aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14021 | 5.77 | 560.45 | C26H30O6N3Br | COC(=O)CCCCCCCCCCNC(=O)c1ccc([N+](=O)[O-])c2[nH]c3cc(Br)ccc3c(=O)c12 |
|
AD14022 | 2.96 | 322.45 | C19H30O4 | CC1(C(=O)O)CCCC2(C)C3CCC4(O)CC3(CCC12)CC4O |
|
AD14023 | 0.48 | 101.15 | C5H11ON | CCN(C=O)CC |
|
AD14024 | -1.63 | 241.27 | C7H15O6NS | COS(=O)(=O)NC(=O)C(O)C(O)C(C)C |
|
AD14025 | 3.13 | 474.64 | C28H42O6 | CC1=C(CO)CC(C(C)C2CCC3C4CC=C5CC(O)CC(O)C5(CO)C4CCC23C)OC1=O |
|
AD14026 | -0.85 | 217.22 | C8H15O4N3 | COC1CC(O)OC(C)C1=NNC(N)=O |
|
AD14027 | 2.72 | 390.52 | C23H34O5 | CC12CCC(O)CC1CCC1(O)C2CCC2(C)C(C3=CC(=O)OC3)CCC21O |
|
AD14028 | -0.49 | 425.87 | C17H28O8N3Cl | COCC1C(CO)OC(N(CC2CCCO2)C(=O)N(CCCl)N=O)C(O)C1O |
|
AD14029 | 8.49 | 915.97 | C54H46O10N3F | O=C(CCCCCNC(=O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)NCC#Cc1ccc(N2C(=O)C(CCC(O)c3ccc(F)cc3)C2c2ccc(O)cc2)cc1 |
|
AD14030 | 2.79 | 253.19 | C11H12O4NP | COP1(=O)OCCC(c2cccc(C#N)c2)O1 |