aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18701 | 1.37 | 219.24 | C12H13O3N | CNC(=O)C=Cc1ccc(OC(C)=O)cc1 |
|
AD18702 | 3.69 | 366.26 | C16H20O2N3Br | CCCOc1ccc(N)cc1-c1nc(C(C)C)c(Br)c(=O)[nH]1 |
|
AD18703 | 3.0 | 543.74 | C28H47O8S | CC(C)C(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O)COS(=O)(=O)[O-] |
|
AD18704 | 1.64 | 196.2 | C10H12O4 | CC(C)C(=O)c1c(O)cc(O)cc1O |
|
AD18705 | 2.08 | 316.73 | C14H11ON7Cl | COc1ccc(C=NNc2nc(N)c3c(n2)[N]C=N3)cc1Cl |
|
AD18706 | -0.6 | 202.25 | C9H18O3N2 | O=CNCCCCCC(=O)NCCO |
|
AD18707 | 0.45 | 522.55 | C26H34O11 | COC(=O)C12OCC34C(CC5C(C)C=C(O)C(=O)C5(C)C3C(O)C1O)OC(=O)C(OC(=O)CC(C)C)C24 |
|
AD18708 | 1.04 | 254.31 | C11H14O3N2S | O=CNc1cccc(S(=O)(=O)N2CCCC2)c1 |
|
AD18709 | -0.41 | 165.14 | C4H5N8 | NNc1nc(N)c2c(n1)[N]N=N2 |
|
AD18710 | 0.57 | 165.2 | C6H5N4S | Nc1nc(S)c2c(n1)[N]C=C2 |