aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32101 | 0.45 | 207.28 | C11H17ON3 | N#CCCCN1CCC2CN(C=O)CC21 |
|
AD32102 | 0.45 | 207.28 | C11H17ON3 | N#CCCCCN1CC2(CN(C=O)C2)C1 |
|
AD32103 | -0.01 | 206.2 | C10H10O3N2 | N#Cc1cc(C(=O)NCCO)ccc1O |
|
AD32104 | -0.01 | 206.2 | C10H10O3N2 | N#Cc1cccc(C(=O)NCCO)c1O |
|
AD32105 | -0.01 | 206.2 | C10H10O3N2 | N#Cc1ccc(C(=O)NCCO)c(O)c1 |
|
AD32106 | 1.26 | 208.3 | C12H20ON2 | C=CCCCCN1CC2(CCN2C=O)C1 |
|
AD32107 | 0.63 | 201.29 | C10H21O2N2 | CC(C)(C)OC(=O)N1CCCC([NH3+])C1 |
|
AD32108 | 0.29 | 192.29 | C11H18N3 | [NH3+]C1CCN(Cc2ccncc2)CC1 |
|
AD32109 | -0.71 | 207.3 | C12H19ON2 | C#CCCC[NH+]1CCC2C1CCN2C=O |
|
AD32110 | -0.85 | 207.3 | C12H19ON2 | C#CCCC[NH+]1CCC2CN(C=O)CC21 |