aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21601 | 2.24 | 264.28 | C14H16O5 | CC=CCCC1Cc2c(O)c(O)cc(O)c2C(=O)O1 |
|
AD21602 | 5.02 | 507.72 | C31H45O3N3 | COc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)C(=O)NCCN(C)C)cc2)c(C(C)C)c1 |
|
AD21603 | 7.46 | 1417.21 | C72H55O20N7Cl2S | O=C1NC2C(=O)NC3c4cc(c(O)c(c4)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC3O)c3ccc(O)c(c3)-c3c(O)cc(O)cc3C(C(=O)O)NC4=O)Oc3ccc(cc3Cl)CC1NC(=O)C(NS(=O)(=O)c1ccc(-c3ccccc3)cc1)c1ccc(O)c(c1)Oc1cc(O)cc2c1 |
|
AD21604 | 2.05 | 268.32 | C14H16N6 | CNc1nc(NCCc2ccccc2)nc2[nH]cnc12 |
|
AD21605 | 1.06 | 240.28 | C12H17O2N2F | CN(CCC(N)C(=O)O)Cc1ccc(F)cc1 |
|
AD21606 | 2.07 | 272.35 | C16H20O2N2 | CN(CCC(N)C(=O)O)Cc1ccc2ccccc2c1 |
|
AD21607 | 7.44 | 704.55 | C36H33O7N3F2Cl2 | COc1cc(C(=O)OC(C)OC(=O)O)ccc1NC(=O)C1NC(CC(C)(C)C)C(C#N)(c2ccc(Cl)cc2F)C1c1cccc(Cl)c1F |
|
AD21608 | 4.01 | 274.75 | C17H15O2Cl | Cc1ccc(Cc2ccc3c(c2Cl)OCCO3)cc1 |
|
AD21609 | 0.24 | 229.26 | C9H11O4NS | COS(=O)(=O)NC(=O)Cc1ccccc1 |
|
AD21610 | 2.96 | 374.43 | C21H26O6 | COc1ccc(CCC(CC(O)CCc2ccc(O)c(O)c2)OC=O)cc1 |