aglycones

Molecular_Structure AD id AlogP MolWeight MolFormula Smiles
AD02101 8.19 630.89 C39H55O2N4F CC1(C)CCC2(C(=O)NCc3cn(-c4cccc(F)c4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
AD02102 7.95 657.9 C39H55O4N5 CC1(C)CCC2(C(=O)NCc3cn(-c4ccc([N+](=O)[O-])cc4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
AD02103 8.81 691.8 C39H55O2N4Br CC1(C)CCC2(C(=O)NCc3cn(-c4cccc(Br)c4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
AD02104 8.05 612.9 C39H56O2N4 CC1(C)CCC2(C(=O)NCc3cn(-c4ccccc4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
AD02105 13.48 3130.24 C134H224O42N29P7 CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(N2C=CC(N)=NC2O)OC1C(C)O[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C
AD02106 11.75 2973.98 C124H204O41N29P7 Cc1cn(C2CC(O)C(CO[PH](OCCC#N)(OC3CC(n4ccc(N)nc4=O)OC3C(C)O[PH](OCCC#N)(OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3CO[PH](OCCC#N)(OC3CC(n4ccc(N)nc4=O)OC3C(C)O[PH](OCCC#N)(OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3CO[PH](OCCC#N)(OC3CC(n4ccc(N)nc4=O)OC3C(C)O[PH](OCCC#N)(OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(O)O)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)O2)c(=O)[nH]c1=O
AD02107 -0.14 218.22 C10H10O2N4 NC(=O)c1cccc(-n2cc(CO)nn2)c1
AD02108 8.7 647.35 C40H55O2N4Cl CC1(C)CCC2(C(=O)NCc3cn(-c4ccc(Cl)cc4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
AD02109 13.61 3130.24 C134H224O42N29P7 CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2ccc(N)nc2=O)OC1C(C)O[PH](OCCC#N)(OC1CC(N2C=C(C)C(=O)NC2O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO[PH](OCCC#N)(OC1CC(n2cc(C)c(=O)[nH]c2=O)OC1CO)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C)N(C(C)C)C(C)C
AD02110 0.47 191.19 C9H9O2N3 OCc1cn(-c2ccccc2O)nn1