aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09641 | 2.11 | 298.37 | C16H20ON5 | CCNc1nc(C#CC(O)C2CCCCC2)nc2c1N=C[N]2 |
|
AD09642 | 0.31 | 248.26 | C11H8O3N2S | O=C1NC(=S)NC(=O)C1=Cc1cccc(O)c1 |
|
AD09643 | 3.09 | 1433.78 | C68H96O16N12S3 | CCC(C)C(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)C(=O)NS(=O)(=O)OC |
|
AD09644 | 0.95 | 396.24 | C9H9O2N4S2I | NS(=O)(=O)c1ccc(-n2nnc(CS)c2I)cc1 |
|
AD09645 | 11.06 | 616.97 | C39H68O5 | CCC=CCC=CCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC=CCCCCCCCC |
|
AD09646 | 0.79 | 295.29 | C13H11ON8 | Nc1nc(OCCn2nnc3ccccc32)nc2c1N=C[N]2 |
|
AD09647 | 4.31 | 462.48 | C23H31O6N2P | COP(=O)(NC(C)C(=O)OC(C)c1ccccc1)NC(C)C(=O)OC(C)c1ccccc1 |
|
AD09648 | 3.19 | 434.43 | C21H27O6N2P | COP(=O)(NCCC(=O)OCc1ccccc1)NCCC(=O)OCc1ccccc1 |
|
AD09649 | 3.25 | 401.4 | C18H28O7NP | CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1CCC(=O)OC(C)C |
|
AD09650 | 1.8 | 208.21 | C11H12O4 | COc1ccc(C=CC(=O)O)cc1OC |