aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22571 | 4.47 | 316.35 | C19H18O2F2 | FC(F)c1c(Cc2ccc3c(c2)OCCO3)ccc2c1CCC2 |
|
AD22572 | 4.65 | 302.8 | C19H19O2Cl | CCOc1ccc(Cc2ccc3c(c2Cl)OC(C)C3)cc1 |
|
AD22573 | 4.13 | 303.79 | C18H18O2NCl | CCOc1ccc(Cc2ccc3c(c2Cl)NCCO3)cc1 |
|
AD22574 | 4.8 | 314.81 | C20H19O2Cl | Clc1c(Cc2ccc(OC3CCC3)cc2)ccc2c1OCC2 |
|
AD22575 | 8.17 | 1714.63 | C83H82O24N10Cl2S2 | CCCCSC1=C(SCCCC)C(=O)N(CCOCCOCCOCCOCc2cn(C3C(=O)NC4Cc5ccc(c(Cl)c5)Oc5cc6cc(c5O)Oc5ccc(cc5Cl)C(O)C5NC(=O)C(NC(O)C6NC(=O)C(NC4=O)c4cc(O)cc(c4)Oc4cc3ccc4O)c3ccc(O)c(c3)-c3c(O)cc(O)cc3C(C(=O)O)NC5=O)nn2)C1=O |
|
AD22576 | 3.4 | 318.38 | C20H18O2N2 | CNC(=O)c1ccc2c3c([nH]c2c1)C(C)(C)c1ccccc1C3=O |
|
AD22577 | 4.16 | 444.51 | C25H20O4N2S | CC1(C)c2ccccc2C(=O)c2c1[nH]c1cc(C(=O)NS(=O)(=O)c3ccccc3)ccc21 |
|
AD22578 | 0.12 | 858.05 | C38H71O11N11 | CC(C)C(NC(=O)NC(C(=O)NC(C(=O)NCCCNC(CO)C(=O)O)C(OC(=O)CCCCCCCCCCCCN(O)C(=N)N)C(C)C)C1CCNC(=N)N1)C(=O)O |
|
AD22579 | 0.88 | 199.25 | C10H17O3N | C=CC(=O)NC(CC(C)C)C(=O)OC |
|
AD22580 | 2.24 | 336.47 | C20H32O4 | CC1C2CC(O)C(C)(C)C23OC12CCC1CC2(CC3O)CC1(C)O |