aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35051 | -0.04 | 207.3 | C11H19N4 | CC(C)Nc1ncnc2c1CC[NH2+]CC2 |
|
AD35052 | 0.69 | 211.37 | C13H27N2 | CC[NH+]1CCC(CC2CCNCC2)CC1 |
|
AD35053 | -0.07 | 223.3 | C11H19ON4 | COc1cc(C)nc(NC2CC[NH2+]CC2)n1 |
|
AD35054 | -0.01 | 220.34 | C13H22N3 | CC[NH+]1CCN(Cc2ccc(N)cc2)CC1 |
|
AD35055 | -0.08 | 217.09 | C7H11N3Br | [NH3+]CCN=c1ccc(Br)c[nH]1 |
|
AD35056 | -0.2 | 201.27 | C8H13O2N2S | CS(=O)(=O)Nc1ccc(C[NH3+])cc1 |
|
AD35057 | 0.33 | 207.3 | C12H19ON2 | Nc1ccc(OCC[NH+]2CCCC2)cc1 |
|
AD35058 | 0.23 | 208.28 | C11H18ON3 | COc1ccnc(NC2CC[NH2+]CC2)c1 |
|
AD35059 | 0.72 | 206.31 | C12H20N3 | [NH3+]C1CCC(NCc2cccnc2)CC1 |
|
AD35060 | 0.23 | 208.28 | C11H18ON3 | COc1cc(NC2CC[NH2+]CC2)ccn1 |