aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31451 | 0.32 | 199.24 | C7H9O2N3S | COC(=O)CSc1ccc(N)nn1 |
|
AD31452 | 1.24 | 204.59 | C8H6O2N2FCl | COC(=O)c1cc(F)c(Cl)nc1N |
|
AD31453 | 0.89 | 201.61 | C8H8O2N3Cl | CCOC(=O)c1c(N)ncnc1Cl |
|
AD31454 | 0.84 | 197.62 | C9H8ON3Cl | CN1C(=O)Cc2c1cc(Cl)nc2N |
|
AD31455 | 1.21 | 201.66 | C9H12ON3Cl | COCCc1nc(N)c(C)c(Cl)n1 |
|
AD31456 | 1.34 | 193.25 | C10H15ON3 | CCOc1nc(N)nc2c1CCCC2 |
|
AD31457 | 1.08 | 197.63 | C8H8N5Cl | CCn1cnc2c(N)nc(Cl)nc21 |
|
AD31458 | 0.09 | 189.17 | C9H7O2N3 | Nc1ncccc1N1C(=O)C=CC1=O |
|
AD31459 | 0.83 | 194.23 | C10H14O2N2 | CON(C)C(=O)Cc1ccc(N)cc1 |
|
AD31460 | 0.41 | 200.63 | C8H9ON4Cl | CN(C)C(=O)c1cc(Cl)nc(N)n1 |