aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12761 | 1.85 | 561.41 | C25H22O13P | COc1cc(C2Oc3cc(C4Oc5cc(O)cc(O)c5C(=O)C4O)ccc3OC2COP(=O)([O-])O)ccc1O |
|
AD12762 | 1.59 | 351.44 | C18H23N8 | Nc1nc(NCCCN2CCN(c3ccccc3)CC2)nc2c1N=C[N]2 |
|
AD12763 | 2.51 | 406.3 | C19H19N8Cl2 | Nc1nc(NCCN2CCN(c3ccc(Cl)c(Cl)c3)CC2)nc2c1N=C[N]2 |
|
AD12764 | 3.21 | 301.27 | C16H13O6 | COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)ccc1O |
|
AD12765 | 0.93 | 204.21 | C9H10ON5 | C1=Nc2c(ncnc2NC2CCCO2)[N]1 |
|
AD12766 | 2.22 | 405.41 | C18H20N8F3 | Nc1nc(NCCN2CCN(c3ccccc3C(F)(F)F)CC2)nc2c1N=C[N]2 |
|
AD12767 | 0.5 | 140.07 | C3H9O4P | CC(C)OP(=O)(O)O |
|
AD12768 | -0.82 | 127.08 | C3H3O2N4 | NC1=C(C(=O)O)N=N[N]1 |
|
AD12769 | 0.49 | 212.19 | C10H6ON5 | O=c1[nH]cnc2c1N=C(c1ccncc1)[N]2 |
|
AD12770 | 2.24 | 288.72 | C14H11ON5Cl | Nc1nc(OCCc2ccc(Cl)cc2)nc2c1N=C[N]2 |