aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11241 | 4.99 | 286.8 | C19H19OCl | CC(C)c1ccc(Cc2ccc3c(c2Cl)OCC3)cc1 |
|
AD11242 | 0.5 | 142.18 | C5H6ON2S | CNC(=O)c1cscn1 |
|
AD11243 | 2.23 | 256.31 | C12H10N5S | Nc1ncnc2c1N=C(SCc1ccccc1)[N]2 |
|
AD11244 | 2.46 | 183.23 | C8H9O2NS | CSCc1ccc([N+](=O)[O-])cc1 |
|
AD11245 | 0.97 | 212.24 | C11H16O4 | C=CC1C(OC)OCC2C(=O)OCCC21 |
|
AD11246 | 2.17 | 246.22 | C13H10O5 | O=C(O)c1cc(O)c(-c2cccc(O)c2)c(O)c1 |
|
AD11247 | 4.28 | 251.42 | C15H29N3 | CCCCCCCCCCCCc1cn(C)nn1 |
|
AD11248 | 3.82 | 866.54 | C45H72O10N5Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2OCCC(=O)NCCNc2ccnc3cc(Cl)ccc23)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD11249 | 1.99 | 219.28 | C13H17O2N | Cc1ccc(OC2CCN(C=O)CC2)cc1 |
|
AD11250 | 2.27 | 277.28 | C14H15O5N | CCON=C(C)c1c(O)oc2c(C)c(O)ccc2c1=O |