aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44051 | -2.32 | 167.17 | C6H9ON5 | C[N+]1=C[N]C2=C1C(O)N=C(N)N2 |
|
AD44052 | -2.32 | 509.24 | C11H22O12N5P3 | CO[PH](O)(O)O[PH](O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(P(=O)(O)O)C1O |
|
AD44053 | -2.04 | 358.01 | CH14O13P4 | CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OP(=O)(O)O |
|
AD44054 | -1.5 | 292.05 | C2H15O10P3 | CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC |
|
AD44055 | -1.34 | 274.04 | C2H13O9P3 | CO[PH](O)(O)C[PH](O)(O)OP(=O)(O)O |
|
AD44056 | -0.1 | 344.43 | C20H26O4N | Oc1ccc2c3c1OC1C(O)CCC4(O)C(C2)[NH+](CC2CC2)CCC314 |
|
AD44057 | -1.8 | 542.44 | C15H32O13N2P2S | CO[PH](O)(O)O[PH](O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)O |
|
AD44058 | -1.55 | 556.46 | C16H34O13N2P2S | CO[PH](O)(O)O[PH](O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)C(C)C(=O)O |
|
AD44059 | -2.09 | 374.05 | C2H18O13P4 | CO[PH](O)(O)O[PH](O)(O)O[PH](O)(O)O[PH](O)(O)OC |
|
AD44060 | -1.26 | 498.43 | C14H32O11N2P2S | CO[PH](O)(O)O[PH](O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(C)=O |