aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36351 | -0.51 | 276.34 | C13H20ON6 | CC1(C)C[NH+](CCNc2ncnc3c2N=C[N]3)CCO1 |
|
AD36352 | -2.42 | 92.12 | C3H10O2N | [NH3+]CC(O)CO |
|
AD36353 | -1.16 | 211.29 | C10H19ON4 | OCCn1cc(C[NH+]2CCCCC2)nn1 |
|
AD36354 | -0.22 | 245.3 | C11H21O4N2 | COC(=O)C1CC([NH3+])CN1C(=O)OC(C)(C)C |
|
AD36355 | -0.87 | 276.34 | C13H20ON6 | CC(C[NH+]1CCOCC1)N(C)c1ncnc2c1N=C[N]2 |
|
AD36356 | -0.51 | 276.34 | C13H20ON6 | COCC[NH+]1CCCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD36357 | -0.45 | 244.32 | C13H18N5 | C[NH+]1CCN(c2nc3ccccc3nc2N)CC1 |
|
AD36358 | -0.76 | 274.33 | C13H18ON6 | C1=Nc2c(ncnc2NCC2C[NH+]3CCCC3CO2)[N]1 |
|
AD36359 | -1.69 | 265.33 | C14H21O3N2 | O=C(NCCO)C1C(O)CC[NH+]1Cc1ccccc1 |
|
AD36360 | -0.46 | 225.36 | C13H25ON2 | COCC1C[NH+](CC2CC2)CC12CCNC2 |