aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01411 | 3.01 | 408.54 | C23H36O6 | CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1C |
|
AD01412 | 2.43 | 252.3 | C14H14N5 | CC(Cc1ccccc1)Nc1ncnc2c1N=C[N]2 |
|
AD01413 | 0.79 | 121.14 | C7H7ON | NC(=O)c1ccccc1 |
|
AD01414 | 4.8 | 356.45 | C22H22N5 | C1=Nc2c(ncnc2NCCCCC(c2ccccc2)c2ccccc2)[N]1 |
|
AD01415 | -0.25 | 159.28 | C8H21N3 | CCN(CCNC)CCNC |
|
AD01416 | -2.03 | 2253.84 | C110H134O30N21Cl | COc1ccc(CC(=O)NC(CC(N)=O)C(=O)NCC2C(=O)NC(c3ccc(O)cc3)C(=O)NC(CCCN)C(=O)NC(C(C)C)C(=O)NC(c3ccc(O)cc3)C(=O)NC(c3ccc(O)cc3)C(=O)NC(C(C)O)C(=O)NC(Cc3ccccc3)C(=O)NC(CCCN)C(=O)NC(c3ccc(O)cc3)C(=O)NC(C(C)O)C(=O)NC(c3ccc(O)cc3)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(c3ccc(O)c(Cl)c3)C(=O)OC2C(N)=O)cc1 |
|
AD01417 | 1.12 | 258.3 | C13H16ON5 | CC(C)CC(C)(O)C#Cc1nc(N)c2c(n1)[N]C=N2 |
|
AD01418 | 0.1 | 67.07 | C3H3N2 | C1=CN=C[N]1 |
|
AD01419 | 1.64 | 325.35 | C16H17O2N6 | Nc1nc(NCCc2ccc(CCC(=O)O)cc2)nc2c1N=C[N]2 |
|
AD01420 | 1.99 | 277.11 | C12H10O3N2Cl2 | O=C(O)NCCNC(=O)c1ccc(Cl)cc1Cl |