aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19581 | 0.53 | 198.27 | C10H18O2N2 | CCC(=O)NCCCN1CCCC1=O |
|
AD19582 | 0.55 | 378.38 | C19H22O8 | COc1cc(C=CC(=O)OC2CC(O)(CO)C3C(O)OC=CC23)ccc1O |
|
AD19583 | 4.03 | 837.95 | C41H66O9N4Cl2S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2cc(Cl)cc(Cl)c2)C(C)C(O)C1(C)O |
|
AD19584 | 4.24 | 518.69 | C30H46O7 | CC1(C(=O)O)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C(=O)O)CC1O |
|
AD19585 | 3.14 | 823.03 | C39H65O9N4F3S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2ccc(F)c(F)c2F)C(C)C(O)C1(C)O |
|
AD19586 | 2.87 | 317.35 | C13H20O4NPS | COP(=S)(NC(C)C(=O)OC(C)C)Oc1ccccc1 |
|
AD19587 | 1.58 | 318.38 | C16H22O3N4 | O=C(CCCCCn1cc(CO)nn1)NOCc1ccccc1 |
|
AD19588 | 1.2 | 174.2 | C10H10ON2 | NC(=O)Cc1c[nH]c2ccccc12 |
|
AD19589 | -0.28 | 89.14 | C4H11ON | NCCCCO |
|
AD19590 | 4.27 | 536.61 | C28H28O7N2S | COC(=O)CCCCCNC(=S)Nc1ccc(C2c3ccc(O)cc3OC3=CC(=O)C=CC32)c(C(=O)O)c1 |