aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38961 | 1.71 | 293.35 | C16H17N6 | C1=Nc2c(ncnc2N2CCN(Cc3ccccc3)CC2)[N]1 |
|
AD38962 | 1.46 | 315.4 | C16H23ON6 | CC1CN(CC2CCCN2c2ncnc3c2N=C[N]3)CC(C)O1 |
|
AD38963 | 3.05 | 266.39 | C18H22N2 | c1ccc(CNC2CCN(Cc3ccccc3)C2)cc1 |
|
AD38964 | 1.05 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1nc2ccc(Br)cc2[nH]1 |
|
AD38965 | 1.05 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1cc(Br)cc2n[nH]cc12 |
|
AD38966 | 1.05 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1cc(Br)cc2nc[nH]c12 |
|
AD38967 | 0.15 | 299.36 | C15H19ON6 | CN1CCN(c2cccc(NC3=C(C(N)=O)N=C[N]3)c2)CC1 |
|
AD38968 | 0.04 | 114.19 | C6H14N2 | CCN1CCC(N)C1 |
|
AD38969 | 0.67 | 296.35 | C16H18ON5 | NC(=O)C1=C(NC2=CCCN(Cc3ccccc3)C2)[N]C=N1 |
|
AD38970 | 0.15 | 299.36 | C15H19ON6 | CN1CCN(c2ccc(NC3=C(C(N)=O)N=C[N]3)cc2)CC1 |