aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00481 | 0.44 | 173.3 | C9H23N3 | CCC(CCN)NCCCCN |
|
AD00482 | 0.68 | 176.12 | C6H6O2N2F2 | Cc1c[nH]c(=O)nc1OC(F)F |
|
AD00483 | -4.09 | 1451.08 | C67H104O21N13Cl | CCC(C)C=C(C)C=CC(O)C(C)(O)C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC1C(=O)NC(COC)C(=O)NCC(=O)NC(C)C(=O)N(C)C(C(C)O)C(=O)NC(C(OC)c2ccc(O)cc2)C(=O)N2CCC(Cl)CC2C(=O)OC1C(C)C)C(C)C(C)C(N)=O)C(C)N)C(C)O |
|
AD00484 | -0.14 | 147.22 | C7H17O2N | CC(N)CCCC(O)CO |
|
AD00485 | 4.45 | 302.79 | C16H11ON2ClS | CC(=O)c1c(C)[nH]c(=S)c(C#N)c1-c1ccc(Cl)cc1 |
|
AD00486 | 0.69 | 213.02 | C5H3N5Br | Nc1ncnc2c1N=C(Br)[N]2 |
|
AD00487 | 4.54 | 530.7 | C31H46O7 | COC(=O)C1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(=O)C(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD00488 | 0.07 | 171.22 | C9H15O3 | O=C([O-])C(O)CC1CCCCC1 |
|
AD00489 | 0.28 | 116.16 | C6H12O2 | OC1CCCCC1O |
|
AD00490 | 4.45 | 398.59 | C22H42O4N2 | CCCCCCCCCCCCCCCC(=O)N1C(CCN)OCC1C(=O)O |