aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36361 | -0.07 | 249.38 | C14H25N4 | CC(C)[NH+]1C(Cn2cccn2)CC2CNCCC21 |
|
AD36362 | -0.77 | 234.32 | C13H20ON3 | c1cncc(COC2CC3CNCC[NH+]3C2)c1 |
|
AD36363 | 0.81 | 246.34 | C13H20N5 | CC1CCNCC1N(C)c1[nH+]cnc2[nH]ccc12 |
|
AD36364 | 0.48 | 246.38 | C15H24N3 | C[NH+](Cc1ccccn1)C1CCCC2CNCC21 |
|
AD36365 | -1.12 | 226.34 | C12H24ON3 | CN(C)C(=O)C[NH+]1CCC2(CCCN2)CC1 |
|
AD36366 | -0.09 | 234.33 | C12H20N5 | c1cc(N2CCNCC2)nc(N2CCCC2)[nH+]1 |
|
AD36367 | -0.65 | 235.31 | C13H19O2N2 | COC(=O)C1(N)CC[NH+](Cc2ccccc2)C1 |
|
AD36368 | -0.02 | 249.33 | C14H21O2N2 | COC(=O)c1cccc(C[NH+]2CCC(N)CC2)c1 |
|
AD36369 | 0.5 | 243.76 | C13H20ON2Cl | COCC[NH+](C)C(CN)c1ccc(Cl)cc1 |
|
AD36370 | -0.53 | 248.35 | C14H22ON3 | COC1CCNC2C[NH+](Cc3cccnc3)CC21 |