aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23411 | 6.9 | 675.13 | C37H33O5N4F2Cl | Cc1c(-c2ccc3c(c2)OCCO3)cccc1C(F)(F)Oc1cc(OCc2ccnc(C#N)c2)c(CN2CCCCC2C(N)=O)cc1Cl |
|
AD23412 | 3.59 | 287.79 | C18H18ONCl | CNCc1ccc(Cc2ccc3c(c2Cl)OCC3)cc1 |
|
AD23413 | 2.52 | 257.34 | C15H19ON3 | CC(C)(C)c1ccc(-c2cc(CO)nc(N)n2)cc1 |
|
AD23414 | -0.78 | 114.15 | C5H10ON2 | NC(=O)C1CCCN1 |
|
AD23415 | -0.31 | 150.12 | C5H4ON5 | Cc1nc(C2=N[N]C=N2)no1 |
|
AD23416 | -0.37 | 386.43 | C14H22O5N6S | COC(CCO)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21 |
|
AD23417 | 18.62 | 966.6 | C60H107O4N3S | CCCCCCCCCCCCCCCCCC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(CCCCCCCCCOCc1cn(CCCCCCCCCCCCCCCCSC)nn1)O2 |
|
AD23418 | 4.86 | 280.41 | C20H24O | CCOc1ccc(Cc2ccc3c(c2C)CCCC3)cc1 |
|
AD23419 | 8.8 | 561.85 | C37H55O3N | COc1ccccc1NC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)CC2 |
|
AD23420 | 2.03 | 221.3 | C13H19O2N | CN(CCCC(=O)O)CCc1ccccc1 |