aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16381 | 9.62 | 825.02 | C43H64O10N6 | CCN(CC)[N+]([O-])=NOc1cc(NCCC(=O)OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)CCC34C)C2(C)C)c([N+](=O)[O-])cc1[N+](=O)[O-] |
|
AD16382 | 2.1 | 292.33 | C15H14N7 | Nc1nc(NCCc2c[nH]c3ccccc23)nc2c1N=C[N]2 |
|
AD16383 | 1.13 | 692.89 | C34H64O12N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCC(=O)NOC)C(C)C(O)C1(C)O |
|
AD16384 | 6.23 | 512.73 | C32H48O5 | CC(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C34OC(=O)C12CC4C |
|
AD16385 | 4.27 | 877.56 | C46H73O9N6Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCCc2cn(CCn3ccc4cc(Cl)ccc43)nn2)C(C)C(O)C1(C)O |
|
AD16386 | 3.6 | 316.35 | C18H20O5 | COc1cc(C=Cc2cc(OC)cc(OC)c2O)cc(OC)c1 |
|
AD16387 | 4.33 | 1028.53 | C56H105O6N11 | CCCCCCCCCCCCCC(=O)NC(CCCCNC(=O)CCCCN1CCCN(Cc2ccc(CN3CCCNCCNCCCNCC3)cc2)CCNCCCNCC1)C(=O)NC(CO)C(=O)O |
|
AD16388 | 1.79 | 164.2 | C10H12O2 | COC(=O)CCc1ccccc1 |
|
AD16389 | 2.71 | 726.91 | C37H62O12N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(=NOCOc2ccccc2OC)C(C)C(O)C1(C)O |
|
AD16390 | 4.81 | 566.18 | C28H52O7N3Cl | CCCCCCCCCCCCCCCCN(C(=O)N(CCCl)N=O)C1OC(CO)C(COC)C(O)C1O |