0 B13R1.575 CNCCC1=CC(=C(C=C1)O)OC Z4437707719 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.286 C/C=C/C1=CC(=C(C=C1)O)OC Z57953030 [1,0,0,0,0,0|0,0,0]=1 2 B12R1.286 C=CCC1=CC(=C(C=C1)O)OC Z56347226 [1,0,0,0,0,0|0,0,2]=3 3 B12R1.286 CNCC1=CC(=C(C=C1)O)OC Z425387552 [1,0,0,0,0,0|1,0,1]=3 4 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [1,0,0,0,0,0|2,0,1]=4 5 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [1,0,0,0,0,0|1,0,1]=3 6 B12R1.382 COC1=CC(=CC=C1)C#CCO Z539904058 [1,0,0,0,0,0|0,0,2]=3 7 B12R1.382 COC1=CC(=CC=C1)CCCN Z1262398467 [1,0,0,0,0,0|1,0,2]=4 8 B12R1.382 COC1=CC(=CC=C1)CCCO Z993012490 [1,0,0,0,0,0|0,0,2]=3 9 B12R1.382 COC1=CC(=CC=C1)OCCN Z335452802 [1,0,0,0,0,0|2,0,1]=4 10 B12R1.385 CC1=C(C=C(C=C1)SCCO)C Z149235456 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.385 CC1=C(C=CC(=C1)OCCO)N Z335092234 [1,0,0,0,0,0|2,0,1]=4 12 B12R1.385 CCCCC1=CC(=C(C=C1)O)C Z1416171318 [1,0,0,0,0,0|1,0,2]=4 13 B12R1.385 OC/C=C/C1=CC(=C(C=C1)Cl)Cl Z1269240197 [1,0,0,0,0,0|2,0,0]=3 14 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)O)F Z1201621929 [0,1,0,0,0,0|1,0,1]=3 15 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)O)O Z56782558 [0,1,0,0,0,0|0,0,1]=2 16 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(C)O)O Z1513917280 [0,1,0,0,0,0|0,0,0]=1 17 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O Z317038020 [0,1,0,0,0,0|0,0,3]=4 18 B14R1.42 COC1=C(C=CC(=C1)CCC(C)N)O Z3324923673 [0,1,0,0,0,0|1,0,2]=4 19 B14R1.42 O=CC1=C(C=CC(=C1)/C=C/C(=O)O)O Z1198181572 [0,1,0,0,0,0|2,0,1]=4 20 B14R1.791 CCNCC1=CC(=C(C=C1)O)OCC Z425449648 [0,1,0,0,0,0|2,0,1]=4 21 B14R1.793 CCNCC1=CC(=C(C=C1)OC)OC Z89283372 [0,1,0,0,0,0|2,0,1]=4 22 B14R1.793 COC1=C(C=C(C=C1)/C=C/C=O)OC Z1251353086 [0,1,0,0,0,0|0,0,2]=3 23 B14R1.793 COC1=C(C=C(C=C1)CCCN)OC Z336080030 [0,1,0,0,0,0|1,0,2]=4 24 B14R1.793 COC1=C(C=C(C=C1)SCCO)OC Z1251388824 [0,1,0,0,0,0|1,0,1]=3 25 B14R1.907 COC1=C(C=CC(=C1)/C=N/NC=O)O Z49645575 [0,1,0,0,0,0|1,0,2]=4 26 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)OC Z1198150768 [0,1,0,0,0,0|2,0,1]=4 27 B14R1.3405 COC1=C(C=CC(=C1)CC(=O)CO)O Z1513806392 [0,1,0,0,0,0|0,0,1]=2 28 B14R1.3405 COC1=C(C=CC(=C1)NC(=O)CO)F Z1768428644 [0,1,0,0,0,0|2,0,0]=3 29 B14R2.203 COC1=C2C=CC=CC2=CC=C1O Z2235409306 [0,0,0,1,0,0|1,0,1]=3 30 B14R2.203 COC1=C2N=CC=CC2=CC=C1Cl Z1620255158 [0,0,0,1,0,0|2,0,1]=4 31 B14R2.991 CCNCC1=CC2=C(C=C1)OCO2 Z57327177 [0,0,0,1,0,0|2,0,1]=4 32 B14R2.991 NCCOC1=CC2=C(C=C1)OCO2 Z426041488 [0,0,0,1,0,0|2,0,1]=4 33 B14R2.991 O=C/C=C/C1=CC2=C(C=C1)OCO2 Z1251353395 [0,0,0,1,0,0|0,0,2]=3 34 B14R2.1128 COC1=C(C=C2C=NC=CC2=C1)Br Z1862017680 [0,0,0,1,0,0|3,0,0]=4 35 B14R2.1128 COC1=C(C=C2C=NC=CC2=C1)O Z381390846 [0,0,0,1,0,0|2,0,0]=3 36 B14R2.1128 COC1=C(C=C2CCCCC2=C1)O Z3241899355 [0,0,0,1,0,0|1,0,2]=4 37 B14R2.1128 COC1=C(C=C2N=CC=CC2=C1)F Z1258977719 [0,0,0,1,0,0|2,0,1]=4 38 B11R1.189 CCNC1=CC(=CC=C1)OC Z286367386 [2,0,0,0,0,0|1,0,1]=4 39 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [2,0,0,0,0,0|1,0,1]=4 41 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [2,0,0,0,0,0|1,0,1]=4 42 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [2,0,0,0,0,0|1,0,1]=4 43 B11R1.280 CCC1=CC(=C(C=C1)O)OC Z57234301 [2,0,0,0,0,0|0,0,1]=3 44 B11R1.280 CNC1=CC(=C(C=C1)C)OC Z5981152945 [2,0,0,0,0,0|2,0,0]=4 45 B11R1.280 COC1=C(C=CC(=C1)C#N)O Z56963393 [2,0,0,0,0,0|1,0,1]=4 46 B11R1.280 COC1=C(C=CC(=C1)C=O)C Z1079442616 [2,0,0,0,0,0|1,0,1]=4 47 B11R1.280 COC1=C(C=CC(=C1)C=O)Cl Z1198175109 [2,0,0,0,0,0|1,0,1]=4 48 B11R1.280 COC1=C(C=CC(=C1)C=O)F Z1203161973 [2,0,0,0,0,0|1,0,1]=4 49 B11R1.280 COC1=C(C=CC(=C1)C=O)O Z57772449 [2,0,0,0,0,0|0,0,1]=3 50 B11R1.280 COC1=C(C=CC(=C1)C=O)S Z835750876 [2,0,0,0,0,0|0,1,1]=4 51 B11R1.280 COC1=C(C=CC(=C1)CN)C Z812517018 [2,0,0,0,0,0|2,0,0]=4 52 B11R1.280 COC1=C(C=CC(=C1)CN)F Z3235016255 [2,0,0,0,0,0|2,0,0]=4 53 B11R1.280 COC1=C(C=CC(=C1)CN)N Z3223855819 [2,0,0,0,0,0|2,0,0]=4 54 B11R1.280 COC1=C(C=CC(=C1)CN)O Z381785798 [2,0,0,0,0,0|1,0,0]=3 55 B11R1.280 COC1=C(C=CC(=C1)CO)C Z397587200 [2,0,0,0,0,0|1,0,0]=3 56 B11R1.280 COC1=C(C=CC(=C1)CO)Cl Z1255366940 [2,0,0,0,0,0|1,0,0]=3 57 B11R1.280 COC1=C(C=CC(=C1)CO)F Z1201620066 [2,0,0,0,0,0|1,0,0]=3 58 B11R1.280 COC1=C(C=CC(=C1)CO)O Z56347244 [2,0,0,0,0,0|0,0,0]=2 59 B11R1.280 COC1=C(C=CC(=C1)SC)N Z1147225829 [2,0,0,0,0,0|2,0,0]=4 60 B11R1.280 COC1=CC(=C(C=C1)Br)OC Z299596224 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.280 COC1=CC(=C(C=C1)N)OC Z104478344 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.280 CSC1=C(C=CC(=C1)C=O)O Z1255433772 [2,0,0,0,0,0|0,1,1]=4 63 B11R1.280 O=CC1=C(C=CC(=C1)CO)O Z1198153315 [2,0,0,0,0,0|2,0,0]=4 64 B11R1.280 OCC1=CC(=C(C=C1)O)CO Z1198151167 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [2,0,0,0,0,0|0,0,2]=4 66 B11R1.24 OC/C=C/C1=CC(=CN=C1)Br Z1703199250 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.1 OC/C=C/C1=CC=C(C=C1)O Z2235811101 [2,0,0,0,0,0|0,0,0]=2 69 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [2,0,0,0,0,0|1,0,1]=4 70 B13R1.49 CNC(=O)C1=CC(=C(C=C1)C)OC Z135505592 [1,1,0,0,0,0|2,0,0]=4 71 B13R1.49 CNC(=O)C1=CC(=C(C=C1)N)OC Z1126164960 [1,1,0,0,0,0|2,0,0]=4 72 B13R1.49 COC(=O)C1=CC(=C(C=C1)O)OC Z104500600 [1,1,0,0,0,0|1,0,0]=3 73 B13R1.49 COC1=C(C=CC(=C1)C(=O)CN)O Z4654934301 [1,1,0,0,0,0|1,0,0]=3 74 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O Z2574937385 [1,1,0,0,0,0|1,0,1]=4 75 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Br Z1269221903 [1,1,0,0,0,0|1,0,1]=4 76 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)C Z168876634 [1,1,0,0,0,0|1,0,1]=4 77 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl Z1269148038 [1,1,0,0,0,0|1,0,1]=4 78 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)N Z4184587402 [1,1,0,0,0,0|1,0,1]=4 79 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)O Z1203162033 [1,1,0,0,0,0|0,0,1]=3 80 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [1,1,0,0,0,0|0,0,2]=4 81 B13R1.52 COC1=C(C=CC(=C1)CN(C)C)O Z2177030804 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)N Z278204678 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.386 C=CCC1=CC(=C(C=C1)OC)OC Z1255398904 [1,1,0,0,0,0|0,0,2]=4 84 B13R1.386 CCNC1=CC(=C(C=C1)OC)OC Z286407122 [1,1,0,0,0,0|1,0,1]=4 85 B13R1.386 CNCC1=CC(=C(C=C1)OC)OC Z56173976 [1,1,0,0,0,0|1,0,1]=4 86 B13R1.386 COC1=C(C=C(C=C1)/C=N/O)OC Z49568350 [1,1,0,0,0,0|1,0,0]=3 87 B13R1.386 COC1=C(C=C(C=C1)CC=O)OC Z1020779916 [1,1,0,0,0,0|0,0,2]=4 88 B13R1.386 COC1=C(C=C(C=C1)CCN)OC Z104477298 [1,1,0,0,0,0|1,0,1]=4 89 B13R1.386 COC1=C(C=C(C=C1)CCO)OC Z397587464 [1,1,0,0,0,0|0,0,1]=3 90 B13R1.81 COC1=CC(=CC=C1)CC(=O)CCl Z1255424725 [1,1,0,0,0,0|1,0,1]=4 91 B13R1.81 COC1=CC(=CC=C1)NC(=O)CCl Z56896296 [1,1,0,0,0,0|2,0,0]=4 92 B13R1.81 COC1=CC(=CC=C1)NC(=O)CN Z1449747347 [1,1,0,0,0,0|2,0,0]=4 93 B13R1.643 COC1=CC(=CC=C1)/C=C/C(=O)C Z85921945 [1,1,0,0,0,0|0,0,2]=4 94 B13R1.643 COC1=CC(=CC=C1)/C=C/C(=O)O Z104494816 [1,1,0,0,0,0|0,0,1]=3 95 B13R1.643 COC1=CC(=CN=C1)/C=C/C(=O)O Z1649893282 [1,1,0,0,0,0|1,0,1]=4 96 B13R1.666 COC1=CC(=CC=C1)CCCCO Z1198340910 [1,1,0,0,0,0|0,0,2]=4 97 B13R1.511 CC1=C(C=CC(=C1)/C=C/C(=O)O)Br Z1269121998 [1,1,0,0,0,0|1,0,1]=4 98 B13R1.511 CC1=C(C=CC(=C1)/C=C/C(=O)O)F Z2311791362 [1,1,0,0,0,0|1,0,1]=4 99 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)O)O Z240113804 [1,1,0,0,0,0|0,0,1]=3 100 B13R1.1630 CC1=CC(=C(C=C1/C=C/CO)C)C Z2607875316 [1,1,0,0,0,0|1,0,0]=3 101 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)O)C Z1462270632 [1,1,0,0,0,0|2,0,0]=4 102 B15R1.392 COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)O Z56911947 [0,2,0,0,0,0|0,0,1]=3 103 B15R1.392 COC1=C(C(=CC(=C1)/C=C/C(=O)O)Cl)O Z56957444 [0,2,0,0,0,0|0,0,1]=3 104 B15R1.4039 COC(=O)/C=C/C1=CC(=C(C=C1)O)OC Z18704892 [0,2,0,0,0,0|0,0,1]=3 105 B15R1.12854 COC1=C(C=C(C=C1)/C=C/C(=O)O)OC Z2573653932 [0,2,0,0,0,0|0,0,1]=3 106 B15R1.12854 COC1=C(C=C(C=C1)/C=C/[N+](=O)[O-])OC Z56862728 [0,2,0,0,0,0|1,0,1]=4 107 B15R1.815 CCOC(=O)C1=CC(=C(C=C1)OC)OC Z53836602 [0,2,0,0,0,0|2,0,0]=4 108 B15R1.12139 CCOC1=C(C=CC(=C1)/C=C/C#N)OC Z851014560 [0,2,0,0,0,0|1,0,1]=4 109 B15R1.1195 COCCNC1=CC(=C(C=C1)OC)OC Z266654348 [0,2,0,0,0,0|1,0,1]=4 110 B15R1.3769 CCC(=O)CC1=CC(=C(C=C1)OC)OC Z599781402 [0,2,0,0,0,0|1,0,1]=4 111 B15R1.3769 CCC(=O)NC1=CC(=C(C=C1)OC)OC Z30849337 [0,2,0,0,0,0|2,0,0]=4 112 B15R1.3769 COC1=C(C=C(C=C1)C/C(=N/O)/N)OC Z285225850 [0,2,0,0,0,0|1,0,1]=4 113 B15R1.3769 COC1=C(C=C(C=C1)CC(=O)NO)OC Z59182048 [0,2,0,0,0,0|1,0,1]=4 114 B15R1.3769 COC1=C(C=C(C=C1)NC(=O)CCl)OC Z56896282 [0,2,0,0,0,0|2,0,0]=4 115 B15R1.12140 CCOC1=C(C=C(C=C1)/C=C/C=O)OC Z2607874374 [0,2,0,0,0,0|0,0,2]=4 116 B13R2.121 COC1=C(C=CC2=C1OCO2)Br Z1681354536 [1,0,0,1,0,0|2,0,0]=4 117 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 Z57307088 [1,0,0,1,0,0|1,0,1]=4 118 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 Z94601334 [1,0,0,1,0,0|1,0,1]=4 119 B13R2.449 O/N=C/C1=CC2=C(C=C1)OCO2 Z49568304 [1,0,0,1,0,0|1,0,0]=3 120 B13R2.449 O=CCC1=CC2=C(C=C1)OCO2 Z1198331621 [1,0,0,1,0,0|0,0,2]=4 121 B13R2.449 O=CNC1=CC2=C(C=C1)OCO2 Z1258520893 [1,0,0,1,0,0|1,0,1]=4 122 B13R2.599 COC1=C(C=C2CCCC2=C1)O Z1513818935 [1,0,0,1,0,0|0,0,2]=4 123 B13R2.599 COC1=C(C=C2NC=CC2=C1)Cl Z1255373562 [1,0,0,1,0,0|2,0,0]=4 124 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 Z1201622861 [1,0,0,1,0,0|2,0,0]=4 125 B13R2.57 COC1=CC2=C(C=C1)CCC=C2 Z1198179971 [1,0,0,1,0,0|1,0,0]=3 126 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 Z166628264 [1,0,0,1,0,0|1,0,1]=4 127 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 Z53835290 [1,0,0,1,0,0|1,0,1]=4 128 B13R2.1613 COC1=C2N=CC=CC2=CC=C1 Z54849993 [1,0,0,1,0,0|1,0,1]=4 129 B13R2.369 OC1=C(C=C2C=NC=CC2=C1)O Z3892178991 [1,0,0,1,0,0|2,0,0]=4 130 B15R2.7688 CC(O)CCC1=CC2=C(C=C1)OCO2 Z335245112 [0,1,0,1,0,0|0,0,2]=4 131 B15R2.7688 O=C(O)/C=C/C1=CC2=C(C=C1)OCC2 Z2942851993 [0,1,0,1,0,0|1,0,1]=4 132 B15R2.7688 O=C(O)/C=C/C1=CC2=C(C=C1)OCO2 Z56789057 [0,1,0,1,0,0|0,0,1]=3 133 B15R2.7688 O=[N+]([O-])/C=C/C1=CC2=C(C=C1)OCO2 Z3103063194 [0,1,0,1,0,0|1,0,1]=4 134 B15R2.1350 NC(CCO)C1=CC2=C(C=C1)OCO2 Z2941518672 [0,1,0,1,0,0|0,0,2]=4 135 B15R2.352 O=C/C=C/C1=CC2=C(C=C1)OCCO2 Z1251359592 [0,1,0,1,0,0|0,0,2]=4 136 B15R2.117 COC1=C(C=C2C=CC=CC2=C1)OC Z1255395785 [0,1,0,1,0,0|1,0,1]=4 137 B15R2.117 COC1=C(C=C2C=NC=CC2=C1)OC Z57008877 [0,1,0,1,0,0|2,0,0]=4 138 B15R2.117 COC1=C(C=C2N=CC=CC2=C1)OC Z1813143006 [0,1,0,1,0,0|1,0,1]=4 139 B15R2.2039 COC1=C(C=C2C(=C1)C=CN=C2O)Cl Z1416169330 [0,1,0,1,0,0|1,0,1]=4 140 B15R2.2039 COC1=C(C=C2C(=CC=NC2=C1)O)Br Z1862017708 [0,1,0,1,0,0|1,0,1]=4 141 B15R2.2123 OCCCCC1=CC2=C(C=C1)OCO2 Z1255357952 [0,1,0,1,0,0|0,0,2]=4 142 B15R2.4343 CCC(=O)NC1=CC2=C(C=C1)OCO2 Z27647469 [0,1,0,1,0,0|2,0,0]=4 143 B15R2.4343 O=C(CCl)NC1=CC2=C(C=C1)OCO2 Z56862739 [0,1,0,1,0,0|2,0,0]=4 144 B10R1.172 CNC1=CC(=CC=C1)CO Z1082871942 [3,0,0,0,0,0|1,0,0]=4 145 B10R1.172 CNC1=CC(=CC=C1)OC Z3013892520 [3,0,0,0,0,0|1,0,0]=4 146 B10R1.172 COC1=CC(=CC=C1)C=O Z53836050 [3,0,0,0,0,0|0,0,1]=4 147 B10R1.172 COC1=CC(=CC=C1)CCl Z104486106 [3,0,0,0,0,0|1,0,0]=4 148 B10R1.172 COC1=CC(=CC=C1)CO Z90121251 [3,0,0,0,0,0|0,0,0]=3 149 B10R1.172 COC1=CC(=NC=C1)CO Z800297980 [3,0,0,0,0,0|1,0,0]=4 150 B10R1.172 COC1=NC(=CC=C1)CO Z969097688 [3,0,0,0,0,0|1,0,0]=4 151 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [3,0,0,0,0,0|1,0,0]=4 152 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [3,0,0,0,0,0|0,0,1]=4 153 B10R1.176 CC1=C(C=CC(=C1)C=O)O Z1082846778 [3,0,0,0,0,0|0,0,1]=4 154 B10R1.176 CC1=C(C=CC(=C1)CO)Br Z1269142250 [3,0,0,0,0,0|1,0,0]=4 155 B10R1.176 CC1=C(C=CC(=C1)CO)Cl Z1201623310 [3,0,0,0,0,0|1,0,0]=4 156 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [3,0,0,0,0,0|0,0,1]=4 157 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [3,0,0,0,0,0|1,0,0]=4 158 B10R1.176 NCC1=CC(=C(C=C1)O)O Z1272096628 [3,0,0,0,0,0|1,0,0]=4 159 B10R1.176 O=CC1=CC(=C(C=C1)O)O Z56957508 [3,0,0,0,0,0|0,0,1]=4 160 B10R1.176 OCC1=CC(=C(C=C1)I)O Z1269159331 [3,0,0,0,0,0|1,0,0]=4 161 B10R1.176 OCC1=CC(=C(C=C1)O)Cl Z839172284 [3,0,0,0,0,0|1,0,0]=4 162 B10R1.176 OCC1=CC(=C(C=C1)O)F Z385458838 [3,0,0,0,0,0|1,0,0]=4 163 B10R1.176 OCC1=NC=C(C(=C1)O)O Z3003010756 [3,0,0,0,0,0|1,0,0]=4 164 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [3,0,0,0,0,0|1,0,0]=4 165 B10R1.30 COC1=C(C=CC(=C1)C)N Z607822396 [3,0,0,0,0,0|1,0,0]=4 166 B10R1.30 COC1=C(C=CC(=C1)N)O Z3244869289 [3,0,0,0,0,0|1,0,0]=4 167 B10R1.30 COC1=C(C=CC(=C1)O)Br Z1258567775 [3,0,0,0,0,0|1,0,0]=4 168 B10R1.30 COC1=C(C=CC(=C1)O)N Z2574932955 [3,0,0,0,0,0|1,0,0]=4 169 B10R1.30 COC1=C(C=CC(=N1)C)O Z1255397596 [3,0,0,0,0,0|1,0,0]=4 170 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [3,0,0,0,0,0|1,0,0]=4 171 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [3,0,0,0,0,0|0,0,0]=3 172 B12R1.435 CCC(=O)C1=CC(=CC=C1)OC Z513732528 [2,1,0,0,0,0|0,0,1]=4 173 B12R1.435 CNC(=O)C1=CC(=CC=C1)OC Z32016549 [2,1,0,0,0,0|1,0,0]=4 174 B12R1.435 COC(=O)C1=CC(=CC=C1)OC Z18352701 [2,1,0,0,0,0|1,0,0]=4 175 B12R1.435 COC1=CC(=CC=C1)C(=O)CBr Z104482198 [2,1,0,0,0,0|1,0,0]=4 176 B12R1.435 COC1=CC(=CC=C1)C(=O)CCl Z440619268 [2,1,0,0,0,0|1,0,0]=4 177 B12R1.435 COC1=CC(=CC=C1)C(=O)CN Z2242140910 [2,1,0,0,0,0|1,0,0]=4 178 B12R1.435 COC1=CC(=CC=C1)C(N)CO Z385458538 [2,1,0,0,0,0|0,0,1]=4 179 B12R1.435 COC1=CC(=CC=C1)C(O)CO Z1416170023 [2,1,0,0,0,0|0,0,1]=4 180 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [2,1,0,0,0,0|0,0,1]=4 181 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [2,1,0,0,0,0|1,0,0]=4 182 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [2,1,0,0,0,0|0,0,1]=4 183 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [2,1,0,0,0,0|0,0,1]=4 184 B12R1.288 COC1=C(C=C(C=C1)CCO)O Z1198339386 [2,1,0,0,0,0|0,0,1]=4 185 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)O)O Z56912624 [2,1,0,0,0,0|1,0,0]=4 186 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)O Z1255420244 [2,1,0,0,0,0|1,0,0]=4 187 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)Cl Z1198331246 [2,1,0,0,0,0|1,0,0]=4 188 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)F Z1201620068 [2,1,0,0,0,0|1,0,0]=4 189 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [2,1,0,0,0,0|0,0,0]=3 190 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)C Z104511172 [2,1,0,0,0,0|1,0,0]=4 191 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)Cl Z1741972864 [2,1,0,0,0,0|1,0,0]=4 192 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F Z1201620067 [2,1,0,0,0,0|1,0,0]=4 193 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)I Z1269139629 [2,1,0,0,0,0|1,0,0]=4 194 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O Z381356666 [2,1,0,0,0,0|0,0,0]=3 195 B12R1.56 COC1=C(N=CC(=C1)C(=O)O)O Z1201626480 [2,1,0,0,0,0|1,0,0]=4 196 B12R1.78 CNC1=CC(=C(C=C1)OC)OC Z1259341013 [2,1,0,0,0,0|1,0,0]=4 197 B12R1.78 COC1=C(C=C(C=C1)C=O)OC Z53837671 [2,1,0,0,0,0|0,0,1]=4 198 B12R1.78 COC1=C(C=C(C=C1)CO)OC Z104477212 [2,1,0,0,0,0|0,0,0]=3 199 B12R1.300 COC1=C(C(=CC(=C1)C=O)Br)O Z57313888 [2,1,0,0,0,0|0,0,1]=4 200 B12R1.300 COC1=C(C(=CC(=C1)C=O)Cl)O Z56948379 [2,1,0,0,0,0|0,0,1]=4 201 B12R1.300 COC1=C(C(=CC(=C1)C=O)I)O Z56957506 [2,1,0,0,0,0|0,0,1]=4 202 B12R1.300 COC1=C(C(=CC(=C1)C=O)O)O Z56979310 [2,1,0,0,0,0|0,0,1]=4 203 B12R1.300 COC1=C(C(=CC(=C1)CN)Br)O Z1695669956 [2,1,0,0,0,0|1,0,0]=4 204 B12R1.300 COC1=C(C(=CC(=C1)CO)I)O Z228585292 [2,1,0,0,0,0|0,0,0]=3 205 B12R1.449 COC1=C(C=C(C(=C1)C=O)Br)O Z57313887 [2,1,0,0,0,0|0,0,1]=4 206 B12R1.449 COC1=C(C=C(C(=C1)C=O)Cl)O Z274515356 [2,1,0,0,0,0|0,0,1]=4 207 B12R1.654 COC1=C(C(=CC=C1O)C=O)Cl Z1198306086 [2,1,0,0,0,0|0,0,1]=4 208 B12R1.654 COC1=C(C(=CC=C1O)C=O)O Z1251357394 [2,1,0,0,0,0|0,0,1]=4 209 B12R1.654 COC1=C(C=CC(=C1C)C=O)O Z1511749564 [2,1,0,0,0,0|0,0,1]=4 210 B12R1.50 CC1=CC(=CC=C1)NC(=O)CO Z431952658 [2,1,0,0,0,0|1,0,0]=4 211 B12R1.226 CC1=CC(=CC=C1)/C=C/C(=O)O Z2942851787 [2,1,0,0,0,0|0,0,1]=4 212 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O Z247613734 [2,1,0,0,0,0|0,0,1]=4 213 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [2,1,0,0,0,0|0,0,1]=4 214 B12R1.71 CCC1=CC=C(C=C1)/C=C/CO Z1913661008 [2,1,0,0,0,0|1,0,0]=4 215 B14R1.1864 CCC(=O)C1=CC(=C(C=C1)OC)OC Z57952774 [1,2,0,0,0,0|0,0,1]=4 216 B14R1.1864 CNC(=O)C1=CC(=C(C=C1)OC)OC Z32016676 [1,2,0,0,0,0|1,0,0]=4 217 B14R1.1864 COC(=O)C1=CC(=C(C=C1)CO)OC Z1618141881 [1,2,0,0,0,0|1,0,0]=4 218 B14R1.1864 COC(=O)C1=CC(=C(C=C1)OC)OC Z18491817 [1,2,0,0,0,0|1,0,0]=4 219 B14R1.1864 COC1=C(C=C(C=C1)C(=O)CBr)OC Z56933742 [1,2,0,0,0,0|1,0,0]=4 220 B14R1.1864 COC1=C(C=C(C=C1)C(=O)CN)OC Z3225947271 [1,2,0,0,0,0|1,0,0]=4 221 B14R1.881 COC1=C(C=C(C(=C1)CC(=O)O)F)O Z1416167707 [1,2,0,0,0,0|0,0,1]=4 222 B14R1.3651 COC1=C(C=C(C=C1)/C=[N+](/C)\[O-])OC Z56920101 [1,2,0,0,0,0|1,0,0]=4 223 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)O)OC Z56924495 [1,2,0,0,0,0|0,0,1]=4 224 B14R1.3651 COC1=C(C=C(C=C1)NC(=O)C)OC Z30849291 [1,2,0,0,0,0|1,0,0]=4 225 B14R1.3651 COC1=C(C=C(C=C1)NC(=S)C)OC Z56757210 [1,2,0,0,0,0|1,0,0]=4 226 B14R1.3237 COC1=C(C(=CC(=C1)/C=N/O)Cl)OC Z49568195 [1,2,0,0,0,0|1,0,0]=4 227 B14R1.6788 CCOC1=C(C=C(C=C1)/C=N/O)OC Z49568504 [1,2,0,0,0,0|1,0,0]=4 228 B14R1.75 COC1=CC(=CC=C1)/C=C(\C)/C(=O)O Z57229610 [1,2,0,0,0,0|0,0,1]=4 229 B14R1.962 COC1=CC(=CC=C1)NC(=O)/C=N/O Z94601354 [1,2,0,0,0,0|1,0,0]=4 230 B14R1.962 COCC(=O)NC1=CC(=CC=C1)OC Z31518698 [1,2,0,0,0,0|1,0,0]=4 231 B14R1.74 COC1=CC(=CC=C1)/C(=C/C(=O)O)/C Z352747000 [1,2,0,0,0,0|0,0,1]=4 232 B14R1.468 CCOC1=CC(=CC=C1)/C=C/C(=O)O Z2587996047 [1,2,0,0,0,0|0,0,1]=4 233 B14R1.3653 COC1=C(C=C(C=C1)/C=C/C(=O)O)O Z2693271860 [1,2,0,0,0,0|0,0,1]=4 234 B16R1.414 COC1=C(C(=CC(=C1)/C=C/C(=O)O)Cl)OC Z2312398330 [0,3,0,0,0,0|0,0,1]=4 235 B16R1.423 COC1=CC(=CC(=C1O)OC)/C=C/C(=O)O Z1266855053 [0,3,0,0,0,0|0,0,1]=4 236 B16R1.4035 CCOC1=C(C(=CC(=C1)/C=C/C(=O)O)Cl)O Z56960245 [0,3,0,0,0,0|0,0,1]=4 237 B16R1.10273 CCOC1=C(C=CC(=C1)/C=C/C(=O)O)OC Z2312398438 [0,3,0,0,0,0|0,0,1]=4 238 B16R1.4763 COC1=C(C=CC(=C1)/C=C(/C#N)\C(=O)O)O Z44303388 [0,3,0,0,0,0|0,0,1]=4 239 B16R1.4276 COC(=O)/C=C/C1=CC(=C(C=C1)OC)OC Z18296037 [0,3,0,0,0,0|0,0,1]=4 240 B16R1.9381 CCOC1=C(C=C(C=C1)/C=C/C(=O)O)OC Z2315575629 [0,3,0,0,0,0|0,0,1]=4 241 B12R1.235 COC1=C(C(=CC(=C1)Br)CO)O Z57100575 [1,0,1,1,0,0|1,0,0]=4 242 B12R2.43 COC1=CC(=CC=C1)C2CO2 Z278165228 [2,0,0,1,0,0|0,0,1]=4 243 B12R2.44 COC1=CC2=C(C=C1)NC=C2 Z104507276 [2,0,0,1,0,0|1,0,0]=4 244 B12R2.44 COC1=CC2=C(C=C1)OC=N2 Z1198314976 [2,0,0,1,0,0|1,0,0]=4 245 B12R2.315 COC1=C2NC=CC2=CC=C1 Z1192378717 [2,0,0,1,0,0|1,0,0]=4 246 B12R2.315 COC1=C2OCOC2=CC=C1 Z1416163605 [2,0,0,1,0,0|1,0,0]=4 247 B12R2.82 CC1=C2OC=NC2=CC=C1O Z3243446285 [2,0,0,1,0,0|1,0,0]=4 248 B14R2.2167 COC1=C(C=C2CCC(=O)C2=C1)O Z1255432077 [1,1,0,1,0,0|0,0,1]=4 249 B14R2.1008 CC(=O)NC1=CC2=C(C=C1)OCO2 Z27647423 [1,1,0,1,0,0|1,0,0]=4 250 B14R2.1008 CC(=S)NC1=CC2=C(C=C1)OCO2 Z56764111 [1,1,0,1,0,0|1,0,0]=4 251 B14R2.1008 C[C@@H](O)CC1=CC2=C(C=C1)OCO2 Z1198314644 [1,1,0,1,0,0|0,0,1]=4 252 B14R2.1008 C[C@H](O)CC1=CC2=C(C=C1)OCO2 Z1650168507 [1,1,0,1,0,0|0,0,1]=4 253 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 Z274782846 [1,1,0,1,0,0|0,0,1]=4 254 B14R2.134 COC1=CC2=C(C=C1)OCC(=O)N2 Z1198176733 [1,1,0,1,0,0|1,0,0]=4 255 B14R2.1815 COC1=CC2=C(C=C1)C(C(=O)N2)O Z808167656 [1,1,0,1,0,0|1,0,0]=4 256 B14R2.11647 COC1=C2OC(=CC2=CC=C1)CN Z446020786 [1,1,0,1,0,0|1,0,0]=4 257 B14R2.10 COC1=CC(=CC=C1)C2=CCNC2 Z1592025222 [1,1,0,1,0,0|1,0,0]=4 258 B14R2.1801 COC1=CC2=C(C=C1)C(=CC=N2)O Z381338442 [1,1,0,1,0,0|0,0,1]=4 259 B14R3.3015 C1=CC2=C(C=C1C3CO3)OCO2 Z278165238 [1,0,0,2,0,0|0,0,1]=4 260 B16R2.24931 O=C(O)/C=C/C1=CC(=C2OCOC2=C1)Cl Z2312401880 [0,2,0,1,0,0|0,0,1]=4 261 B16R2.477 O=C(O)/C=C/C1=CC2=C(C=C1)OCCO2 Z2942851901 [0,2,0,1,0,0|0,0,1]=4 262 B16R2.2151 O=C(/C=N/O)NC1=CC2=C(C=C1)OCO2 Z104487046 [0,2,0,1,0,0|1,0,0]=4 263 B16R3.10840 O=C1C=CC2=C(O1)C=C3OCOC3=C2 Z1198183381 [0,1,0,2,0,0|0,0,1]=4 264 B16R3.5256 O=C1OC(C2=C1C=C3OCOC3=C2)O Z1946122176 [0,1,0,2,0,0|1,0,0]=4 265 B16R3.27813 O=C1CCOC2=C1C=C3OCOC3=C2 Z384973100 [0,1,0,2,0,0|0,0,1]=4