aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09451 | 2.01 | 214.27 | C13H14ON2 | C=CC(=O)NCCc1c[nH]c2ccccc12 |
|
AD09452 | 2.62 | 670.72 | C37H38O10N2 | COC(=O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD09453 | 3.02 | 335.21 | C12H9N5SBr | Nc1nc2c(c(SCc3ccc(Br)cc3)n1)N=C[N]2 |
|
AD09454 | 5.1 | 478.71 | C29H50O5 | CC(=O)OCC(C)CCCC(C)C1CCC2C3CC(O)C4(O)CC(O)CCC4(C)C3CCC12C |
|
AD09455 | 1.29 | 179.23 | C7H7N4S | CSc1cc(N)nc2c1N=C[N]2 |
|
AD09456 | 3.3 | 401.85 | C22H20O5NCl | CN1CCC(c2c(O)cc(O)c3c(=O)cc(-c4ccccc4Cl)oc23)C(O)C1 |
|
AD09457 | 0.96 | 347.45 | C17H33O6N | CCCCCCOC(CNC1(C)CC(O)OC(C)C1O)C(=O)OC |
|
AD09458 | 5.17 | 1473.25 | C72H67O23N9Cl2 | COCCOCCOCCOCCOCc1cn(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)nn1 |
|
AD09459 | 11.59 | 1569.56 | C80H79O20N7Cl2S2 | CCCCCCCCSC1=C(SCCCCCCCC)C(=O)N(C2C(=O)NC3Cc4ccc(c(Cl)c4)Oc4cc5cc(c4O)Oc4ccc(cc4Cl)C(O)C4NC(=O)C(NC(O)C5NC(=O)C(NC3=O)c3cc(O)cc(c3)Oc3cc2ccc3O)c2ccc(O)c(c2)-c2c(O)cc(O)cc2C(C(=O)O)NC4=O)C1=O |
|
AD09460 | 2.06 | 298.33 | C15H16O2N5 | COc1ccc(CCNc2ncnc3c2N=C[N]3)cc1OC |