0 B25R3.3579239 C=C(O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-4156022328 [0,0,0,0,0,0|0,0,2]=2 1 B25R3.3579239 CC(=O)C=C(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-8015572976 [0,0,0,0,0,0|0,0,2]=2 2 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)[O-] MCULE-2794487450 [0,0,0,0,0,0|0,0,1]=1 3 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)SC2=O)O MCULE-2056228619 [0,0,0,0,0,0|0,1,0]=1 4 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=N3)OC2=O)O MCULE-4519084711 [0,0,0,0,0,0|1,0,0]=1 5 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-1618253893 [0,0,0,0,0,0|0,0,0]=0 6 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-2274749076 [0,0,0,0,0,0|0,0,0]=0 7 B25R3.3579239 CC(=O)CC(C1=CC=CC=C1)C2=C(OC3=C(C2=O)C=CC=C3)O MCULE-3295453336 [0,0,0,0,0,0|0,0,2]=2 8 B25R3.3579239 CC(=O)C[C@@H](C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-2729868582 [0,0,0,0,0,0|0,0,0]=0 9 B25R3.3579239 CC(=O)C[C@@H](C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-7311592691 [0,0,0,0,0,0|0,0,0]=0 10 B25R3.3579239 CC(=O)C[C@H](C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-6870528147 [0,0,0,0,0,0|0,0,0]=0 11 B25R3.3579239 O=C(O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-9921028074 [0,0,0,0,0,0|1,0,0]=1 12 B24R3.36559 CC(=O)NC(C1=CC=CC=C1)C2=C(C3=NC=CC=C3C=C2)O MCULE-8870787509 [1,0,0,0,0,0|3,0,0]=4 13 B26R3.33404991 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(OC2=O)C(=CC=C3)O)O MCULE-7344547815 [0,1,0,0,0,0|0,0,0]=1 14 B26R3.34007343 CC(=O)C(O)C(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-2915829379 [0,1,0,0,0,0|0,0,0]=1 15 B26R3.34289914 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC(=C3)O)OC2=O)O MCULE-7822776549 [0,1,0,0,0,0|0,0,0]=1 16 B26R3.53831368 CC(=O)CC(C1=CC=C(C=C1)Br)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-8224899323 [0,1,0,0,0,0|0,0,0]=1 17 B26R3.53831368 CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-2783988823 [0,1,0,0,0,0|0,0,0]=1 18 B26R3.53831368 CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=C(C=CC=C3)OC2=O)[O-] MCULE-2503120894 [0,1,0,0,0,0|0,0,1]=2 19 B26R3.53831368 CC(=O)CC(C1=CC=C(C=C1)O)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-1773092339 [0,1,0,0,0,0|0,0,0]=1 20 B26R3.53831368 CC(=O)CC(C1=CC=C(C=C1)O)C2=C(C3=C(C=CC=C3)OC2=O)[O-] MCULE-6609756461 [0,1,0,0,0,0|0,0,1]=2 21 B26R3.53831368 CC(=O)C[C@H](C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O MCULE-1680797690 [0,1,0,0,0,0|0,0,0]=1 22 B26R3.53831368 CC(=O)C[C@H](C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O MCULE-5192571008 [0,1,0,0,0,0|0,0,0]=1 23 B26R3.53831368 O=C(O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-1694383581 [0,1,0,0,0,0|1,0,0]=2 24 B26R3.56121876 CCC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)[O-] MCULE-3028381227 [0,1,0,0,0,0|0,0,1]=2 25 B26R3.56121876 CCC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)[O-] MCULE-5294408572 [0,1,0,0,0,0|0,0,1]=2 26 B26R3.56121876 CCC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)SC2=O)O MCULE-8861285506 [0,1,0,0,0,0|0,1,0]=2 27 B26R3.56121876 CCC(O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-6714659257 [0,1,0,0,0,0|0,0,2]=3 28 B26R3.56121876 COC(=O)CC(C1=CC=CC=C1)C2=C(N3C=CC=CC3=NC2=O)O MCULE-2958683812 [0,1,0,0,0,0|2,0,0]=3 29 B26R3.56121876 COC(=O)CC(C1=CN=CC=C1)C2=C(N3C=CC=CC3=NC2=O)O MCULE-5161069673 [0,1,0,0,0,0|3,0,0]=4 30 B26R3.150958569 O=C(O)CC(C1=CC=CC(=C1)Br)C2=C(C3=CC=CC=C3OC2=O)O MCULE-1009493920 [0,1,0,0,0,0|1,0,0]=2 31 B26R3.249452400 CC(=O)CC(C1=CC=CC=C1)C2=C(C3=C(C=C(C=C3)O)OC2=O)O MCULE-2855272552 [0,1,0,0,0,0|0,0,0]=1 32 B24R3.2713944 O=C(O)CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=CC=C3 MCULE-5503710796 [0,0,0,0,1,0|2,0,1]=4 33 B24R3.24420679 CC(=O)C[C@H](C1=CC=CO1)C2=C(C3=CC=CC=C3OC2=O)O MCULE-5907789989 [0,0,0,0,1,0|1,0,0]=2 34 B23R3.1931051 CCC(C1=CC=CC=C1)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-7819585997 [2,0,0,0,0,0|0,0,0]=2 35 B25R3.19242648 CC(=O)CC(C1=CC=CC=C1)C2(C(=O)C3=C(C2=O)C=CC=C3)Br MCULE-8286215600 [0,1,0,0,1,0|0,0,2]=4 36 B25R3.19242648 CC(=O)CC(C1=CC=CC=C1)C2(C(=O)C3=C(C2=O)C=CC=C3)Cl MCULE-5884912824 [0,1,0,0,1,0|0,0,2]=4 37 B25R3.310091406 CCC(=O)CC(C1=CC=CC=C1)C2C(=O)C3=C(C2=O)C=CC=C3 MCULE-3882062690 [0,1,0,0,1,0|0,0,2]=4 38 B25R3.310091406 COC(=O)CC(C1=CC=CC=C1)N2C(=O)C3=C(C2=O)C=CC=C3 MCULE-8503556452 [0,1,0,0,1,0|1,0,1]=4 39 B27R3.387601216 COC(=O)CC(C1=C(C=CC=C1)Cl)C2=C(N3C=CC=CC3=NC2=O)O MCULE-6867224045 [0,2,0,0,0,0|2,0,0]=4 40 B27R3.387601216 COC(=O)CC(C1=C(C=CC=C1)F)C2=C(N3C=CC=CC3=NC2=O)O MCULE-3804008664 [0,2,0,0,0,0|2,0,0]=4 41 B27R3.63183138 COC(=O)CC(C1=CC=CC=C1)C2=C(N3C=C(C=CC3=NC2=O)Cl)O MCULE-5834351305 [0,2,0,0,0,0|2,0,0]=4 42 B27R3.24435108 COC1=CC=C(C=C1)C(CC(=O)C)C2=C(C3=C(C=CC=C3)OC2=O)O MCULE-2182246059 [0,2,0,0,0,0|0,0,0]=2 43 B27R3.387516207 COC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(N3C=CC=CC3=NC2=O)O MCULE-4069200367 [0,2,0,0,0,0|2,0,0]=4 44 B27R3.387516207 COC(=O)CC(C1=CC=C(C=C1)F)C2=C(N3C=CC=CC3=NC2=O)O MCULE-3511230276 [0,2,0,0,0,0|2,0,0]=4 45 B27R3.387516207 COC(=O)CC(C1=CC=C(C=C1)O)C2=C(C3=CC=CC=C3OC2=O)O MCULE-5063193935 [0,2,0,0,0,0|0,0,0]=2 46 B27R3.387516207 COC(=O)CC(C1=CC=C(C=C1)O)C2=C(N3C=CC=CC3=NC2=O)O MCULE-1018217476 [0,2,0,0,0,0|2,0,0]=4 47 B27R3.53999947 CCOC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3NC2=O)O MCULE-2257960645 [0,2,0,0,0,0|1,0,0]=3 48 B27R3.53999947 CCOC(=O)CC(C1=CN=CC=C1)C2=C(C3=CC=CC=C3NC2=O)O MCULE-3929857084 [0,2,0,0,0,0|2,0,0]=4 49 B27R3.387561180 COC(=O)CC(C1=CC(=CC=C1)O)C2=C(C3=CC=CC=C3OC2=O)O MCULE-9787065871 [0,2,0,0,0,0|0,0,0]=2 50 B27R3.387561180 COC(=O)CC(C1=CC(=CC=C1)O)C2=C(N3C=CC=CC3=NC2=O)O MCULE-9693254536 [0,2,0,0,0,0|2,0,0]=4 51 B27R3.2450887680 CC1=CC(=C2C(=C1)OC(=O)C(=C2O)C(CC(=O)O)C3=CC=CC=C3)C MCULE-4118521036 [0,2,0,0,0,0|1,0,0]=3 52 B25R3.3576644 CC(=O)CC(OC1=CC(=O)OC2=C1C=CC=C2)C3=CC=CC=C3 MCULE-8800687085 [0,0,1,1,0,0|2,0,0]=4 53 B25R4.4243507 O=C1OC(C2=C1C=CC=C2)C3=C(C4=CC=CC=C4OC3=O)O MCULE-2544215250 [1,0,0,1,0,0|1,0,0]=3 54 B25R4.41619982 O=C1CC(C2=C(O1)C3=C(C=CC=C3)NC2=O)C4=CC=CC=C4 MCULE-1667684868 [1,0,0,1,0,0|1,0,0]=3 55 B25R4.41619982 O=C1CC(C2=C(O1)C3=C(C=CC=C3)NC2=O)C4=CN=CC=C4 MCULE-4535827373 [1,0,0,1,0,0|2,0,0]=4 56 B25R4.41619982 O=C1CC(C2=C(O1)C3=C(C=CC=C3)OC2=O)C4=CC=CC=C4 MCULE-9287232478 [1,0,0,1,0,0|0,0,0]=2 57 B25R4.44540817 O=C1OC2=C(C=CC=C2)C(=C1C3CCCC4=C3C=CC=C4)O MCULE-8371389991 [1,0,0,1,0,0|0,0,1]=3 58 B25R4.44540817 O=C1OC2=C(C=CC=C2)C(=C1C3NCCC4=C3C=CC=C4)O MCULE-9851928056 [1,0,0,1,0,0|1,0,1]=4 59 B27R4.25880292 O=C(O)CC1=C(OC2=C1C(=O)OC3=C2C=CC=C3)C4=CC=CC=C4 MCULE-5105944414 [0,0,0,1,0,1|1,0,1]=4 60 B27R4.3862206 CC(=O)N1C=C(C2=C1C=CC=C2)C3=C(C4=CC=CC=C4OC3=O)O MCULE-3707437670 [0,0,0,1,0,1|0,0,2]=4 61 B27R4.428930 COC(=O)C1OC2=C(C1C3=CN=CC=C3)C(=O)OC4=CC=CC=C24 MCULE-2289518046 [0,1,0,1,0,0|1,0,0]=3 62 B27R4.67435666 CO[C@@]1(C[C@@H](C2=C(O1)C3=C(C=CC=C3)OC2=O)C4=CC=CC=C4)C MCULE-3030042015 [0,1,0,1,0,0|0,0,2]=4