aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39411 | 0.88 | 300.34 | C15H18O2N5 | CCN(CC)C(=O)c1cccc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD39412 | 0.88 | 300.34 | C15H18O2N5 | CCN(CC)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD39413 | 0.64 | 298.33 | C15H16O2N5 | NC(=O)C1=C(Nc2cccc(C(=O)N3CCCC3)c2)[N]C=N1 |
|
AD39414 | 0.58 | 307.36 | C13H15O3N4S | CC(C)S(=O)(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD39415 | 0.19 | 293.33 | C12H13O3N4S | CCS(=O)(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD39416 | 0.4 | 306.35 | C14H20O3N5 | CC(C)(C)OC(=O)N1CC=C(NC2=C(C(N)=O)N=C[N]2)CC1 |
|
AD39417 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1ncc2cc(Br)ccn12 |
|
AD39418 | 0.82 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1cc2cc(Br)ccn2n1 |
|
AD39419 | 2.27 | 270.32 | C13H10ON4S | O=C(Nc1ccc(S)cc1)c1cnc2ccnn2c1 |
|
AD39420 | 0.21 | 285.1 | C9H9O2N4Br | O=C(NCCO)c1cnc2c(Br)cnn2c1 |