aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41421 | 2.01 | 291.31 | C16H13ON5 | Cn1c2ccccc2c2c1cc(C(N)=O)n2-c1ncccn1 |
|
AD41422 | 1.05 | 319.39 | C14H17O2N5S | Cc1ccc(N2CCCc3sc(C(=O)NCCO)nc32)nn1 |
|
AD41423 | 2.28 | 299.36 | C14H13ON5S | Cc1cc(C)n2nc(C(=O)Nc3ccc(S)cc3)nc2n1 |
|
AD41424 | 1.98 | 300.34 | C15H12O3N2S | NC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12 |
|
AD41425 | 0.79 | 331.35 | C16H13O5NS | O=C(NCCO)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O |
|
AD41426 | 0.42 | 310.35 | C14H22O4N4 | CC(C)(C)OC(=O)N1CCc2c(n[nH]c2C(=O)NCCO)C1 |
|
AD41427 | 1.0 | 345.38 | C16H15O4N3S | O=C(NCCO)c1cc2cccnc2n1S(=O)(=O)c1ccccc1 |
|
AD41428 | 1.89 | 305.38 | C13H11O2N3S2 | O=C(Nc1ccc(S)cc1)c1cnc2n(c1=O)CCS2 |
|
AD41429 | 0.47 | 304.3 | C15H16O5N2 | CCn1cc(C(=O)NCCO)c(=O)c2cc3c(cc21)OCO3 |
|
AD41430 | 1.11 | 309.33 | C17H15O3N3 | O=C(NCCO)c1nn(-c2ccccc2)c(=O)c2ccccc12 |