aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00471 | 0.32 | 117.19 | C6H15ON | CCN(CC)CCO |
|
AD00472 | -0.03 | 89.09 | C3H7O2N | CNC(=O)OC |
|
AD00473 | 2.12 | 134.18 | C9H10O | C=CCc1ccc(O)cc1 |
|
AD00474 | -0.18 | 115.09 | C4H5O3N | C#CCONC(=O)O |
|
AD00475 | 3.51 | 345.38 | C17H15O5NS | CC(=NOCc1ccsc1)c1c(O)c2ccc(O)c(C)c2oc1=O |
|
AD00476 | 0.59 | 130.22 | C5H10N2S | CSCCC(N)C#N |
|
AD00477 | 2.23 | 475.49 | C23H23O4N8 | CCOC(=O)c1ccc(CNC(=O)c2cnn(-c3nc4c(c(NC5CCCO5)n3)N=C[N]4)c2)cc1 |
|
AD00478 | 5.18 | 488.71 | C30H48O5 | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD00479 | 0.5 | 194.19 | C10H10O4 | C=CC1C2=CCOC(=O)C2=COC1O |
|
AD00480 | 1.47 | 136.15 | C8H8O2 | COC(=O)c1ccccc1 |