aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10331 | 1.52 | 1435.71 | C66H90O18N12S3 | COS(=O)(=O)NC(=O)C(CC(=O)O)NC(=O)C(C)NC(=O)C(CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)CNC(=O)C(NC(=O)C(CCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2)NC(=O)C(CCSC)NC=O)C(C)OC(C)(C)C |
|
AD10332 | 3.55 | 286.33 | C17H18O4 | COC(=O)c1c(CC=C(C)C)c(O)c2ccccc2c1O |
|
AD10333 | 2.31 | 360.39 | C19H21O4N2F | CC1CCc2c(N3CCC(O)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23 |
|
AD10334 | 4.43 | 558.5 | C30H22O11 | O=C1CC(c2ccc(O)c(O)c2)Oc2c1c(O)cc(O)c2C1C(=O)c2c(O)cc(O)cc2OC1c1ccc(O)cc1 |
|
AD10335 | 2.79 | 376.45 | C21H28O6 | COc1cc(CCC(O)CC(O)CCc2ccc(O)c(OC)c2)ccc1O |
|
AD10336 | 5.19 | 349.52 | C20H35O2N3 | CCCCCCCCCCCCCCCC(=O)Nc1cc[nH]c(=O)n1 |
|
AD10337 | 0.71 | 85.15 | C5H11N | CN(C)C1CC1 |
|
AD10338 | 2.7 | 386.49 | C23H30O5 | CC12CCC3C(CCC4=CC(O)CCC43C=O)C1(O)CCC2C1=CC(=O)OC1 |
|
AD10339 | 6.04 | 571.08 | C32H31O3N6Cl | CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccc4)c(Cl)c3)c2cc1NC(=O)C=CCN(C)NC |
|
AD10340 | 0.25 | 413.36 | C21H17O9 | COc1cc([O-])c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)C(O)C(OC)C(C)(O)C3=O |