aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42141 | 1.27 | 285.42 | C17H25N4 | Cc1cc(N)n(CC2CC[NH+](Cc3ccccc3)CC2)n1 |
|
AD42142 | -1.13 | 219.22 | C10H11O2N4 | [NH3+]Cc1cncc(-c2c[nH]c(=O)[nH]c2=O)c1 |
|
AD42143 | -1.59 | 194.21 | C9H12O2N3 | O=c1[nH]cc(C2=CCC[NH2+]C2)c(=O)[nH]1 |
|
AD42144 | -1.59 | 194.21 | C9H12O2N3 | O=c1[nH]cc(C2=CC[NH2+]CC2)c(=O)[nH]1 |
|
AD42145 | -1.96 | 234.24 | C10H12O2N5 | O=c1[nH]cc(-c2cnn(C3C[NH2+]C3)c2)c(=O)[nH]1 |
|
AD42146 | -1.13 | 219.22 | C10H11O2N4 | [NH3+]Cc1cnccc1-c1c[nH]c(=O)[nH]c1=O |
|
AD42147 | -0.15 | 322.38 | C17H24O5N | COC(=O)C1CC([NH2+]CCO)CC1C(=O)OCc1ccccc1 |
|
AD42148 | -0.25 | 309.39 | C16H25O4N2 | COc1ccc(CN2CCC([NH2+]CCO)CC2=O)c(OC)c1 |
|
AD42149 | 1.7 | 300.42 | C16H30O4N | CC(C)(C)OC(=O)C1CCC([NH3+])CC1C(=O)OC(C)(C)C |
|
AD42150 | -0.13 | 317.41 | C15H29O5N2 | CCC1(C(=O)OC)CC([NH2+]CCO)CN1C(=O)OC(C)(C)C |