aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14201 | 1.61 | 206.06 | C5H4ONSBr | NC(=O)c1sccc1Br |
|
AD14202 | 1.61 | 206.06 | C5H4ONSBr | NC(=O)c1ccc(Br)s1 |
|
AD14203 | 2.92 | 370.36 | C20H18O7 | Oc1cc2c(cc1C1OCC3C(c4ccc5c(c4)OCO5)OCC13)OCO2 |
|
AD14204 | 1.59 | 193.29 | C12H19ON | OCCNCCCCc1ccccc1 |
|
AD14205 | 2.77 | 345.33 | C15H24O6NP | CCOCCC(NP(=O)(OC)Oc1ccccc1)C(=O)OCC |
|
AD14206 | 0.69 | 370.41 | C19H22O4N4 | C#CCCNC(=O)COc1ccc(CCCON=c2cc[nH]c(=O)[nH]2)cc1 |
|
AD14207 | -0.37 | 136.13 | C7H6O2N | Nc1ccc(C(=O)[O-])cc1 |
|
AD14208 | 0.57 | 243.25 | C10H11N8 | CCc1cn(-c2nc3c(c(NC)n2)N=C[N]3)nn1 |
|
AD14209 | -5.87 | 479.53 | C19H37O9N5 | CNC1C(O)OC2CC(N)C(OC3C(N)CC(NC(=O)C(O)CCN)C(O)C3O)OC2C1O |
|
AD14210 | 4.37 | 922.13 | C48H71O11N7 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(Cc2ccc(-c3cn(CCn4ccc5cc([N+](=O)[O-])ccc54)nn3)cc2)C(C)C(O)C1(C)O |