aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40771 | -2.01 | 208.2 | C8H10O2N5 | [NH3+]Cc1ccnn1-c1c[nH]c(=O)[nH]c1=O |
|
AD40772 | -2.01 | 208.2 | C8H10O2N5 | [NH3+]Cc1cn(-c2c[nH]c(=O)[nH]c2=O)cn1 |
|
AD40773 | -2.52 | 213.22 | C8H13O3N4 | [NH3+]C1COCC1Nc1c[nH]c(=O)[nH]c1=O |
|
AD40774 | -2.42 | 239.25 | C10H15O3N4 | O=c1[nH]cc(NCC23C[NH2+]C(CO2)C3)c(=O)[nH]1 |
|
AD40775 | -2.56 | 239.25 | C10H15O3N4 | O=c1[nH]cc(NC2C[NH2+]C3COCC23)c(=O)[nH]1 |
|
AD40776 | -2.42 | 239.25 | C10H15O3N4 | O=c1[nH]cc(NC2C[NH2+]C3CCOC23)c(=O)[nH]1 |
|
AD40777 | -2.9 | 215.23 | C8H15O3N4 | [NH3+]CCN(CCO)c1c[nH]c(=O)[nH]c1=O |
|
AD40778 | -2.12 | 197.22 | C8H13O2N4 | [NH3+]C1CCN(c2c[nH]c(=O)[nH]c2=O)C1 |
|
AD40779 | -1.97 | 222.23 | C9H12O2N5 | [NH3+]CCc1nccn1-c1c[nH]c(=O)[nH]c1=O |
|
AD40780 | -1.97 | 131.2 | C6H15ON2 | NCC1(O)CCC[NH2+]C1 |