aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06541 | 6.4 | 1306.29 | C68H55O19N7S | COC(=O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(NC(=O)C(n5cc6ccccc6c5S)c5ccc(O)c(c5)Oc5cc4cc(O)c5C)C(O)c4ccc(cc4)Oc4cc3cc(c4O)Oc3ccc(cc3)C2O)c2ccc(O)c(c2)-c2c(O)cc(O)cc21 |
|
AD06542 | 2.75 | 309.33 | C15H9O2N4S | O=c1oc2ccccc2cc1CSC1=Nc2cncnc2[N]1 |
|
AD06543 | 2.29 | 246.26 | C14H14O4 | Oc1ccc(CCc2ccc(O)cc2O)c(O)c1 |
|
AD06544 | 3.09 | 347.37 | C14H22O5NPS | CCOC(=O)C(CCSC)NP(=O)(OC)Oc1ccccc1 |
|
AD06545 | 2.66 | 340.34 | C18H16O5N2 | Cc1cc(C(=O)Nc2c(O)c3ccc(O)c(C)c3oc2=O)ccc1N |
|
AD06546 | 1.01 | 225.68 | C11H12ON3Cl | O=CN1CCN(c2ccc(Cl)cn2)CC1 |
|
AD06547 | -1.6 | 254.26 | C7H14O6N2S | CCN(CC(=O)NC)C(=O)COS(=O)(=O)O |
|
AD06548 | 1.4 | 280.31 | C15H14ON5 | NC(=O)CCNc1ncnc2c1C(c1ccccc1)=C[N]2 |
|
AD06549 | 2.33 | 312.32 | C17H16O4N2 | OCCn1cc(-c2ccc(O)cc2)c(-c2ccc(O)cc2O)n1 |
|
AD06550 | 1.99 | 345.36 | C14H13O3N6S | O=[N+]([O-])c1ccc(CSc2nc(NCCO)nc3c2N=C[N]3)cc1 |