,0,0,0|0,0,2]=3 72 B7R1.1 CCC1=CNN=C1 Z1139192482 [1,0,0,0,0,0|2,0,0]=3 73 B7R1.1 CCC1=NC=CN1 Z803154382 [1,0,0,0,0,0|2,0,0]=3 74 B7R1.1 CCC1=NN=CN1 Z2065464313 [1,0,0,0,0,0|1,0,0]=2 75 B7R1.1 CCC1=NN=NN1 Z335291070 [1,0,0,0,0,0|2,0,0]=3 76 B7R1.1 CCC1=NNC=C1 Z1238571110 [1,0,0,0,0,0|2,0,1]=4 77 B7R1.1 CCN1C=CC=N1 Z600618624 [1,0,0,0,0,0|2,0,1]=4 78 B7R1.1 CCN1C=CN=C1 Z286789018 [1,0,0,0,0,0|2,0,0]=3 79 B7R1.1 CCN1C=CN=N1 Z4497103939 [1,0,0,0,0,0|3,0,0]=4 80 B7R1.1 CNC1=CNN=C1 Z1313483441 [1,0,0,0,0,0|3,0,0]=4 81 B7R1.1 CNC1=NN=CO1 Z235540568 [1,0,0,0,0,0|3,0,0]=4 82 B7R1.1 CNC1=NN=CS1 Z1082870996 [1,0,0,0,0,0|3,0,0]=4 83 B7R1.1 CNC1=NN=NN1 Z2572821634 [1,0,0,0,0,0|3,0,0]=4 84 B7R1.1 COC1=CNN=C1 Z2525138345 [1,0,0,0,0,0|3,0,0]=4 85 B7R1.1 COC1=NN=CS1 Z1642058386 [1,0,0,0,0,0|3,0,0]=4 86 B7R1.1 CSC1=NC=CN1 Z1203730949 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.1 CSC1=NN=NN1 Z821307136 [1,0,0,0,0,0|3,0,0]=4 88 B7R1.1 N#CC1=CN=CS1 Z1160900223 [1,0,0,0,0,0|1,0,2]=4 89 B7R1.1 N#CC1=NN=CN1 Z104510140 [1,0,0,0,0,0|1,0,2]=4 90 B7R1.1 NCC1=CC=CN1 Z976631692 [1,0,0,0,0,0|1,0,0]=2 91 B7R1.1 NCC1=CC=CS1 Z104485908 [1,0,0,0,0,0|2,0,0]=3 92 B7R1.1 NCC1=CC=NO1 Z1964347782 [1,0,0,0,0,0|2,0,0]=3 93 B7R1.1 NCC1=CC=NS1 Z2310716170 [1,0,0,0,0,0|2,0,0]=3 94 B7R1.1 NCC1=CN=CN1 Z1250100778 [1,0,0,0,0,0|0,0,0]=1 95 B7R1.1 NCC1=CNC=C1 Z1203586194 [1,0,0,0,0,0|1,0,1]=3 96 B7R1.1 NCC1=CNN=C1 Z1198394221 [1,0,0,0,0,0|2,0,0]=3 97 B7R1.1 NCC1=CNN=N1 Z2768172060 [1,0,0,0,0,0|1,0,2]=4 98 B7R1.1 NCC1=COC=C1 Z406680098 [1,0,0,0,0,0|2,0,0]=3 99 B7R1.1 NCC1=CSN=C1 Z2310727787 [1,0,0,0,0,0|2,0,0]=3 100 B7R1.1 NCC1=NC=CN1 Z1962341939 [1,0,0,0,0,0|2,0,0]=3 101 B7R1.1 NCC1=NC=CO1 Z4774639311 [1,0,0,0,0,0|2,0,1]=4 102 B7R1.1 NCC1=NC=CS1 Z1198107502 [1,0,0,0,0,0|2,0,1]=4 103 B7R1.1 NCC1=NC=NO1 Z2310727797 [1,0,0,0,0,0|1,0,1]=3 104 B7R1.1 NCC1=NCCN1 Z2714784585 [1,0,0,0,0,0|2,0,1]=4 105 B7R1.1 NCC1=NN=CO1 Z104505014 [1,0,0,0,0,0|2,0,0]=3 106 B7R1.1 NCC1=NN=CS1 Z2738360224 [1,0,0,0,0,0|2,0,0]=3 107 B7R1.1 NCC1=NN=NN1 Z1172068153 [1,0,0,0,0,0|2,0,0]=3 108 B7R1.1 NCC1=NOC=C1 Z802903300 [1,0,0,0,0,0|2,0,1]=4 109 B7R1.1 NCC1=NOC=N1 Z1266854926 [1,0,0,0,0,0|2,0,1]=4 110 B7R1.1 NCC1=NON=C1 Z2944173400 [1,0,0,0,0,0|1,0,1]=3 111 B7R1.1 O=CC1=CC=CN1 Z104478580 [1,0,0,0,0,0|2,0,1]=4 112 B7R1.1 OCC1=CC=CO1 Z104472794 [1,0,0,0,0,0|3,0,0]=4 113 B7R1.1 OCC1=CC=CS1 Z104478586 [1,0,0,0,0,0|3,0,0]=4 114 B7R1.1 OCC1=CNC=N1 Z234898057 [1,0,0,0,0,0|1,0,2]=4 115 B7R1.1 OCC1=CNN=C1 Z812520032 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.1 OCC1=COC=C1 Z397587426 [1,0,0,0,0,0|3,0,0]=4 117 B7R1.1 OCC1=NC=CN1 Z825761068 [1,0,0,0,0,0|3,0,0]=4 118 B7R1.1 OCC1=NN=CN1 Z2574360328 [1,0,0,0,0,0|2,0,0]=3 119 B7R1.1 OCC1=NN=NN1 Z1000189 [1,0,0,0,0,0|3,0,0]=4 120 B7R1.1 OCN1C=NC=N1 Z57071658 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.7 CC1=CC=C(S1)CCN Z3038322398 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.7 CC1=CN(N=C1)CCN Z600430704 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.7 CC1=CN=C(S1)CCN Z994267436 [0,1,0,0,0,0|2,0,1]=4 124 B9R1.7 CC1=NC(=CS1)CCN Z1744689874 [0,1,0,0,0,0|1,0,1]=3 125 B9R1.7 CC1=NC(=CS1)CCO Z1201624831 [0,1,0,0,0,0|2,0,1]=4 126 B9R1.7 CC1=NC(=NN1)CCN Z1263602348 [0,1,0,0,0,0|1,0,2]=4 127 B9R1.7 CC1=NC(=NO1)CCN Z1682072467 [0,1,0,0,0,0|2,0,1]=4 128 B9R1.7 CC1=NC=C(O1)CCN Z3251575034 [0,1,0,0,0,0|1,0,0]=2 129 B9R1.7 CC1=NC=C(S1)CC#N Z1182322189 [0,1,0,0,0,0|1,0,2]=4 130 B9R1.7 CC1=NC=C(S1)CCN Z1079164344 [0,1,0,0,0,0|1,0,0]=2 131 B9R1.7 CC1=NN(C=C1)CCN Z3248014730 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.7 CC1=NN(N=N1)CCN Z1416282946 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.7 CC1=NN=C(N1)CCO Z4201878113 [0,1,0,0,0,0|2,0,0]=3 134 B9R1.7 CC1=NN=C(S1)CCN Z1201628633 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.7 CC1=NOC(=C1)CCN Z2092369291 [0,1,0,0,0,0|2,0,0]=3 136 B9R1.7 CC1=NOC(=N1)CCN Z969559798 [0,1,0,0,0,0|1,0,1]=3 137 B9R1.7 CCCC1=CC(=O)NN1 Z2583036240 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.7 CCCC1=CN=C(S1)N Z1203578740 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.7 CCCC1=CNC(=O)N1 Z1203732484 [0,1,0,0,0,0|1,0,1]=3 140 B9R1.7 CCCC1=CSC(=N1)N Z1582264042 [0,1,0,0,0,0|2,0,1]=4 141 B9R1.7 CCCC1=NC(=NN1)C Z385478576 [0,1,0,0,0,0|2,0,1]=4 142 B9R1.7 CCCC1=NN=C(N1)S Z56921538 [0,1,0,0,0,0|2,0,0]=3 143 B9R1.7 CCCC1=NN=C(O1)N Z285233902 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.7 CCCC1=NN=C(S1)Br Z1136468837 [0,1,0,0,0,0|3,0,0]=4 145 B9R1.7 CCCC1=NN=C(S1)N Z56768598 [0,1,0,0,0,0|3,0,0]=4 146 B9R1.7 CCCN1C=NC(=C1)N Z3210756298 [0,1,0,0,0,0|3,0,0]=4 147 B9R1.7 CCSC1=NN=C(N1)N Z18356876 [0,1,0,0,0,0|3,0,0]=4 148 B9R1.7 CN1C=C(C=N1)CCN Z335291636 [0,1,0,0,0,0|2,0,0]=3 149 B9R1.7 CN1C=C(C=N1)CCO Z992949632 [0,1,0,0,0,0|3,0,0]=4 150 B9R1.7 CN1C=NC(=C1)CCN Z5632546328 [0,1,0,0,0,0|0,0,2]=3 151 B9R1.7 CN1C=NC(=N1)CCN Z1682072425 [0,1,0,0,0,0|1,0,2]=4 152 B9R1.7 CN1N=CC(=N1)CCO Z2179941262 [0,1,0,0,0,0|2,0,1]=4 153 B9R1.7 CNCC1=CN=C(S1)C Z432733330 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.7 COCC1=NN=C(N1)N Z802558930 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.7 COCC1=NN=C(N1)S Z802558922 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.7 NC1=NC(=CS1)CCO Z1198266841 [0,1,0,0,0,0|2,0,1]=4 157 B9R1.7 NC1=NC=C(S1)CCO Z1203580148 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.7 NC1=NN(C=N1)CCO Z600615284 [0,1,0,0,0,0|2,0,1]=4 159 B9R1.7 NC1=NN=C(S1)CCCl Z1205658599 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.7 NCCC1=CC(=O)NN1 Z1483956795 [0,1,0,0,0,0|2,0,0]=3 161 B9R1.7 NCCC1=CC=C(O1)Br Z1442016604 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.7 NCCC1=CC=C(S1)Cl Z432066930 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.7 NCCC1=CC=C(S1)I Z1262398458 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.7 NCCC1=CSC(=C1)Br Z4125344523 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.7 NCCC1=CSC(=N1)N Z1901070719 [0,1,0,0,0,0|1,0,1]=3 166 B9R1.7 NCCC1=NC(=NN1)N Z2168541806 [0,1,0,0,0,0|1,0,1]=3 167 B9R1.7 NCCC1=NC(=NO1)N Z1259340155 [0,1,0,0,0,0|1,0,1]=3 168 B9R1.7 NCCC1=NC(=O)NN1 Z1285151897 [0,1,0,0,0,0|1,0,2]=4 169 B9R1.7 NCCC1=NN=C(O1)N Z1744709993 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.7 NCCC1=NN=C(O1)S Z1737940672 [0,1,0,0,0,0|2,0,0]=3 171 B9R1.7 NCCC1=NN=C(S1)N Z3234882070 [0,1,0,0,0,0|2,0,0]=3 172 B9R1.7 NCCN1C=C(C=N1)I Z3183972621 [0,1,0,0,0,0|2,0,1]=4 173 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.11 CC(CN)C1=CN=CN1 Z2865711302 [0,1,0,0,0,0|0,0,0]=1 175 B9R1.11 CC(CN)C1=NC=CN1 Z3205686355 [0,1,0,0,0,0|2,0,0]=3 176 B9R1.11 CC(CN)C1=NC=CS1 Z994266314 [0,1,0,0,0,0|2,0,1]=4 177 B9R1.11 CC(CN)C1=NN=NN1 Z1675167186 [0,1,0,0,0,0|2,0,0]=3 178 B9R1.11 CC(CN)C1=NOC=N1 Z2899612303 [0,1,0,0,0,0|2,0,1]=4 179 B9R1.11 CCC(=O)C1=NN=CN1 Z1259213773 [0,1,0,0,0,0|2,0,1]=4 180 B9R1.11 CCC(C)N1C=CN=C1 Z57842757 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.11 CCC(N)C1=CC=CS1 Z744593088 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.11 CCC(N)C1=COC=N1 Z3594983524 [0,1,0,0,0,0|2,0,1]=4 183 B9R1.11 CCC(N)C1=NC=CN1 Z1723549294 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.11 CCC(N)C1=NN=CN1 Z1255523392 [0,1,0,0,0,0|2,0,0]=3 185 B9R1.11 CCC(N)C1=NN=NN1 Z756918812 [0,1,0,0,0,0|3,0,0]=4 186 B9R1.11 CCC(O)C1=NC=CN1 Z1889917109 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.11 COC(=O)C1=CN=CN1 Z1250100745 [0,1,0,0,0,0|2,0,1]=4 188 B9R1.11 NC(CO)C1=CC=CO1 Z1255405023 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.11 NC(CO)C1=CSC=N1 Z3813478275 [0,1,0,0,0,0|2,0,1]=4 190 B9R1.11 NCC(=O)C1=CC=CO1 Z1193968923 [0,1,0,0,0,0|2,0,1]=4 191 B9R1.11 NCC(=O)C1=CC=NN1 Z5198855335 [0,1,0,0,0,0|2,0,1]=4 192 B9R1.11 NCC(=O)C1=CN=CS1 Z2865546208 [0,1,0,0,0,0|1,0,1]=3 193 B9R1.11 NCC(O)C1=CN=CS1 Z2310732372 [0,1,0,0,0,0|1,0,0]=2 194 B9R1.11 NCC(O)C1=CNC=N1 Z2310707384 [0,1,0,0,0,0|0,0,2]=3 195 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [0,1,0,0,0,0|2,0,0]=3 196 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [0,1,0,0,0,0|2,0,0]=3 197 B9R1.11 NNC(=O)C1=CC=CN1 Z95516011 [0,1,0,0,0,0|2,0,1]=4 198 B9R1.11 O=C(CCl)C1=CC=CN1 Z56912626 [0,1,0,0,0,0|2,0,1]=4 199 B9R1.11 O=C(CCl)C1=CN=CO1 Z3034481585 [0,1,0,0,0,0|2,0,1]=4 200 B9R1.12 C#CCCN1C=NC=N1 Z4922335864 [0,1,0,0,0,0|2,0,1]=4 201 B9R1.12 CCCCC1=CN=CO1 Z2520746593 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.12 CCNCC1=CC=CO1 Z90513169 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.12 CCNCC1=CN=CS1 Z3268542028 [0,1,0,0,0,0|2,0,0]=3 204 B9R1.12 CCNCC1=COC=C1 Z385447452 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.12 CCNCC1=NN=NN1 Z1263529662 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.12 CCOCC1=NC=CN1 Z1203819044 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.12 CNCCC1=CC=CS1 Z162416950 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.12 CNCCC1=NNC=C1 Z2686452658 [0,1,0,0,0,0|2,0,1]=4 209 B9R1.12 CNCCC1=NNN=N1 Z2143575916 [0,1,0,0,0,0|2,0,1]=4 210 B9R1.12 CNCCC1=NOC=N1 Z2889975619 [0,1,0,0,0,0|2,0,1]=4 211 B9R1.12 CNCCN1C=CN=N1 Z4525811502 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.12 CNCCN1C=NC=N1 Z1675167205 [0,1,0,0,0,0|1,0,1]=3 213 B9R1.12 CNCCN1C=NN=C1 Z994688662 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.12 COCCN1C=CN=C1 Z203976416 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.12 FCCCC1=NN=NN1 Z1000709 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.12 N#CCCC1=CC=CO1 Z1079179114 [0,1,0,0,0,0|2,0,1]=4 217 B9R1.12 N#CCCC1=CNC=N1 Z1795818466 [0,1,0,0,0,0|0,0,3]=4 218 B9R1.12 N#CCCN1C=CN=C1 Z53111124 [0,1,0,0,0,0|2,0,1]=4 219 B9R1.12 NCCCC1=CC=NN1 Z2895332060 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,1,0,0,0,0|0,0,2]=3 221 B9R1.12 NCCCC1=CNN=C1 Z2106603664 [0,1,0,0,0,0|2,0,0]=3 222 B9R1.12 NCCCC1=CNN=N1 Z3379992373 [0,1,0,0,0,0|1,0,2]=4 223 B9R1.12 NCCCC1=CON=C1 Z3022047352 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,1,0,0,0,0|2,0,1]=4 226 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,1,0,0,0,0|2,0,1]=4 227 B9R1.12 NCCCC1=NC=NO1 Z1429378655 [0,1,0,0,0,0|1,0,1]=3 228 B9R1.12 NCCCC1=NN=CS1 Z4327155967 [0,1,0,0,0,0|2,0,0]=3 229 B9R1.12 NCCCC1=NNN=N1 Z1407007328 [0,1,0,0,0,0|2,0,1]=4 230 B9R1.12 NCCCN1C=CC=C1 Z600497510 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,1,0,0,0,0|2,0,1]=4 232 B9R1.12 NCCCN1C=CN=N1 Z1649880105 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.12 NCCCN1C=NC=N1 Z2242062120 [0,1,0,0,0,0|1,0,1]=3 234 B9R1.12 NCCCN1C=NN=C1 Z2768235726 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.12 NCCCN1C=NN=N1 Z2867580878 [0,1,0,0,0,0|2,0,1]=4 236 B9R1.12 O=CCCC1=CON=C1 Z2238235999 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.12 O=CCCC1=CSC=C1 Z993017658 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.12 OCCCC1=CNC=N1 Z1142681983 [0,1,0,0,0,0|1,0,2]=4 239 B9R1.12 OCCCC1=CNN=C1 Z826006476 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.12 OCCCC1=COC=C1 Z1198265634 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.12 OCCCC1=CSC=C1 Z993012564 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.12 OCCCC1=CSC=N1 Z1270133079 [0,1,0,0,0,0|2,0,1]=4 243 B9R1.12 OCCCC1=NC=CN1 Z2771661063 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.12 OCCCC1=NC=NN1 Z5356836398 [0,1,0,0,0,0|2,0,1]=4 245 B9R1.12 OCCCN1C=CN=C1 Z425794726 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [0,1,0,0,0,0|2,0,0]=3 247 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [0,1,0,0,0,0|2,0,0]=3 249 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [0,1,0,0,0,0|2,0,0]=3 250 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [0,1,0,0,0,0|2,0,1]=4 251 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [0,1,0,0,0,0|2,0,0]=3 252 B9R1.13 CC(N)CN1C=NC=N1 Z271011738 [0,1,0,0,0,0|1,0,1]=3 253 B9R1.13 CC(N)CN1C=NN=C1 Z1154270076 [0,1,0,0,0,0|3,0,0]=4 254 B9R1.13 CC(O)CN1C=CN=C1 Z600458136 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.13 CN(C)CC1=CC=CN1 Z810541778 [0,1,0,0,0,0|3,0,0]=4 256 B9R1.13 N=C(N)CC1=CC=CS1 Z1526503402 [0,1,0,0,0,0|2,0,1]=4 257 B9R1.13 N=C(N)CN1C=CN=C1 Z3137550773 [0,1,0,0,0,0|2,0,1]=4 258 B9R1.13 N=C(N)CN1C=NC=N1 Z2574934980 [0,1,0,0,0,0|1,0,2]=4 259 B9R1.13 NC(=O)CC1=CC=CN1 Z1203579730 [0,1,0,0,0,0|1,0,1]=3 260 B9R1.13 O=C(O)CC1=CN=CN1 Z2738358143 [0,1,0,0,0,0|1,0,1]=3 261 B9R1.13 O=C(O)CC1=CN=CS1 Z1198176810 [0,1,0,0,0,0|2,0,1]=4 262 B9R1.13 O=C(O)CC1=NN=CN1 Z2372279646 [0,1,0,0,0,0|2,0,1]=4 263 B9R1.33 CC1=C(C=NO1)CCN Z2310699406 [0,1,0,0,0,0|2,0,0]=3 264 B9R1.33 CC1=C(N=CN1)CCN Z1682072469 [0,1,0,0,0,0|0,0,2]=3 265 B9R1.33 CC1=C(N=CO1)CCN Z4133751936 [0,1,0,0,0,0|1,0,1]=3 266 B9R1.33 CC1=C(NC=N1)CC#N Z1272670411 [0,1,0,0,0,0|0,0,2]=3 267 B9R1.33 CC1=C(SC=N1)CCCl Z945806150 [0,1,0,0,0,0|2,0,0]=3 268 B9R1.33 CC1=C(SC=N1)CCN Z945840330 [0,1,0,0,0,0|1,0,0]=2 269 B9R1.33 CC1=C(SC=N1)CCO Z104477768 [0,1,0,0,0,0|2,0,0]=3 270 B9R1.33 CC1=NC=CN1CCN Z271005730 [0,1,0,0,0,0|2,0,0]=3 271 B9R1.33 CC1=NC=CN1CCO Z425794744 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.33 CC1=NC=CN1CCS Z820771758 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.33 CC1=NN=CN1CCN Z1227766117 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.33 CC1=NNC=C1CCN Z4991178728 [0,1,0,0,0,0|2,0,0]=3 275 B9R1.33 CC1=NNN=C1CCN Z4526316913 [0,1,0,0,0,0|1,0,1]=3 276 B9R1.33 CCCC1=NON=C1N Z359374180 [0,1,0,0,0,0|2,0,1]=4 277 B9R1.33 CCCN1C=CN=C1S Z57043495 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.33 CCCN1NC=CC1=N Z1245633132 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.33 CN1C=CN=C1CCN Z2805865782 [0,1,0,0,0,0|2,0,0]=3 280 B9R1.33 CN1C=CN=C1CCO Z1183455332 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.33 CN1C=NC=C1CCN Z1198148027 [0,1,0,0,0,0|0,0,0]=1 282 B9R1.33 CN1C=NN=C1CCN Z1263820446 [0,1,0,0,0,0|1,0,0]=2 283 B9R1.33 CN1C=NN=C1CCO Z1688885881 [0,1,0,0,0,0|2,0,0]=3 284 B9R1.33 CN1N=CC=C1CCCl Z1824511155 [0,1,0,0,0,0|3,0,0]=4 285 B9R1.33 CN1N=CC=C1CCN Z1183446166 [0,1,0,0,0,0|2,0,0]=3 286 B9R1.33 CN1N=CC=C1CCO Z1183446153 [0,1,0,0,0,0|3,0,0]=4 287 B9R1.33 CN1N=CN=C1CCN Z1405445912 [0,1,0,0,0,0|1,0,1]=3 288 B9R1.33 CN1N=NC=C1CCN Z3997853416 [0,1,0,0,0,0|1,0,0]=2 289 B9R1.33 CNCC1=C(N=CS1)C Z385446916 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.33 CNCC1=CC=CN1C Z57778741 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.33 CNCC1=NN=CN1C Z954644184 [0,1,0,0,0,0|3,0,0]=4 292 B9R1.33 NCCC1=C(SC=C1)Cl Z4606142914 [0,1,0,0,0,0|2,0,0]=3 293 B9R1.33 NCCC1=CNN=C1O Z4623367325 [0,1,0,0,0,0|2,0,0]=3 294 B9R1.33 NCCN1C=CSC1=O Z1123714633 [0,1,0,0,0,0|3,0,0]=4 295 B7R0.7 CCNC(=O)CCN Z1449756826 [0,0,1,0,0,0|2,0,1]=4 296 B9R2.2 C1=CC(=CS1)C2CO2 Z954550900 [0,0,0,1,0,0|3,0,0]=4 297 B9R2.2 C1=NC=NN1C2CC2 Z5030705075 [0,0,0,1,0,0|2,0,1]=4 298 B9R2.2 C1=NN=C(N1)C2CC2 Z2130641619 [0,0,0,1,0,0|2,0,0]=3 299 B9R2.3 C1=CN2CCCC2=N1 Z1255492142 [0,0,0,1,0,0|3,0,0]=4 300 B9R2.3 C1=NC2=C(N1)CNC2 Z3244520038 [0,0,0,1,0,0|2,0,0]=3 301 B9R2.3 C1=NC2=C(S1)CNC2 Z4459994874 [0,0,0,1,0,0|3,0,0]=4 302 B9R2.3 C1=NN2CCNC2=C1 Z1203731545 [0,0,0,1,0,0|2,0,1]=4 303 B9R2.3 C1=NNC2=C1CCC2 Z1198165735 [0,0,0,1,0,0|3,0,0]=4 304 B9R2.3 C1CN2CCNC2=N1 Z3013893077 [0,0,0,1,0,0|2,0,1]=4 305 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,0,0,0,0,1|3,0,0]=4 306 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [0,0,0,0,0,1|2,0,1]=4 307 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [0,0,0,0,0,1|2,0,1]=4 308 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [0,0,0,0,0,1|3,0,0]=4 309 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [0,0,0,0,0,1|3,0,0]=4 310 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [0,0,0,0,0,1|3,0,0]=4 311 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [0,0,0,0,0,1|3,0,0]=4 312 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [0,0,0,0,0,1|3,0,0]=4 313 B9R1.8 CNCC1=NC=CN=C1 Z385447136 [0,0,0,0,0,1|2,0,1]=4 314 B9R1.8 CNCC1=NC=NC=C1 Z2871313713 [0,0,0,0,0,1|2,0,1]=4 315 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [0,0,0,0,0,1|3,0,0]=4 316 B9R1.8 N#CCC1=CN=CC=C1 Z239871646 [0,0,0,0,0,1|1,0,2]=4 317 B9R1.8 N#CCC1=NC=CN=C1 Z1098233793 [0,0,0,0,0,1|0,0,3]=4 318 B9R1.8 N#CCC1=NC=NC=C1 Z1098233919 [0,0,0,0,0,1|0,0,3]=4 319 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [0,0,0,0,0,1|1,0,0]=2 320 B9R1.8 NCCC1=CCOCC1 Z1511513665 [0,0,0,0,0,1|2,0,1]=4 321 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [0,0,0,0,0,1|1,0,0]=2 322 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [0,0,0,0,0,1|1,0,0]=2 323 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [0,0,0,0,0,1|1,0,1]=3 324 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [0,0,0,0,0,1|0,0,1]=2 325 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [0,0,0,0,0,1|0,0,1]=2 326 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [0,0,0,0,0,1|3,0,0]=4 327 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [0,0,0,0,0,1|2,0,0]=3 328 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [0,0,0,0,0,1|3,0,0]=4 329 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [0,0,0,0,0,1|3,0,0]=4 330 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,0,0,0,0,1|2,0,0]=3 331 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,0,0,0,0,1|2,0,1]=4 332 B9R1.8 OCCC1=NC=CN=C1 Z234895105 [0,0,0,0,0,1|1,0,1]=3 333 B9R1.8 OCCC1=NC=NC=C1 Z1250886882 [0,0,0,0,0,1|1,0,1]=3 334 B6R0.6 C=C/C=C/CCN Z2786180930 [1,0,1,0,0,0|1,0,0]=3 335 B6R0.6 C=CCCCCN Z1198160046 [1,0,1,0,0,0|1,0,1]=4 336 B6R0.6 C=CCOCCN Z976678988 [1,0,1,0,0,0|2,0,0]=4 337 B6R0.6 C=CCSCCN Z1262237162 [1,0,1,0,0,0|2,0,0]=4 338 B6R0.1 CNC(=O)CCN Z425449754 [1,0,1,0,0,0|1,0,1]=4 339 B6R1.2 CC1=CC=CN1 Z594218440 [2,0,0,0,0,0|1,0,0]=3 340 B6R1.2 CC1=CC=CO1 Z104472456 [2,0,0,0,0,0|2,0,0]=4 341 B6R1.2 CC1=CN=CN1 Z1945707502 [2,0,0,0,0,0|0,0,0]=2 342 B6R1.2 CC1=CN=CO1 Z1198180653 [2,0,0,0,0,0|1,0,0]=3 343 B6R1.2 CC1=CNC=C1 Z1203730789 [2,0,0,0,0,0|1,0,1]=4 344 B6R1.2 CC1=CNN=C1 Z600419582 [2,0,0,0,0,0|2,0,0]=4 345 B6R1.2 CC1=COC=N1 Z1198313432 [2,0,0,0,0,0|1,0,1]=4 346 B6R1.2 CC1=NC=CN1 Z104494990 [2,0,0,0,0,0|2,0,0]=4 347 B6R1.2 CN1C=CN=C1 Z104506032 [2,0,0,0,0,0|2,0,0]=4 348 B6R1.2 CN1C=NC=N1 Z237493308 [2,0,0,0,0,0|1,0,1]=4 349 B6R1.2 NC1=CC=NO1 Z415654518 [2,0,0,0,0,0|2,0,0]=4 350 B6R1.2 NC1=CC=NS1 Z2568737642 [2,0,0,0,0,0|2,0,0]=4 351 B6R1.2 NC1=CN=NS1 Z1116303505 [2,0,0,0,0,0|2,0,0]=4 352 B6R1.2 NC1=CNC=N1 Z3241270014 [2,0,0,0,0,0|0,0,2]=4 353 B6R1.2 NC1=CSC=C1 Z1962138158 [2,0,0,0,0,0|2,0,0]=4 354 B6R1.2 NC1=CSN=C1 Z2467685283 [2,0,0,0,0,0|2,0,0]=4 355 B6R1.2 NC1=NC=CN1 Z1262237195 [2,0,0,0,0,0|2,0,0]=4 356 B6R1.2 NC1=NC=NS1 Z1827897976 [2,0,0,0,0,0|1,0,1]=4 357 B6R1.2 NC1=NN=CN1 Z56866006 [2,0,0,0,0,0|1,0,0]=3 358 B6R1.2 NC1=NN=CO1 Z277559304 [2,0,0,0,0,0|2,0,0]=4 359 B6R1.2 NC1=NN=CS1 Z56899142 [2,0,0,0,0,0|2,0,0]=4 360 B6R1.2 NC1=NN=NN1 Z1250100717 [2,0,0,0,0,0|2,0,0]=4 361 B6R1.2 NC1=NON=C1 Z1203638167 [2,0,0,0,0,0|1,0,1]=4 362 B6R1.2 NC1=NSN=C1 Z2065788230 [2,0,0,0,0,0|1,0,1]=4 363 B8R1.1 CC1=CSC(=C1)CN Z2235810231 [1,1,0,0,0,0|2,0,0]=4 364 B8R1.1 CC1=NC(=CS1)CN Z54749838 [1,1,0,0,0,0|1,0,1]=4 365 B8R1.1 CC1=NC=C(S1)CO Z608610310 [1,1,0,0,0,0|2,0,0]=4 366 B8R1.1 CC1=NN=C(S1)CN Z1198280045 [1,1,0,0,0,0|2,0,0]=4 367 B8R1.1 CC1=NOC(=N1)CN Z802671508 [1,1,0,0,0,0|1,0,1]=4 368 B8R1.1 CCC1=CC(=CS1)Br Z1255374735 [1,1,0,0,0,0|2,0,0]=4 369 B8R1.1 CCC1=CC(=NN1)O Z1198163105 [1,1,0,0,0,0|2,0,0]=4 370 B8R1.1 CCC1=CN=C(O1)N Z994289172 [1,1,0,0,0,0|1,0,0]=3 371 B8R1.1 CCC1=CN=C(S1)N Z851799002 [1,1,0,0,0,0|1,0,0]=3 372 B8R1.1 CCC1=CNC(=O)N1 Z1198151065 [1,1,0,0,0,0|0,0,1]=3 373 B8R1.1 CCC1=CSC(=N1)Cl Z1037582854 [1,1,0,0,0,0|1,0,1]=4 374 B8R1.1 CCC1=CSC(=N1)N Z1263824431 [1,1,0,0,0,0|1,0,1]=4 375 B8R1.1 CCC1=CSC(=O)N1 Z916925862 [1,1,0,0,0,0|1,0,0]=3 376 B8R1.1 CCC1=NC(=NS1)N Z1203581808 [1,1,0,0,0,0|1,0,1]=4 377 B8R1.1 CCC1=NN=C(O1)N Z285233906 [1,1,0,0,0,0|2,0,0]=4 378 B8R1.1 CCC1=NN=C(S1)N Z57052870 [1,1,0,0,0,0|2,0,0]=4 379 B8R1.1 CCC1=NN=C(S1)S Z1198171110 [1,1,0,0,0,0|2,0,0]=4 380 B8R1.1 CCN1C=NC(=C1)N Z2313530831 [1,1,0,0,0,0|2,0,0]=4 381 B8R1.1 CCN1C=NC(=N1)N Z600615070 [1,1,0,0,0,0|1,0,1]=4 382 B8R1.1 CN1C=C(C=N1)CN Z317041916 [1,1,0,0,0,0|2,0,0]=4 383 B8R1.1 CN1N=CC(=N1)CN Z1203652613 [1,1,0,0,0,0|1,0,1]=4 384 B8R1.1 CSC1=NN=C(N1)N Z18356875 [1,1,0,0,0,0|2,0,0]=4 385 B8R1.1 NC1=NN=C(N1)CO Z600620424 [1,1,0,0,0,0|2,0,0]=4 386 B8R1.1 NCC1=CC(=CN1)Br Z1278621610 [1,1,0,0,0,0|1,0,0]=3 387 B8R1.1 NCC1=CC(=CS1)Br Z234895215 [1,1,0,0,0,0|2,0,0]=4 388 B8R1.1 NCC1=CC=C(S1)Br Z336481666 [1,1,0,0,0,0|2,0,0]=4 389 B8R1.1 NCC1=CC=C(S1)Cl Z426041582 [1,1,0,0,0,0|2,0,0]=4 390 B8R1.1 NCC1=CN=C(S1)Cl Z1741976615 [1,1,0,0,0,0|1,0,0]=3 391 B8R1.1 NCC1=CN=C(S1)N Z2989210641 [1,1,0,0,0,0|1,0,0]=3 392 B8R1.1 NCC1=CSC(=C1)Br Z234896703 [1,1,0,0,0,0|2,0,0]=4 393 B8R1.1 NCC1=CSC(=N1)N Z1263820281 [1,1,0,0,0,0|1,0,1]=4 394 B8R1.1 NCC1=CSC(=O)N1 Z1434233458 [1,1,0,0,0,0|1,0,0]=3 395 B8R1.1 NCC1=NC(=NN1)N Z1318356936 [1,1,0,0,0,0|1,0,1]=4 396 B8R1.1 NCC1=NN=C(O1)N Z1737940729 [1,1,0,0,0,0|2,0,0]=4 397 B8R1.1 NCC1=NN=C(O1)S Z1787355966 [1,1,0,0,0,0|2,0,0]=4 398 B8R1.1 NCC1=NN=C(S1)N Z3234882069 [1,1,0,0,0,0|2,0,0]=4 399 B8R1.1 NCC1=NN=C(S1)S Z4201725041 [1,1,0,0,0,0|2,0,0]=4 400 B8R1.7 CC(=O)C1=CC=CN1 Z56899162 [1,1,0,0,0,0|1,0,1]=4 401 B8R1.7 CC(=O)C1=CN=CO1 Z1255430875 [1,1,0,0,0,0|1,0,1]=4 402 B8R1.7 CC(C)C1=CC=CS1 Z1198727220 [1,1,0,0,0,0|2,0,0]=4 403 B8R1.7 CC(C)C1=CNN=C1 Z2418194166 [1,1,0,0,0,0|2,0,0]=4 404 B8R1.7 CC(C)C1=NC=CN1 Z335243296 [1,1,0,0,0,0|2,0,0]=4 405 B8R1.7 CC(C)C1=NN=CN1 Z2130643548 [1,1,0,0,0,0|1,0,0]=3 406 B8R1.7 CC(C)C1=NN=NN1 Z335291104 [1,1,0,0,0,0|2,0,0]=4 407 B8R1.7 CC(N)C1=CC=CN1 Z1198171808 [1,1,0,0,0,0|1,0,0]=3 408 B8R1.7 CC(N)C1=CC=CO1 Z89283368 [1,1,0,0,0,0|2,0,0]=4 409 B8R1.7 CC(N)C1=CC=CS1 Z119974474 [1,1,0,0,0,0|2,0,0]=4 410 B8R1.7 CC(N)C1=CC=NN1 Z362020428 [1,1,0,0,0,0|2,0,0]=4 411 B8R1.7 CC(N)C1=CC=NS1 Z2687575410 [1,1,0,0,0,0|2,0,0]=4 412 B8R1.7 CC(N)C1=CNC=N1 Z1198180341 [1,1,0,0,0,0|0,0,2]=4 413 B8R1.7 CC(N)C1=CNN=C1 Z4606013370 [1,1,0,0,0,0|2,0,0]=4 414 B8R1.7 CC(N)C1=COC=C1 Z1436472920 [1,1,0,0,0,0|2,0,0]=4 415 B8R1.7 CC(N)C1=COC=N1 Z3629373018 [1,1,0,0,0,0|1,0,1]=4 416 B8R1.7 CC(N)C1=CSC=C1 Z513796194 [1,1,0,0,0,0|2,0,0]=4 417 B8R1.7 CC(N)C1=CSN=C1 Z3486644530 [1,1,0,0,0,0|2,0,0]=4 418 B8R1.7 CC(N)C1=NN=CS1 Z4435730071 [1,1,0,0,0,0|2,0,0]=4 419 B8R1.7 CC(N)C1=NN=NN1 Z607822424 [1,1,0,0,0,0|2,0,0]=4 420 B8R1.7 CC(O)C1=CC=CS1 Z335245078 [1,1,0,0,0,0|2,0,0]=4 421 B8R1.7 CC(O)C1=CNC=N1 Z1198180340 [1,1,0,0,0,0|0,0,2]=4 422 B8R1.7 CC(O)C1=NC=CN1 Z4326395573 [1,1,0,0,0,0|2,0,0]=4 423 B8R1.7 CC(O)C1=NN=CN1 Z2587997232 [1,1,0,0,0,0|1,0,0]=3 424 B8R1.7 CC(O)C1=NN=NN1 Z1216833150 [1,1,0,0,0,0|2,0,0]=4 425 B8R1.7 CN(C)C1=NN=CN1 Z4969995706 [1,1,0,0,0,0|2,0,0]=4 426 B8R1.7 CS(=O)C1=NN=CN1 Z1123802519 [1,1,0,0,0,0|2,0,0]=4 427 B8R1.7 C[C@@H](N)C1=NC=CN1 Z2472857467 [1,1,0,0,0,0|2,0,0]=4 428 B8R1.7 C[C@@H](O)C1=CN=CS1 Z1217177234 [1,1,0,0,0,0|1,0,0]=3 429 B8R1.7 C[C@H](N)C1=CC=CO1 Z1407007556 [1,1,0,0,0,0|2,0,0]=4 430 B8R1.7 C[C@H](N)C1=NC=CN1 Z2205958486 [1,1,0,0,0,0|2,0,0]=4 431 B8R1.7 N=C(N)C1=CC=CN1 Z4929337487 [1,1,0,0,0,0|1,0,1]=4 432 B8R1.7 N=C(N)C1=CN=CS1 Z1889917212 [1,1,0,0,0,0|1,0,1]=4 433 B8R1.7 N=C(N)C1=NN=CN1 Z1688198391 [1,1,0,0,0,0|1,0,1]=4 434 B8R1.7 NC(=O)C1=CC=CN1 Z135897752 [1,1,0,0,0,0|1,0,1]=4 435 B8R1.7 NC(=O)C1=CN=CO1 Z1198164353 [1,1,0,0,0,0|1,0,1]=4 436 B8R1.7 NC(=O)C1=CN=CS1 Z741560256 [1,1,0,0,0,0|1,0,1]=4 437 B8R1.7 NC(=S)C1=NN=CN1 Z241091528 [1,1,0,0,0,0|1,0,1]=4 438 B8R1.7 O=C(O)C1=CN=CN1 Z993967082 [1,1,0,0,0,0|1,0,1]=4 439 B8R1.11 CC1=C(C=CO1)CN Z803145352 [1,1,0,0,0,0|2,0,0]=4 440 B8R1.11 CC1=C(C=CS1)CN Z3034293414 [1,1,0,0,0,0|2,0,0]=4 441 B8R1.11 CC1=C(C=NN1)CN Z1837077131 [1,1,0,0,0,0|2,0,0]=4 442 B8R1.11 CC1=C(C=NO1)CN Z2895200737 [1,1,0,0,0,0|2,0,0]=4 443 B8R1.11 CC1=C(N=CN1)CN Z1318147471 [1,1,0,0,0,0|0,0,2]=4 444 B8R1.11 CC1=C(N=CS1)CN Z317098554 [1,1,0,0,0,0|1,0,1]=4 445 B8R1.11 CC1=C(NC=N1)C=O Z2686040987 [1,1,0,0,0,0|1,0,1]=4 446 B8R1.11 CC1=C(NN=C1)CN Z2865543087 [1,1,0,0,0,0|2,0,0]=4 447 B8R1.11 CC1=C(OC=C1)CN Z291234200 [1,1,0,0,0,0|2,0,0]=4 448 B8R1.11 CC1=C(OC=N1)CN Z2939254026 [1,1,0,0,0,0|1,0,0]=3 449 B8R1.11 CC1=C(OC=N1)CO Z1198166472 [1,1,0,0,0,0|2,0,0]=4 450 B8R1.11 CC1=C(SC=C1)CN Z235352157 [1,1,0,0,0,0|2,0,0]=4 451 B8R1.11 CC1=C(SC=N1)CN Z291234254 [1,1,0,0,0,0|1,0,0]=3 452 B8R1.11 CC1=C(SC=N1)CO Z397587526 [1,1,0,0,0,0|2,0,0]=4 453 B8R1.11 CC1=COC=C1CN Z5616265876 [1,1,0,0,0,0|2,0,0]=4 454 B8R1.11 CC1=CSC=C1CN Z1345189827 [1,1,0,0,0,0|2,0,0]=4 455 B8R1.11 CC1=NON=C1CN Z1269638429 [1,1,0,0,0,0|1,0,1]=4 456 B8R1.11 CCC1=CNN=C1N Z1741979116 [1,1,0,0,0,0|2,0,0]=4 457 B8R1.11 CCC1=CSC=C1N Z4935394961 [1,1,0,0,0,0|2,0,0]=4 458 B8R1.11 CCC1=NN=CN1C Z992282430 [1,1,0,0,0,0|1,0,0]=3 459 B8R1.11 CCC1=NON=C1N Z359374178 [1,1,0,0,0,0|1,0,1]=4 460 B8R1.11 CCN1C=CN=C1N Z594268182 [1,1,0,0,0,0|2,0,0]=4 461 B8R1.11 CCN1C=CN=C1S Z220434788 [1,1,0,0,0,0|2,0,0]=4 462 B8R1.11 CN1C=CC=C1CN Z362827744 [1,1,0,0,0,0|1,0,0]=3 463 B8R1.11 CN1C=CN=C1CN Z235536854 [1,1,0,0,0,0|2,0,0]=4 464 B8R1.11 CN1C=NC=C1C#N Z1201623260 [1,1,0,0,0,0|0,0,2]=4 465 B8R1.11 CN1C=NC=C1C=O Z1065768466 [1,1,0,0,0,0|1,0,1]=4 466 B8R1.11 CN1C=NC=C1CN Z1198266141 [1,1,0,0,0,0|0,0,0]=2 467 B8R1.11 CN1C=NC=C1CO Z1115775402 [1,1,0,0,0,0|1,0,0]=3 468 B8R1.11 CN1C=NN=C1CN Z317027588 [1,1,0,0,0,0|1,0,0]=3 469 B8R1.11 CN1C=NN=C1NN Z56792015 [1,1,0,0,0,0|2,0,0]=4 470 B8R1.11 CN1N=CC=C1CN Z316122740 [1,1,0,0,0,0|2,0,0]=4 471 B8R1.11 CN1N=NC=C1CN Z2111525634 [1,1,0,0,0,0|1,0,0]=3 472 B8R1.11 CN1N=NC=C1CO Z1251355468 [1,1,0,0,0,0|2,0,0]=4 473 B8R1.11 NCC1=C(C=CS1)Cl Z3244521023 [1,1,0,0,0,0|2,0,0]=4 474 B8R1.11 NCC1=C(C=NN1)Br Z1263824426 [1,1,0,0,0,0|2,0,0]=4 475 B8R1.11 NCC1=C(SC=C1)Cl Z4459561724 [1,1,0,0,0,0|2,0,0]=4 476 B8R1.11 NCC1=C(SC=C1)I Z4912253513 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [0,1,0,0,0,1|2,0,0]=4 478 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [0,1,0,0,0,1|1,0,0]=3 479 B10R1.1 CC1=NC=C(N=C1)CCO Z1504684184 [0,1,0,0,0,1|1,0,1]=4 480 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [0,1,0,0,0,1|2,0,0]=4 481 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [0,1,0,0,0,1|2,0,0]=4 482 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [0,1,0,0,0,1|2,0,0]=4 483 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [0,1,0,0,0,1|2,0,0]=4 484 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [0,1,0,0,0,1|2,0,0]=4 485 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [0,1,0,0,0,1|1,0,0]=3 486 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [0,1,0,0,0,1|0,0,1]=3 487 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [0,1,0,0,0,1|1,0,1]=4 488 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [0,1,0,0,0,1|1,0,1]=4 489 B10R1.1 NCCC1=NC=C(C=N1)Br Z4752114140 [0,1,0,0,0,1|1,0,1]=4 490 B10R1.1 O=C1N=CC(=CN1)CCO Z2096659590 [0,1,0,0,0,1|1,0,0]=3 491 B10R1.4 CC1=C(C=NC=C1)CCN Z1198264124 [0,1,0,0,0,1|1,0,0]=3 492 B10R1.4 CC1=C(N=CC=C1)CCN Z1098234132 [0,1,0,0,0,1|1,0,1]=4 493 B10R1.4 CC1=C(N=CC=N1)CCO Z1198163945 [0,1,0,0,0,1|1,0,1]=4 494 B10R1.4 CCCC1=C(N=CC=N1)Cl Z1504680268 [0,1,0,0,0,1|1,0,1]=4 495 B10R1.4 ClCCC1=C(N=CN=C1)Cl Z1262489672 [0,1,0,0,0,1|1,0,1]=4 496 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [0,1,0,0,0,1|2,0,0]=4 497 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [0,1,0,0,0,1|2,0,0]=4 498 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [0,1,0,0,0,1|2,0,0]=4 499 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [0,1,0,0,0,1|2,0,0]=4 500 B10R1.4 NCCC1=C(N=CC=C1)O Z5862214540 [0,1,0,0,0,1|1,0,0]=3 501 B10R1.4 NCCN1C=CC=NC1=O Z3038857671 [0,1,0,0,0,1|2,0,0]=4 502 B10R1.4 NCCN1C=NC=CC1=O Z2379084242 [0,1,0,0,0,1|2,0,0]=4 503 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [0,1,0,0,0,1|2,0,0]=4 504 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [0,1,0,0,0,1|1,0,1]=4 505 B10R1.10 CCCC1=CC(=NN=C1)Cl Z4580564381 [0,1,0,0,0,1|2,0,0]=4 506 B10R1.10 CCCC1=CC(=NN=C1)N Z4580562529 [0,1,0,0,0,1|2,0,0]=4 507 B10R1.10 CCCC1=CC(=O)NN=C1 Z1198341234 [0,1,0,0,0,1|2,0,0]=4 508 B10R1.10 NC1=NC=CC(=C1)CCO Z1197888440 [0,1,0,0,0,1|2,0,0]=4 509 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [0,1,0,0,0,1|2,0,0]=4 510 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [0,1,0,0,0,1|2,0,0]=4 511 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [0,1,0,0,0,1|2,0,0]=4 512 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [0,1,0,0,0,1|2,0,0]=4 513 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [0,1,0,0,0,1|2,0,0]=4 514 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [0,1,0,0,0,1|1,0,0]=3 515 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [0,1,0,0,0,1|1,0,0]=3 516 B10R1.10 NCCC1=NC(=NC=C1)N Z5619121124 [0,1,0,0,0,1|0,0,1]=3 517 B10R1.10 NCCC1=NC=NC(=C1)Br Z4513781102 [0,1,0,0,0,1|0,0,1]=3 518 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [0,1,0,0,0,1|0,0,1]=3 519 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [0,1,0,0,0,1|1,0,0]=3 520 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [0,1,0,0,0,1|2,0,0]=4 521 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [0,1,0,0,0,1|2,0,0]=4 522 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [0,1,0,0,0,1|2,0,0]=4 523 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [0,1,0,0,0,1|2,0,0]=4 524 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [0,1,0,0,0,1|1,0,1]=4 525 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [0,1,0,0,0,1|2,0,0]=4 526 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [0,1,0,0,0,1|2,0,0]=4 527 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [0,1,0,0,0,1|1,0,0]=3 528 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [0,1,0,0,0,1|1,0,1]=4 529 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [0,1,0,0,0,1|2,0,0]=4 530 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,1,0,0,0,1|2,0,0]=4 531 B10R1.17 CCCOC1=NC=CN=C1 Z2182020100 [0,1,0,0,0,1|1,0,1]=4 532 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [0,1,0,0,0,1|2,0,0]=4 533 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [0,1,0,0,0,1|2,0,0]=4 534 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [0,1,0,0,0,1|1,0,0]=3 535 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,1,0,0,0,1|1,0,0]=3 536 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,1,0,0,0,1|1,0,1]=4 537 B10R1.17 CNCCC1=NC=CC=N1 Z3023337072 [0,1,0,0,0,1|1,0,1]=4 538 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,1,0,0,0,1|1,0,1]=4 539 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [0,1,0,0,0,1|2,0,0]=4 540 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,1,0,0,0,1|1,0,0]=3 541 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [0,1,0,0,0,1|1,0,0]=3 542 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,1,0,0,0,1|1,0,1]=4 543 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,1,0,0,0,1|0,0,1]=3 544 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [0,1,0,0,0,1|1,0,0]=3 545 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,1,0,0,0,1|1,0,1]=4 546 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,1,0,0,0,1|1,0,1]=4 547 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,1,0,0,0,1|1,0,1]=4 548 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,1,0,0,0,1|2,0,0]=4 549 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [0,1,0,0,0,1|1,0,0]=3 550 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,1,0,0,0,1|1,0,0]=3 551 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,1,0,0,0,1|1,0,1]=4 552 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [0,1,0,0,0,1|2,0,0]=4 553 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [0,1,0,0,0,1|2,0,0]=4 554 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [0,1,0,0,0,1|2,0,0]=4 555 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [0,1,0,0,0,1|2,0,0]=4 556 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [0,1,0,0,0,1|2,0,0]=4 557 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,1,0,0,0,1|2,0,0]=4 558 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,1,0,0,0,1|1,0,1]=4 559 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [0,1,0,0,0,1|2,0,0]=4 560 B10R1.17 OCCNC1=NC=CN=C1 Z31212301 [0,1,0,0,0,1|1,0,1]=4 561 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,1,0,0,0,1|2,0,0]=4 562 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,1,0,0,0,1|1,0,0]=3 563 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [0,1,0,0,0,1|2,0,0]=4 564 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [0,1,0,0,0,1|1,0,1]=4 565 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,1,0,0,0,1|1,0,1]=4 566 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [0,1,0,0,0,1|1,0,1]=4 567 B10R1.18 NC(=O)CC1=CN=CN=C1 Z1203583458 [0,1,0,0,0,1|0,0,2]=4 568 B10R1.14 CC1=CC=C(O1)C(O)CN Z363991860 [0,2,0,0,0,0|2,0,0]=4 569 B10R1.14 CN1C=C(C=N1)C(N)CN Z425860954 [0,2,0,0,0,0|2,0,0]=4 570 B10R1.14 CN1C=C(C=N1)C(O)CN Z336086446 [0,2,0,0,0,0|2,0,0]=4 571 B10R1.14 NCC(O)C1=CC=C(S1)Cl Z838891514 [0,2,0,0,0,0|2,0,0]=4 572 B10R1.16 CC1=NN=C(S1)CCCN Z3069856930 [0,2,0,0,0,0|2,0,0]=4 573 B10R1.16 CC1=NOC(=C1)CCCN Z4499620658 [0,2,0,0,0,0|2,0,0]=4 574 B10R1.16 CN1C=C(C=N1)CCCN Z851015102 [0,2,0,0,0,0|2,0,0]=4 575 B10R1.16 CN1C=NC(=C1)CCCN Z4510431269 [0,2,0,0,0,0|0,0,2]=4 576 B10R1.16 COCCC1=CN=C(S1)N Z3016043308 [0,2,0,0,0,0|2,0,0]=4 577 B10R1.16 NC1=NN=C(N1)CCCO Z56903990 [0,2,0,0,0,0|2,0,0]=4 578 B10R1.16 NC1=NN=C(N1)NCCO Z1270636167 [0,2,0,0,0,0|2,0,0]=4 579 B10R1.16 NCCCC1=CC(=NO1)O Z3214695832 [0,2,0,0,0,0|2,0,0]=4 580 B10R1.16 NCCCC1=NN=C(N1)N Z1333873225 [0,2,0,0,0,0|1,0,0]=3 581 B10R1.16 NCCCC1=NN=C(S1)N Z3234882071 [0,2,0,0,0,0|2,0,0]=4 582 B10R1.54 CC(C)CC1=CN=C(S1)N Z1171158145 [0,2,0,0,0,0|2,0,0]=4 583 B10R1.54 CC1=CC=C(S1)CC(C)N Z381678020 [0,2,0,0,0,0|2,0,0]=4 584 B10R1.54 CC1=NN=C(N1)CC(C)C Z927196228 [0,2,0,0,0,0|2,0,0]=4 585 B10R1.54 CC1=NNC(=C1)CC(C)N Z1446874472 [0,2,0,0,0,0|2,0,0]=4 586 B10R1.94 CC1=C(C=NN1C)CCN Z1198178790 [0,2,0,0,0,0|2,0,0]=4 587 B10R1.94 CC1=C(N(C=N1)CCN)C Z3247610126 [0,2,0,0,0,0|2,0,0]=4 588 B10R1.94 CC1=NN=C(N1C)CCN Z1824482726 [0,2,0,0,0,0|1,0,0]=3 589 B10R1.94 CN1C(=NN=C1CCN)S Z1117882788 [0,2,0,0,0,0|1,0,0]=3 590 B10R1.94 CN1C(=NN=C1CCO)S Z1696860089 [0,2,0,0,0,0|2,0,0]=4 591 B10R1.96 CCC1=NC(=CS1)CCN Z905065786 [0,2,0,0,0,0|1,0,1]=4 592 B10R1.96 N#CC1=NN(C=N1)CCN Z2065464237 [0,2,0,0,0,0|1,0,1]=4 593 B10R1.96 NCCC1=NN=C(S1)CO Z4309361859 [0,2,0,0,0,0|2,0,0]=4 594 B10R1.130 CC1=C(SC(=N1)N)CCN Z2967324772 [0,2,0,0,0,0|1,0,0]=3 595 B10R1.130 CC1=CC(=C(S1)C)CCN Z825743066 [0,2,0,0,0,0|2,0,0]=4 596 B10R1.130 CC1=NC(=C(S1)CCN)C Z1148766061 [0,2,0,0,0,0|1,0,0]=3 597 B10R1.130 CC1=NN(C=C1CCN)C Z1198178791 [0,2,0,0,0,0|2,0,0]=4 598 B10R1.6 CC(C)(CN)C1=CC=CS1 Z992250152 [0,2,0,0,0,0|2,0,0]=4 599 B10R1.6 CC(C)(CN)C1=CN=CN1 Z4573427554 [0,2,0,0,0,0|0,0,0]=2 600 B10R1.6 CC(C)(CN)C1=CSC=C1 Z4658970174 [0,2,0,0,0,0|2,0,0]=4 601 B10R1.6 CC(C)(CN)N1C=CN=C1 Z2528321728 [0,2,0,0,0,0|2,0,0]=4 602 B10R1.6 CC(O)(CN)C1=CC=CO1 Z1258863696 [0,2,0,0,0,0|2,0,0]=4 603 B10R1.6 CC(O)(CN)C1=CC=CS1 Z1198237242 [0,2,0,0,0,0|2,0,0]=4 604 B10R1.6 CC(O)(CN)C1=CSC=C1 Z1250080853 [0,2,0,0,0,0|2,0,0]=4 605 B10R1.11 CNCC(C)C1=NN=NN1 Z1665033417 [0,2,0,0,0,0|2,0,0]=4 606 B10R1.11 NC(CCO)C1=CN=CS1 Z2895171388 [0,2,0,0,0,0|2,0,0]=4 607 B10R1.23 CC(N)C(C)N1C=NC=N1 Z803066294 [0,2,0,0,0,0|1,0,1]=4 608 B10R1.149 CC(CN)C1=NN=CN1C Z1795818496 [0,2,0,0,0,0|1,0,0]=3 609 B10R1.149 CCC(=O)C1=CN=CN1C Z1216833829 [0,2,0,0,0,0|1,0,1]=4 610 B10R1.149 CN1C=CC=C1C(O)CN Z363990702 [0,2,0,0,0,0|1,0,0]=3 611 B10R1.149 CN1C=NC=C1C(N)CO Z2527586590 [0,2,0,0,0,0|1,0,0]=3 612 B10R1.21 CCNCCC1=CC=CS1 Z162417018 [0,2,0,0,0,0|2,0,0]=4 613 B10R1.21 CNCCCN1C=CN=C1 Z138029274 [0,2,0,0,0,0|2,0,0]=4 614 B10R1.21 NCCCCC1=CNN=C1 Z1203591855 [0,2,0,0,0,0|2,0,0]=4 615 B10R1.21 NCCCCN1C=CN=C1 Z285163712 [0,2,0,0,0,0|2,0,0]=4 616 B10R1.21 NCCSCC1=CSC=C1 Z111412082 [0,2,0,0,0,0|2,0,0]=4 617 B10R1.27 CC(CN)CC1=CC=CS1 Z992308868 [0,2,0,0,0,0|2,0,0]=4 618 B10R1.27 CC(CN)CN1C=CN=C1 Z445226240 [0,2,0,0,0,0|2,0,0]=4 619 B10R1.27 CNC(C)CC1=CNN=C1 Z5095434431 [0,2,0,0,0,0|2,0,0]=4 620 B10R1.27 CNC(C)CC1=CSC=C1 Z1333043374 [0,2,0,0,0,0|2,0,0]=4 621 B10R1.27 NC(CO)CC1=CN=CS1 Z2731749295 [0,2,0,0,0,0|1,0,0]=3 622 B10R1.27 N[C@H](CO)CC1=CNC=N1 Z2697164739 [0,2,0,0,0,0|0,0,2]=4 623 B10R1.29 CC1=C(C=NN1)CCCN Z271128608 [0,2,0,0,0,0|2,0,0]=4 624 B10R1.29 CC1=C(SC=N1)CCCN Z945859360 [0,2,0,0,0,0|1,0,0]=3 625 B10R1.29 CC1=CN=CN1CCCN Z1511514269 [0,2,0,0,0,0|2,0,0]=4 626 B10R1.29 CC1=NC=CN1CCCN Z271005732 [0,2,0,0,0,0|2,0,0]=4 627 B10R1.29 CC1=NNN=C1CCCN Z4368602815 [0,2,0,0,0,0|1,0,1]=4 628 B10R1.29 CCCSC1=NN=CN1C Z19813861 [0,2,0,0,0,0|2,0,0]=4 629 B10R1.29 CCNCC1=C(N=CS1)C Z3325546594 [0,2,0,0,0,0|2,0,0]=4 630 B10R1.29 CN1C=NC=C1CCCO Z1198265551 [0,2,0,0,0,0|1,0,0]=3 631 B10R1.29 CN1C=NN=C1CCCN Z2186882371 [0,2,0,0,0,0|1,0,0]=3 632 B10R1.29 CN1C=NN=C1SCCO Z71256462 [0,2,0,0,0,0|2,0,0]=4 633 B10R1.29 CN1N=CC=C1CCCN Z3702582641 [0,2,0,0,0,0|2,0,0]=4 634 B10R1.29 CN1N=CN=C1CCCN Z2405063799 [0,2,0,0,0,0|1,0,1]=4 635 B10R1.29 CN1N=NN=C1SCCN Z56968240 [0,2,0,0,0,0|2,0,0]=4 636 B10R1.29 CNCCN1C=CN=C1C Z4606140444 [0,2,0,0,0,0|2,0,0]=4 637 B10R1.66 CC(C)NCC1=CN=CS1 Z3243815927 [0,2,0,0,0,0|2,0,0]=4 638 B10R1.66 CC(N)CCC1=CNN=C1 Z5355227297 [0,2,0,0,0,0|2,0,0]=4 639 B10R1.66 CC(N)CCN1C=NC=N1 Z361881098 [0,2,0,0,0,0|1,0,1]=4 640 B10R1.66 N=C(N)CCN1C=CN=C1 Z839522528 [0,2,0,0,0,0|2,0,0]=4 641 B10R1.66 N=C(N)CCN1C=NC=N1 Z969560750 [0,2,0,0,0,0|1,0,1]=4 642 B10R1.66 O=C(O)CCC1=CN=CO1 Z1255388483 [0,2,0,0,0,0|2,0,0]=4 643 B10R1.66 O=C(O)CCC1=NN=CN1 Z1350606441 [0,2,0,0,0,0|2,0,0]=4 644 B10R1.64 CC(N)CC1=NN=CN1C Z5090447814 [0,2,0,0,0,0|1,0,0]=3 645 B10R1.64 CN1C=NC=C1CC(=O)O Z1741785912 [0,2,0,0,0,0|1,0,1]=4 646 B10R1.5 CCC1=NC=CN1CCN Z2855994812 [0,2,0,0,0,0|2,0,0]=4 647 B10R1.5 CCN1C=NN=C1CCN Z1266823174 [0,2,0,0,0,0|1,0,0]=3 648 B10R1.187 CC1=NNC(=C1CCN)C Z2106606067 [0,2,0,0,0,0|2,0,0]=4 649 B10R1.187 CC1=NOC(=C1CCN)C Z803080836 [0,2,0,0,0,0|2,0,0]=4 650 B8R1.2 NCC1=CC=NC=C1 Z104474354 [0,0,1,1,0,0|1,0,1]=4 651 B8R1.2 NCC1=CN=CC=C1 Z104474366 [0,0,1,1,0,0|1,0,1]=4 652 B8R1.2 NCC1=CN=CN=C1 Z3244401628 [0,0,1,1,0,0|0,0,2]=4 653 B8R1.2 NCC1=NC=NC=C1 Z254526552 [0,0,1,1,0,0|0,0,2]=4 654 B8R1.5 NC1=C(N=CC=C1)N Z385438806 [0,0,1,1,0,0|0,0,2]=4 655 B8R1.5 NC1=C(N=CC=N1)N Z1198174211 [0,0,1,1,0,0|1,0,1]=4 656 B8R1.4 NC1=CN=CC(=C1)N Z3158827045 [0,0,1,1,0,0|0,0,2]=4 657 B8R1.4 O=C1CCNC(=O)N1 Z57033885 [0,0,1,1,0,0|2,0,0]=4 658 B8R1.18 NC1CC(=O)NC1=O Z2901974060 [0,0,1,1,0,0|2,0,0]=4 659 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [0,0,0,1,0,1|2,0,0]=4 660 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [0,0,0,1,0,1|2,0,0]=4 661 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [0,0,0,1,0,1|2,0,0]=4 662 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [0,0,0,1,0,1|2,0,0]=4 663 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [0,0,0,1,0,1|1,0,0]=3 664 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [0,0,0,1,0,1|2,0,0]=4 665 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [0,0,0,1,0,1|1,0,0]=3 666 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [0,0,0,1,0,1|1,0,1]=4 667 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [0,0,0,1,0,1|1,0,0]=3 668 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [0,0,0,1,0,1|2,0,0]=4 669 B10R2.2 CC1=NC2=C(S1)CCC2 Z1255451464 [0,1,0,1,0,0|2,0,0]=4 670 B10R2.2 ClC1=NC2=C(S1)CCC2 Z1037582666 [0,1,0,1,0,0|2,0,0]=4 671 B10R2.2 NC1CC2=CSC=C2C1 Z3661455884 [0,1,0,1,0,0|2,0,0]=4 672 B10R2.2 NC1CC2=NC=CN2C1 Z1416167525 [0,1,0,1,0,0|2,0,0]=4 673 B10R2.14 CC1=NN=C(N1)C2CC2 Z927193238 [0,1,0,1,0,0|2,0,0]=4 674 B10R2.14 NC1=NC=C(O1)C2CC2 Z4091739325 [0,1,0,1,0,0|2,0,0]=4 675 B10R2.14 NC1=NC=C(S1)C2CC2 Z992239694 [0,1,0,1,0,0|2,0,0]=4 676 B10R2.14 NC1=NN=C(N1)C2CC2 Z802556338 [0,1,0,1,0,0|2,0,0]=4 677 B10R2.32 NC1=NC=C2N1CCC2 Z1203653058 [0,1,0,1,0,0|1,0,0]=3 678 B10R2.32 NC1CCN2C1=NC=C2 Z1216842580 [0,1,0,1,0,0|2,0,0]=4 679 B10R2.32 SC1=NC=C2N1CCC2 Z3490723931 [0,1,0,1,0,0|1,0,0]=3 680 B10R2.5 N[C@@H]1C[C@H]1C2=CNC=N2 Z2798782647 [0,1,0,1,0,0|0,0,2]=4 681 B10R2.5 N[C@@H]1C[C@H]1C2=CSC=C2 Z2683264163 [0,1,0,1,0,0|2,0,0]=4 682 B10R2.16 NC1(CC1)C2=NN=CN2 Z3770977958 [0,1,0,1,0,0|2,0,0]=4 683 B10R2.136 C1=CN(C=N1)C2CNC2 Z1267881732 [0,1,0,1,0,0|2,0,0]=4 684 B10R2.136 C1=CNC(=N1)C2CNC2 Z2867705708 [0,1,0,1,0,0|2,0,0]=4 685 B10R2.136 C1=NC=NN1C2CNC2 Z1197994833 [0,1,0,1,0,0|1,0,1]=4 686 B10R2.21 CN1C=NN=C1C2CC2 Z992282428 [0,1,0,1,0,0|2,0,0]=4 687 B10R2.21 NC1=C(SC=N1)C2CC2 Z2755109162 [0,1,0,1,0,0|2,0,0]=4