aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17311 | -0.89 | 128.05 | C3H3ON3P | NC(=O)C1=N[N]C=P1 |
|
AD17312 | 2.41 | 191.27 | C12H17ON | COCC=Cc1ccc(N(C)C)cc1 |
|
AD17313 | 4.73 | 398.53 | C23H32O3N3 | CC12CCC3C(CCC4C(C)(C(=O)OCC5=C[N]N=N5)CCCC34C)(CC1=O)C2 |
|
AD17314 | 2.45 | 279.28 | C15H11O2N4 | COc1nc(N)nc2c1C(c1cc3ccccc3o1)=C[N]2 |
|
AD17315 | 3.17 | 248.27 | C15H10ON3 | Cc1ncnc2c1C(c1cc3ccccc3o1)=C[N]2 |
|
AD17316 | 1.77 | 245.29 | C11H9ON4S | COc1nc(N)nc2c1C(c1ccsc1)=C[N]2 |
|
AD17317 | 1.92 | 204.22 | C12H12O3 | OCCOc1ccc2cc(O)ccc2c1 |
|
AD17318 | 2.16 | 223.26 | C13H11N4 | CNc1ncnc2c1C(c1ccccc1)=C[N]2 |
|
AD17319 | -6.0 | 436.46 | C17H32O9N4 | NCC1OC2OC3C(N)CC(N)C(O)C3OC3OC(CNC2C(O)C1O)C(O)C3O |
|
AD17320 | 2.84 | 531.73 | C27H47O8S | CC(C)C(O)CCC(C)C1CC(OS(=O)(=O)[O-])C2C3C(O)C(O)C4CC(O)CCC4(C)C3CCC12C |