0 B18R2.1232501 O=C(O)CC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-1571657756 [0,0,0,0,0,0|1,0,0]=1 1 B17R2.20680 CC1=CC2=C(C=C1)N(CC(=O)O2)CC(=O)O MCULE-8904950590 [1,0,0,0,0,0|2,0,1]=4 2 B17R2.20680 CC1=CC=C2C(=CC(=O)OC2=C1)CC(=O)O MCULE-4547612874 [1,0,0,0,0,0|1,0,0]=2 3 B17R2.20680 NC(=O)CC1=CC(=O)OC2=CC(=CC=C12)N MCULE-5069653191 [1,0,0,0,0,0|2,0,0]=3 4 B17R2.20680 NC(=O)CC1=CC(=O)OC2=CC(=CC=C12)O MCULE-1610832390 [1,0,0,0,0,0|1,0,0]=2 5 B17R2.20680 NC1=CC=C2C(=CC(=O)OC2=C1)CC(=O)O MCULE-7405575099 [1,0,0,0,0,0|1,0,0]=2 6 B17R2.20680 O=C(O)CC1=CC(=O)OC2=C1C=CC(=C2)O MCULE-6299044943 [1,0,0,0,0,0|0,0,0]=1 7 B17R2.186597 CC1=CC2=C(C=C1)OC(=O)CN2CC(=O)O MCULE-8803999721 [1,0,0,0,0,0|2,0,1]=4 8 B17R2.186597 CC1=CC=C2OC(=O)C=C(C2=C1)CC(=O)O MCULE-6287484341 [1,0,0,0,0,0|1,0,0]=2 9 B17R2.186597 CN(C)CC1=CC(=O)OC2=CC=C(C=C12)O MCULE-2931053086 [1,0,0,0,0,0|3,0,0]=4 10 B17R2.186597 O=C(O)CN1CC(=O)OC2=C1C=C(C=C2)Cl MCULE-8919509794 [1,0,0,0,0,0|2,0,1]=4 11 B17R2.845669 CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-3500578178 [1,0,0,0,0,0|2,0,1]=4 12 B17R2.845669 CCCC1=CC(=O)OC2=CC(=C(C=C12)O)O MCULE-7332341730 [1,0,0,0,0,0|1,0,1]=3 13 B17R2.845669 COCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-4556174049 [1,0,0,0,0,0|3,0,0]=4 14 B17R2.845669 NCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-3237341960 [1,0,0,0,0,0|2,0,1]=4 15 B17R2.845669 NCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-8447476784 [1,0,0,0,0,0|2,0,1]=4 16 B19R2.5695370 CC1=C(C=C2C(=CC(=O)OC2=C1)CP(=O)(O)O)C MCULE-2600051922 [0,1,0,0,0,0|3,0,0]=4 17 B19R2.14895602 COC(=O)CC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-1836846086 [0,1,0,0,0,0|1,0,0]=2 18 B17R2.38691 CC1=C(C=C2C(=C1)OC(=C2CC(=O)O)Br)Cl MCULE-1649868354 [0,0,0,0,1,0|3,0,0]=4 19 B17R2.900642 O=C1C=C(C2=C(N1)C=C(C(=C2)F)F)C(=O)O MCULE-9986211169 [0,0,0,0,1,0|3,0,0]=4 20 B19R2.5603395 CC(=O)OCC1=CC(=O)OC2=CC(=C(C=C12)Cl)C MCULE-4804570547 [0,0,0,0,0,1|3,0,0]=4 21 B16R2.2986 O=C(O)CC1=C2C=CC(=CC2=CC=C1)O MCULE-2735674873 [2,0,0,0,0,0|1,0,0]=3 22 B16R2.3995 O=C(O)CC1=C2C=CC=CC2=CC(=C1)Cl MCULE-2383966189 [2,0,0,0,0,0|2,0,0]=4 23 B16R2.3995 O=C(O)CC1=CC(=O)NC2=CC=CC=C12 MCULE-4146125331 [2,0,0,0,0,0|1,0,0]=3 24 B16R2.3995 O=C(O)CC1=CC(=O)OC2=CC=CC=C12 MCULE-4275715076 [2,0,0,0,0,0|0,0,0]=2 25 B16R2.3995 O=C(O)CC1CC(=O)OC2=CC=CC=C12 MCULE-9750844159 [2,0,0,0,0,0|0,0,2]=4 26 B16R2.3995 O=C(O)CN1CC(=O)OC2=C1C=CC=C2 MCULE-1226717505 [2,0,0,0,0,0|1,0,1]=4 27 B16R2.113313 CCCC1=CC(=O)OC2=CC(=CC=C12)O MCULE-4564512392 [2,0,0,0,0,0|1,0,1]=4 28 B16R2.113313 COCC1=CC(=O)OC2=C1C=CC(=C2)O MCULE-6856884221 [2,0,0,0,0,0|2,0,0]=4 29 B16R2.113313 NCCC1=CC(=O)OC2=CC(=CC=C12)O MCULE-4098927828 [2,0,0,0,0,0|1,0,1]=4 30 B16R2.198795 CC1=C(C=C2C(=CC(=O)OC2=C1)CN)O MCULE-5505518733 [2,0,0,0,0,0|2,0,0]=4 31 B16R2.198795 CC1=C(C=C2C(=CC(=O)OC2=C1)CN)O MCULE-5749034550 [2,0,0,0,0,0|2,0,0]=4 32 B16R2.198795 CC1=C(C=C2C(=CC(=O)OC2=C1)CO)Cl MCULE-3662334992 [2,0,0,0,0,0|2,0,0]=4 33 B16R2.198795 CC1=CC2=C(C=C1O)C(=CC(=O)O2)CCl MCULE-5809659567 [2,0,0,0,0,0|2,0,0]=4 34 B16R2.198795 CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-2691943943 [2,0,0,0,0,0|1,0,1]=4 35 B16R2.198795 CCC1=CC(=O)OC2=CC(=C(C=C12)O)O MCULE-7496327559 [2,0,0,0,0,0|0,0,1]=3 36 B16R2.198795 O=C1C=C(C2=CC(=C(C=C2O1)O)Br)CO MCULE-7322184886 [2,0,0,0,0,0|1,0,0]=3 37 B16R2.198795 O=C1C=C(C2=CC(=C(C=C2O1)O)Cl)CCl MCULE-1806175670 [2,0,0,0,0,0|2,0,0]=4 38 B16R2.198795 O=C1C=C(C2=CC(=C(C=C2O1)O)O)CCl MCULE-1060966681 [2,0,0,0,0,0|1,0,0]=3 39 B18R2.19576 COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)O MCULE-2970583884 [1,1,0,0,0,0|0,0,0]=2 40 B18R2.33000 CC1=CC=C2C(=CC(=O)OC2=C1)CP(=O)(O)O MCULE-9094429298 [1,1,0,0,0,0|2,0,0]=4 41 B18R2.359530 CC1=CC(=C2C(=CC(=O)OC2=C1)CC(=O)O)O MCULE-1700174032 [1,1,0,0,0,0|1,0,0]=3 42 B18R2.359530 O=C(O)CC1=CC(=O)OC2=CC(=CC(=C12)O)O MCULE-4149260039 [1,1,0,0,0,0|0,0,0]=2 43 B18R2.508820 CC1=C2OC(=O)C=C(C2=CC=C1O)CC(=O)N MCULE-8104047876 [1,1,0,0,0,0|1,0,0]=3 44 B18R2.508820 CC1=C2OC(=O)C=C(C2=CC=C1O)CC(=O)O MCULE-7365946791 [1,1,0,0,0,0|0,0,0]=2 45 B18R2.508820 O=C(O)CC1=CC(=O)OC2=C(C(=CC=C12)O)O MCULE-9447502838 [1,1,0,0,0,0|0,0,0]=2 46 B18R2.1834046 CNC(=O)CC1=CC(=O)OC2=CC(=CC=C12)C MCULE-9888531924 [1,1,0,0,0,0|2,0,0]=4 47 B18R2.1834046 COC(=O)CC1=CC(=O)OC2=CC(=CC=C12)O MCULE-2014901807 [1,1,0,0,0,0|0,0,0]=2 48 B18R2.1834046 NNC(=O)CC1=CC(=O)OC2=CC(=CC=C12)O MCULE-1632669184 [1,1,0,0,0,0|1,0,0]=3 49 B18R2.491081 CC1=CC=C2OC(=O)C=C(C2=C1)CP(=O)(O)O MCULE-5144257666 [1,1,0,0,0,0|2,0,0]=4 50 B18R2.862975 CCC1=CC=C2OC(=O)C=C(C2=C1)CC(=O)O MCULE-2144892974 [1,1,0,0,0,0|1,0,0]=3 51 B18R2.1700338 CCCCC1=CC(=O)OC2=CC(=C(C=C12)O)O MCULE-2275782008 [1,1,0,0,0,0|1,0,1]=4 52 B20R2.14883189 COC1=C(C=C2C(=CC(=O)OC2=C1)CC(=O)O)OC MCULE-9064154668 [0,2,0,0,0,0|0,0,0]=2 53 B20R2.14883197 COC(=O)CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC MCULE-5688762163 [0,2,0,0,0,0|1,0,0]=3 54 B20R2.3956895 CCOC(=O)CC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-8793660089 [0,2,0,0,0,0|1,0,0]=3 55 B18R3.869816 O=C1OC2=CC(=C(C=C2C3=C1CCC3)O)O MCULE-5538189946 [1,0,0,1,0,0|1,0,1]=4 56 B20R3.267209 O=C(O)CC1=CC(=O)OC2=C1C=C3OCOC3=C2 MCULE-5005244721 [0,1,0,1,0,0|0,0,0]=2 57 B16R1.16548 CC1=C(C=C(C=C1)C(=CC(=O)O)C(=O)O)Cl MCULE-6035552494 [0,0,1,0,1,0|2,0,0]=4 58 B16R2.13690 CC1=C(C=C2C(=COC2=C1)CC(=O)O)C MCULE-1209102629 [1,0,0,0,1,0|2,0,0]=4 59 B16R2.13690 CC1=C(C=C2C(=COC2=C1)CC(=O)O)Cl MCULE-6141188211 [1,0,0,0,1,0|2,0,0]=4 60 B16R2.13690 CC1=CC2=C(C=C1Cl)OC=C2CC(=O)O MCULE-1435852409 [1,0,0,0,1,0|2,0,0]=4 61 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)O)Br MCULE-3283492492 [1,0,0,0,1,0|2,0,0]=4 62 B16R2.2982 CC1=CC=C2C(=C1)OC(=C2CC(=O)O)Cl MCULE-7259884390 [1,0,0,0,1,0|2,0,0]=4 63 B16R2.2982 O=C(O)CN1C(=O)OC2=C1C=CC(=C2)Br MCULE-5291311817 [1,0,0,0,1,0|2,0,0]=4 64 B16R2.2982 O=C(O)CN1C(=O)OC2=C1C=CC(=C2)Cl MCULE-9179755001 [1,0,0,0,1,0|2,0,0]=4 65 B16R2.12541 O=C1C=C(C2=C(N1)C=C(C=C2)Br)C(=O)O MCULE-5880193836 [1,0,0,0,1,0|2,0,0]=4 66 B16R2.12541 O=C1C=C(C2=C(N1)C=C(C=C2)Cl)C(=O)O MCULE-2474306537 [1,0,0,0,1,0|2,0,0]=4 67 B16R2.12541 O=C1C=C(C2=C(N1)C=C(C=C2)F)C(=O)O MCULE-9750934322 [1,0,0,0,1,0|2,0,0]=4 68 B16R2.24600 O=C(O)CC1NC(=O)C2=C1C=CC(=C2)O MCULE-6679921158 [1,0,0,0,1,0|1,0,1]=4 69 B16R2.12021 CC1=C(C2=C(N1)C=CC(=C2)O)CC(=O)O MCULE-9613804428 [1,0,0,0,1,0|2,0,0]=4 70 B16R2.12021 CC1=CC=C2OC(=O)N(C2=C1)CC(=O)O MCULE-2993440394 [1,0,0,0,1,0|2,0,0]=4 71 B16R2.12021 O=C(O)CC1=C(OC2=CC=C(C=C12)F)Br MCULE-7395616119 [1,0,0,0,1,0|2,0,0]=4 72 B16R2.12021 O=C(O)CN1C(=O)OC2=CC=C(C=C12)Cl MCULE-2662222216 [1,0,0,0,1,0|2,0,0]=4 73 B16R2.23502 CC1=NC2=C(C=C(C=C2)O)C(=C1)C(=O)O MCULE-5311275347 [1,0,0,0,1,0|2,0,0]=4 74 B16R2.23502 O=C1C=C(C2=C(N1)C=CC(=C2)Br)C(=O)O MCULE-5936627826 [1,0,0,0,1,0|2,0,0]=4 75 B16R2.23502 O=C1C=C(C2=C(N1)C=CC(=C2)Cl)C(=O)O MCULE-2069039052 [1,0,0,0,1,0|2,0,0]=4 76 B16R2.23502 O=C1C=C(C2=C(N1)C=CC(=C2)F)C(=O)O MCULE-3335468229 [1,0,0,0,1,0|2,0,0]=4 77 B18R2.32999 CC(=O)OCC1=CC(=O)OC2=CC(=CC=C12)F MCULE-3841824198 [1,0,0,0,0,1|2,0,0]=4 78 B18R2.491080 CC1=CC=C2OC(=O)C=C(C2=C1)SCC(=O)O MCULE-5928621031 [1,0,0,0,0,1|1,0,0]=3 79 B15R1.1081 O=C(O)C/C=C\C(=O)NC1=CC=CC=C1 MCULE-6957197284 [2,0,1,0,0,0|1,0,0]=4 80 B15R2.68122 O=C(O)CC1=CC=CC2=CC=CC=C12 MCULE-1244884723 [3,0,0,0,0,0|1,0,0]=4 81 B15R2.68122 O=C(O)CC1=CC=NC2=C1C=CC=C2 MCULE-3326591019 [3,0,0,0,0,0|1,0,0]=4 82 B15R2.22666 CCC1=CC(=O)OC2=C1C=CC(=C2)O MCULE-7643920592 [3,0,0,0,0,0|0,0,1]=4 83 B15R2.22666 O=C1C=C(C2=CC=C(C=C2O1)O)CCl MCULE-2690999073 [3,0,0,0,0,0|1,0,0]=4 84 B15R2.89950 O=C1C=C(C2=CC(=CC=C2O1)O)CCl MCULE-9267441045 [3,0,0,0,0,0|1,0,0]=4 85 B15R2.59733 CC1=CC(=O)OC2=C1C=C(C(=C2)O)N MCULE-8928771982 [3,0,0,0,0,0|1,0,0]=4 86 B15R2.59733 CC1=CC(=O)OC2=C1C=C(C(=C2)O)O MCULE-2984770490 [3,0,0,0,0,0|0,0,0]=3 87 B15R2.59733 CC1=CC(=O)OC2=CC(=C(C=C12)Cl)O MCULE-7035070946 [3,0,0,0,0,0|1,0,0]=4 88 B15R2.59733 CC1=CC(=O)OC2=CC(=C(C=C12)N)O MCULE-1909769706 [3,0,0,0,0,0|1,0,0]=4 89 B15R2.59733 CC1=CC2=C(C=C1O)C(=CC(=O)O2)C MCULE-5454773908 [3,0,0,0,0,0|1,0,0]=4 90 B17R2.12011 COC1=CC2=C(C=CC=C2CC(=O)O)C=C1 MCULE-3300625222 [2,1,0,0,0,0|1,0,0]=4 91 B17R2.451970 COC(=O)CC1=CC(=O)NC2=CC=CC=C12 MCULE-9488615899 [2,1,0,0,0,0|1,0,0]=4 92 B17R2.70977 COC1=C(C=C2N=CC=C(C2=C1)C(=O)O)O MCULE-4062520396 [1,1,0,0,1,0|1,0,0]=4 93 B17R2.64915 COC1=CC2=C(C=C1)NC(=O)C=C2C(=O)O MCULE-3454690996 [1,1,0,0,1,0|1,0,0]=4 94 B19R2.7295 CN(C)C1=CC=C2C(=CC(=O)OC2=C1)CC(=O)O MCULE-8105381870 [1,2,0,0,0,0|1,0,0]=4 95 B19R2.29696 COC1=CC=C2C(=CC(=O)OC2=C1)CP(=O)(O)O MCULE-6941201933 [1,2,0,0,0,0|1,0,0]=4 96 B19R2.29844 CNC(=O)CC1=CC(=O)OC2=CC(=CC=C12)OC MCULE-5917010563 [1,2,0,0,0,0|1,0,0]=4 97 B19R2.29844 COC(=O)CC1=CC(=O)OC2=CC(=CC=C12)OC MCULE-6073558480 [1,2,0,0,0,0|0,0,0]=3 98 B19R2.1547418 COC1=CC=C2C(=CC(=O)OC2=C1C)CC(=O)O MCULE-8704115484 [1,2,0,0,0,0|0,0,0]=3 99 B19R2.14895401 COC(=O)CC1=CC(=O)OC2=CC(=CC(=C12)O)C MCULE-8170259865 [1,2,0,0,0,0|1,0,0]=4 100 B19R2.14895401 COC(=O)CC1=CC(=O)OC2=CC(=CC(=C12)O)O MCULE-7135964344 [1,2,0,0,0,0|0,0,0]=3 101 B19R2.1884684 COC(=O)CC1=CC(=O)OC2=C(C(=CC=C12)O)C MCULE-4616748332 [1,2,0,0,0,0|0,0,0]=3 102 B19R2.1884684 COC(=O)CC1=CC(=O)OC2=C(C(=CC=C12)O)O MCULE-2327293971 [1,2,0,0,0,0|0,0,0]=3 103 B19R2.1707329 CCOC(=O)CC1=CC(=O)OC2=C1C=CC(=C2)O MCULE-4123377547 [1,2,0,0,0,0|0,0,0]=3 104 B19R2.2889491 CCOC(=O)CC1=CC(=O)OC2=C1C=C(C=C2)O MCULE-8230160414 [1,2,0,0,0,0|0,0,0]=3 105 B19R2.216652 CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)O MCULE-3788732782 [0,1,0,0,1,1|1,0,0]=4 106 B19R2.216652 CC1=C(C(=O)OC2=CC(=C(C=C12)O)O)CC(=O)O MCULE-4981333221 [0,1,0,0,1,1|0,0,0]=3 107 B21R2.11372171 COC(=O)C(C)C1=CC(=O)OC2=CC(=C(C=C12)Cl)OC MCULE-4389183669 [0,3,0,0,0,0|1,0,0]=4 108 B17R2.78303 O=C(O)C1=CC2=C(C=C(C(=C2)O)O)OC1=O MCULE-7054932233 [1,0,1,1,0,0|0,0,1]=4 109 B21R3.423010 O=C1C=C(C2=CC3=C(C=C2O1)OCO3)CP(=O)(O)O MCULE-2014841928 [0,2,0,1,0,0|1,0,0]=4 110 B15R1.888 O=C(O)C=CC=CC1=CC=C(C(=C1)O)O MCULE-1423975379 [1,0,1,0,1,0|0,0,1]=4 111 B15R1.111 CC1=CC=C(C=C1)OC(=O)C=CC(=O)O MCULE-7670023611 [1,0,1,0,1,0|1,0,0]=4 112 B15R1.111 O=C(O)/C=C/C(=O)NC1=CC=C(C=C1)O MCULE-1257378372 [1,0,1,0,1,0|1,0,0]=4 113 B15R1.111 O=C(O)C=CC(=O)NC1=CC=C(C=C1)O MCULE-5471049510 [1,0,1,0,1,0|1,0,0]=4 114 B15R1.120 O=C(O)C=CC(=O)NC1=CC=CC(=C1)O MCULE-7951038169 [1,0,1,0,1,0|1,0,0]=4 115 B15R1.922 O=C(O)C=C(C(=O)O)C1=CC=C(C=C1)Cl MCULE-8048088660 [1,0,1,0,1,0|1,0,0]=4 116 B15R2.377 CC1=CC=C2C(=COC2=C1)CC(=O)O MCULE-6577994358 [2,0,0,0,1,0|1,0,0]=4 117 B15R2.377 O=C(O)CC1=CNC2=CC(=CC=C12)O MCULE-2932262739 [2,0,0,0,1,0|1,0,0]=4 118 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)F MCULE-4596349219 [2,0,0,0,1,0|1,0,0]=4 119 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)O MCULE-2650354142 [2,0,0,0,1,0|0,0,0]=3 120 B15R2.377 O=C(O)CC1=COC2=CC(=CC=C12)Br MCULE-8775600267 [2,0,0,0,1,0|1,0,0]=4 121 B15R2.377 O=C(O)CC1=COC2=CC(=CC=C12)Cl MCULE-2532015131 [2,0,0,0,1,0|1,0,0]=4 122 B15R2.377 O=C(O)CC1=NOC2=C1C=CC(=C2)O MCULE-4593168478 [2,0,0,0,1,0|1,0,0]=4 123 B15R2.384 O=C(O)C1=CC=CC2=C1C=CC(=C2)O MCULE-9675424040 [2,0,0,0,1,0|1,0,0]=4 124 B15R2.384 O=C(O)C1=CC=NC2=CC(=CC=C12)O MCULE-5998313319 [2,0,0,0,1,0|1,0,0]=4 125 B15R2.7268 O=C(O)C1=C2C=C(C=CC2=CC=C1)O MCULE-8997323102 [2,0,0,0,1,0|1,0,0]=4 126 B15R2.7268 O=C(O)C1=CC=NC2=CC=C(C=C12)O MCULE-3032842538 [2,0,0,0,1,0|1,0,0]=4 127 B15R2.9410 CC1=CC=C2OC=C(C2=C1)CC(=O)O MCULE-1336420816 [2,0,0,0,1,0|1,0,0]=4 128 B15R2.9410 O=C(O)CC1=CNC2=CC=C(C=C12)O MCULE-5193831459 [2,0,0,0,1,0|1,0,0]=4 129 B15R2.9410 O=C(O)CC1=COC2=C1C=C(C=C2)F MCULE-7256135626 [2,0,0,0,1,0|1,0,0]=4 130 B15R2.9410 O=C(O)CC1=NOC2=CC=C(C=C12)O MCULE-4620797319 [2,0,0,0,1,0|1,0,0]=4 131 B15R2.993 CC1=C(C2=C(O1)C=CC=C2)CC(=O)O MCULE-8034313758 [2,0,0,0,1,0|1,0,0]=4 132 B15R2.993 O=C(O)CN1C(=O)OC2=C1C=CC=C2 MCULE-4408323669 [2,0,0,0,1,0|1,0,0]=4 133 B15R2.381 CC1=C(C2=C(O1)C=C(C=C2)O)C(=O)O MCULE-4160841968 [1,0,0,0,2,0|1,0,0]=4 134 B15R2.7204 CC1=C(C2=C(O1)C=CC(=C2)O)C(=O)O MCULE-5913259130 [1,0,0,0,2,0|1,0,0]=4 135 B17R2.5014 O=C(O)COC1=CC(=O)NC2=C1C=CC=C2 MCULE-2379933238 [2,0,0,0,0,1|1,0,0]=4 136 B17R2.5014 O=C(O)COC1=CC(=O)OC2=C1C=CC=C2 MCULE-7592916903 [2,0,0,0,0,1|0,0,0]=3