aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23321 | 1.07 | 162.19 | C9H10ON2 | Cn1c(CO)nc2ccccc21 |
|
AD23322 | 5.22 | 612.58 | C32H31O3N5Cl2S | CNC(=O)c1ccc(COc2cc(Cl)c(CN3CSCC3C(=O)N3CCN(C4CC4)c4ccccc43)cc2Cl)nc1 |
|
AD23323 | 6.27 | 470.69 | C30H46O4 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)CCC(=O)C(C)(C)C5CC(O)C43C)C12 |
|
AD23324 | 3.77 | 302.35 | C16H20O3N3 | O=C(O)CCCCCCCOc1cccc(C2=C[N]N=N2)c1 |
|
AD23325 | -0.37 | 238.31 | C8H18O4N2S | CNC(CC(C)C)C(=O)NS(=O)(=O)OC |
|
AD23326 | 1.56 | 541.55 | C28H31O10N | CCC1(O)CC(OC2CC(N)C(O)C(C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1C(=O)OC |
|
AD23327 | 2.18 | 297.31 | C16H15O3N3 | COCc1cn(CC(=O)Oc2cccc3ccccc23)nn1 |
|
AD23328 | 1.53 | 283.29 | C15H13O3N3 | O=C(Cn1cc(CO)nn1)Oc1cccc2ccccc12 |
|
AD23329 | 3.14 | 257.33 | C16H19O2N | CN(CCCC(=O)O)Cc1ccc2ccccc2c1 |
|
AD23330 | 0.72 | 420.5 | C23H32O7 | CC12CCC3C(CCC4CC(O)C(O)CC43C=O)C1(O)CC(O)C2C1=CC(=O)OC1 |