aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21821 | 2.91 | 310.31 | C17H14O4N2 | COC(=O)c1ccccc1NC(=O)c1[nH]c2ccccc2c1O |
|
AD21822 | 1.25 | 337.37 | C16H17ON8 | Nc1nc(NN=Cc2ccc(N3CCOCC3)cc2)nc2c1N=C[N]2 |
|
AD21823 | 1.68 | 291.3 | C14H11N8 | CNc1nc(-n2cc(-c3ccccn3)cn2)nc2c1N=C[N]2 |
|
AD21824 | 4.03 | 316.78 | C19H17O3Cl | Clc1c(Cc2ccc3c(c2)OCCO3)ccc2c1CCCO2 |
|
AD21825 | 3.85 | 280.37 | C19H20O2 | Cc1c(Cc2ccc3c(c2)OCCO3)ccc2c1CCC2 |
|
AD21826 | 3.92 | 288.77 | C18H17O2Cl | CC(O)c1ccc(Cc2ccc3c(c2Cl)OCC3)cc1 |
|
AD21827 | -1.84 | 604.56 | C27H26O8N9 | NC(=O)C1=C(C=CC(=O)N(CC2=NC3C(=O)NC(N)=NC3C=C2)c2ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc2)[N]C=N1 |
|
AD21828 | 1.69 | 289.72 | C15H12O2N3Cl | O=c1n(Cc2ccccc2Cl)nc2cc(CO)ccn12 |
|
AD21829 | 2.12 | 242.29 | C11H8N5S | Nc1nc(Sc2ccccc2)nc2c1N=C[N]2 |
|
AD21830 | 3.35 | 379.16 | C16H11O6Br | COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2Br)cc1O |