aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15291 | 3.01 | 300.27 | C16H12O6 | COc1ccc(Oc2cc(=O)c3c(O)cc(O)cc3o2)cc1 |
|
AD15292 | 4.67 | 494.76 | C30H54O5 | CC(C)(O)CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C |
|
AD15293 | 3.29 | 564.55 | C31H24O7N4 | Cc1cc(O)c2c(c1)C1OC(=O)C(COCc3cn(Cc4ccccc4)nn3)N1C1=C2C(=O)c2cccc(O)c2C1=O |
|
AD15294 | 0.57 | 168.56 | C7H3ON3Cl | O=c1nc(Cl)cc2n1C=C[N]2 |
|
AD15295 | 2.62 | 180.25 | C11H16O2 | CCCOc1ccc(COC)cc1 |
|
AD15296 | 3.31 | 428.52 | C24H26ON7 | Nc1nc(N2CCN(c3ccc(OCCCc4ccccc4)cc3)CC2)nc2c1N=C[N]2 |
|
AD15297 | 3.57 | 213.24 | C13H11O2N | Cc1ccc(-c2cccc([N+](=O)[O-])c2)cc1 |
|
AD15298 | 1.34 | 593.64 | C29H35O7N7 | NC(=O)C(CCC(=O)NCCCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12)NC(=O)C1CCCN1C(=O)CO |
|
AD15299 | 5.0 | 284.5 | C12H12S4 | SSCc1cccc2c(CSS)cccc12 |
|
AD15300 | -0.34 | 582.62 | C27H34O7N8 | CC(NC(=O)CO)C(=O)NC(CCC(=O)NCCNCCNc1c2ccccc2nc2cccc([N+](=O)[O-])c12)C(N)=O |