aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17501 | 0.97 | 352.47 | C20H32O5 | C=C1C2CCC3CC2(CC3(C)O)C(O)C(O)C2(O)C1CC(O)C2(C)C |
|
AD17502 | -2.57 | 371.44 | C16H29O5N5 | NC1CC=C(C=NN2CCOCC2)OC1OC1C(N)CC(N)C(O)C1O |
|
AD17503 | 2.34 | 254.37 | C15H26O3 | C=CC(C)(O)CCC=C(C)C=CC(O)C(C)(C)O |
|
AD17504 | 4.43 | 365.42 | C23H17ON4 | Nc1ncnc2c1C(c1ccc(COc3cccc4ccccc34)cc1)=C[N]2 |
|
AD17505 | 4.0 | 309.35 | C20H13N4 | Nc1ncnc2c1C(c1cc3ccccc3c3ccccc13)=C[N]2 |
|
AD17506 | 2.83 | 291.31 | C17H13O2N3 | COc1ccc(-n2nc3c4ccccc4[nH]cc-3c2=O)cc1 |
|
AD17507 | 2.89 | 196.21 | C12H8ON2 | c1ccc2cc(-c3ncno3)ccc2c1 |
|
AD17508 | 2.28 | 286.24 | C15H10O6 | O=c1cc(-c2ccccc2O)oc2cc(O)c(O)c(O)c12 |
|
AD17509 | 5.36 | 622.8 | C36H50O7N2 | CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=NOCCCCc2cnc3ccccc3c2)C=CC(C)=CC1CO |
|
AD17510 | 1.67 | 179.22 | C10H13O2N | COC(=O)c1cc(C)c(C)cc1N |