aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44321 | 3.26 | 312.32 | C17H16O4N2 | CN(C)c1ccc(C=CC(=O)c2cc([N+](=O)[O-])ccc2O)cc1 |
|
AD44322 | 2.91 | 310.35 | C18H18O3N2 | Cc1ccc(OCCN2C(=O)C(=NO)c3cc(C)ccc32)cc1 |
|
AD44323 | 2.91 | 310.35 | C18H18O3N2 | Cc1ccc2c(c1)C(=NO)C(=O)N2CCOc1ccccc1C |
|
AD44324 | 0.79 | 233.29 | C9H15O4NS | COC(=O)C1N(OC(C)=O)CSC1(C)C |
|
AD44325 | 1.21 | 190.15 | C10H6O4 | O=C1C=C(O)C(=O)c2c(O)cccc21 |
|
AD44326 | 1.21 | 190.15 | C10H6O4 | O=C1C(O)=CC(=O)c2c(O)cccc21 |
|
AD44327 | 0.18 | 256.25 | C12H16O6 | C=CC1C(O)OC=C(C(=O)OC)C1C1OCCO1 |
|
AD44328 | 2.27 | 414.25 | C16H14ON8Br | CCCN1C(=NN=C2[N]c3ncnc(N)c3N2)C(=O)c2cc(Br)ccc21 |
|
AD44329 | 1.48 | 204.18 | C11H8O4 | COC1=C(O)C(=O)c2ccccc2C1=O |
|
AD44330 | 1.9 | 188.18 | C11H8O3 | CC1=C(O)C(=O)c2ccccc2C1=O |