aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09461 | 2.54 | 288.74 | C13H7N5ClS | CNc1nc(C#Cc2ccc(Cl)s2)nc2c1N=C[N]2 |
|
AD09462 | 2.08 | 209.25 | C13H11N3 | N#Cc1cnccc1-c1ccc(CN)cc1 |
|
AD09463 | 2.53 | 213.28 | C14H15ON | CCc1ccc(Cc2ccc[nH]c2=O)cc1 |
|
AD09464 | 4.39 | 252.77 | C14H13OClS | CCOc1ccc(Cc2ccsc2Cl)cc1 |
|
AD09465 | 4.21 | 244.36 | C15H16OS | C=CCOc1ccc(Cc2ccsc2C)cc1 |
|
AD09466 | 3.4 | 373.44 | C21H21ON6 | Oc1ccc(CCNc2nc3c(c(NCCc4ccccc4)n2)N=C[N]3)cc1 |
|
AD09467 | 5.3 | 310.21 | C16H9ONCl2S | Clc1ccc(Cc2ncc(-c3ccco3)s2)c(Cl)c1 |
|
AD09468 | 1.59 | 269.29 | C13H13ON6 | COc1ccccc1CNc1nc(N)nc2c1N=C[N]2 |
|
AD09469 | -2.3 | 814.0 | C37H67O11N9 | CC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(C)NC(=O)C(C)NC(=O)C(C)N(C)C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O |
|
AD09470 | 1.05 | 160.18 | C8H8N4 | Nc1ccc(-c2nc[nH]n2)cc1 |