aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD04771 | 4.54 | 891.16 | C49H74O9N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(Cc2ccc(-c3cn(CCc4cn(C)c5ccccc45)nn3)cc2)C(C)C(O)C1(C)O |
|
AD04772 | -0.41 | 360.37 | C16H20O4N6 | CN1C=C(COC(=O)c2cccc(C(=O)OCC3=CN(C)NN3)c2)NN1 |
|
AD04773 | 2.86 | 188.23 | C12H12O2 | COc1ccc(OC)c2ccccc12 |
|
AD04774 | 4.55 | 259.71 | C16H11NFCl | Fc1cc2c(Cc3ccccc3)c[nH]c2cc1Cl |
|
AD04775 | 2.52 | 302.28 | C16H14O6 | COc1cc(C2CC(=O)c3c(O)cc(O)cc3O2)ccc1O |
|
AD04776 | 1.55 | 139.17 | C8H10NF | CNCc1cccc(F)c1 |
|
AD04777 | 6.98 | 694.95 | C42H62O8 | CCC1=CC(CO)CC(C)C(O)C(C)CCCC2(C)C=C(C)C(C)CC23OC(=O)C(=C3O)C(=O)C2(CC)C1C(C)=CC1C(O)CC(=O)C(C)C12 |
|
AD04778 | 3.01 | 337.27 | C15H16O6NP | CNC(=O)OC(c1cccc(Oc2ccccc2)c1)P(=O)(O)O |
|
AD04779 | 1.8 | 189.14 | C8H6ONF3 | NC(=O)c1ccc(C(F)(F)F)cc1 |
|
AD04780 | 2.78 | 298.35 | C15H12O2N3S | COC(=O)c1ccc(CSc2ncnc3c2C=C[N]3)cc1 |