aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23391 | 0.33 | 555.62 | C24H29O5N9S | CC(=O)Nc1nc(-c2cccc(NC(=O)CCC(=O)NC(Cc3cn(C)nn3)C(=O)NC(C)C(N)=O)c2)cs1 |
|
AD23392 | 0.22 | 290.3 | C10H14O6N2S | COc1ccc(S(=O)(=O)N(C)CCO)c([N+](=O)[O-])c1 |
|
AD23393 | 6.06 | 414.63 | C27H42O3 | CC1(C)CCC2(C(=O)O)CCC3C(=CCC4C3CCC3C4CCC(O)C3(C)C)C2C1 |
|
AD23394 | 3.53 | 492.52 | C25H32O10 | COc1cc(C2OCC3C(c4cc(O)c(OC)c(OC)c4OC)OCC23)c(OC)c(OC)c1OC |
|
AD23395 | -2.01 | 162.07 | C3H5O3N3P | Cn1cc(P(=O)([O-])O)nn1 |
|
AD23396 | -0.47 | 150.12 | C5H4ON5 | Nc1ncnc2c1C(O)=N[N]2 |
|
AD23397 | 1.95 | 261.07 | C9H9O4Br | COC(=O)c1cc(Br)c(O)c(OC)c1 |
|
AD23398 | 1.86 | 247.04 | C8H7O4Br | COc1cc(C(=O)O)cc(Br)c1O |
|
AD23399 | -1.68 | 313.36 | C13H23O4N5 | Cn1cc(CNC(=O)CCNC(=O)C(O)C(C)(C)CO)nn1 |
|
AD23400 | -0.34 | 151.06 | C3H6O4NP | COC(C#N)P(=O)(O)O |