aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18831 | -1.94 | 350.38 | C14H22O3N8 | CNC(=O)C(N)CCCCNC(=O)Cn1cnc2c(=O)[nH]c(N)nc21 |
|
AD18832 | -0.43 | 158.57 | C6H5ON3Cl | NC(=O)C1=CC(CCl)=N[N]1 |
|
AD18833 | 4.52 | 418.45 | C25H22O6 | COc1ccc2ccc(OCC(O)COc3ccc4ccc(C(=O)O)cc4c3)cc2c1 |
|
AD18834 | 3.34 | 334.33 | C20H14O5 | COc1cccc2c1C(=O)c1ccc3cc(C)c(O)c(O)c3c1C2=O |
|
AD18835 | 2.08 | 144.18 | C9H8N2 | c1ccc(-c2c[nH]cn2)cc1 |
|
AD18836 | 2.06 | 244.2 | C13H8O5 | O=c1c2cc(O)ccc2oc2c(O)ccc(O)c12 |
|
AD18837 | 4.8 | 374.57 | C24H38O3 | CC(=O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C |
|
AD18838 | 0.05 | 171.12 | C5H8O2NF3 | O=C(NCCCO)C(F)(F)F |
|
AD18839 | -2.86 | 189.19 | C6H13O3N4 | NC(=NO)NCCCC(N)C(=O)[O-] |
|
AD18840 | 2.23 | 685.9 | C35H63O10N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC3C2OC(=NCCCN(C)C)N3C)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O |