aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16901 | 3.07 | 418.54 | C26H30O3N2 | NC1CC(N)C(OCCCCc2cc3ccc4cccc5ccc(c2)c3c45)C(O)C1O |
|
AD16902 | 2.3 | 219.61 | C10H4ON4Cl | Clc1nc2c(c(-c3ccco3)n1)N=C[N]2 |
|
AD16903 | -0.72 | 321.4 | C12H23O5N3S | COS(=O)(=O)NC(=O)C(CC(C)C)NC(=O)C1CCCN1 |
|
AD16904 | 4.59 | 407.44 | C24H22O4NF | O=C1OC(C(O)CCc2ccccc2)C(c2ccc(O)cc2)N1c1ccc(F)cc1 |
|
AD16905 | -2.33 | 320.34 | C13H24O7N2 | COC(=O)CCCCC(=O)NCC(=O)NC(CO)(CO)CO |
|
AD16906 | 4.37 | 1255.05 | C63H53O17N9Cl2 | NCCCNC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)C2O)NC(=O)C(N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD16907 | 4.69 | 381.44 | C24H19O2N3 | CC1(C)c2ccccc2C(=O)c2c1[nH]c1cc(C(=O)Nc3ccccn3)ccc21 |
|
AD16908 | -1.42 | 313.4 | C9H19O5N3S2 | COS(=O)(=O)NC(=O)C(CCSC)NC(=O)C(C)N |
|
AD16909 | 2.63 | 315.36 | C18H15N6 | C#CCn1cc(CCNc2ncnc3c2N=C[N]3)c2ccccc21 |
|
AD16910 | 6.87 | 558.63 | C36H30O6 | O=C(O)Cc1cccc(-c2cc(Cc3ccc(Cc4ccc(O)c(-c5cccc(CC(=O)O)c5)c4)cc3)ccc2O)c1 |