aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11981 | 3.77 | 332.36 | C19H15N5F | Fc1nc2c(c(NCC(c3ccccc3)c3ccccc3)n1)N=C[N]2 |
|
AD11982 | 2.05 | 302.75 | C15H13ON5Cl | OCC(Cc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD11983 | 4.89 | 844.15 | C42H81O10N7 | [N-]=[N+]=NCCCCCCCCCCC(=O)NC(COCCC(=O)NCCCCCCO)(COCCC(=O)NCCCCCCO)COCCC(=O)NCCCCCCO |
|
AD11984 | -0.29 | 440.53 | C23H36O8 | CC12CC(O)C3C(CCC4(O)CC(O)CC(O)C34CO)C1(O)CCC2C1COC(=O)C1 |
|
AD11985 | 1.59 | 312.26 | C13H17O5N2P | COC(=O)C(Cc1c[nH]c2ccccc12)NP(=O)(O)OC |
|
AD11986 | 2.62 | 454.34 | C22H14O11 | O=C(Oc1cc(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c12)c1cc(O)c(O)c(O)c1 |
|
AD11987 | -1.13 | 295.31 | C15H19O6 | O=C([O-])C(Cc1ccccc1)OCC1OCCC(O)C1O |
|
AD11988 | -2.35 | 219.21 | C9H15O6 | CC(OCC1OCCC(O)C1O)C(=O)[O-] |
|
AD11989 | 1.88 | 192.21 | C11H12O3 | COC(=O)C=Cc1ccc(OC)cc1 |
|
AD11990 | 2.89 | 314.29 | C17H14O6 | COc1cc(OC)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1 |