aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19511 | 3.76 | 323.31 | C17H16O2NF3 | CC(=O)NCCc1ccc(O)cc1-c1cccc(C(F)(F)F)c1 |
|
AD19512 | 5.05 | 385.39 | C22H18O2NF3 | O=C(NCCc1ccc(O)cc1-c1cccc(C(F)(F)F)c1)c1ccccc1 |
|
AD19513 | 0.29 | 215.23 | C8H9O4NS | CNS(=O)(=O)c1cccc(C(=O)O)c1 |
|
AD19514 | 3.05 | 573.6 | C32H31O9N | COC(=O)C(Cc1ccc2ccccc2c1)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD19515 | -2.45 | 448.46 | C18H26O5N9 | CCC(NC(=O)CO)C(=O)NC(CCC(=O)NCCNc1ncnc2c1N=C[N]2)C(N)=O |
|
AD19516 | -1.2 | 231.25 | C9H17O4N3 | OCCOCCOCCn1cc(CO)nn1 |
|
AD19517 | 5.53 | 590.62 | C31H37O2N5Cl2S | CNC(=O)NCCCCCc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl |
|
AD19518 | -0.52 | 259.69 | C11H14O3N3Cl | CNc1c(NCCCNC(=O)CCl)c(=O)c1=O |
|
AD19519 | 4.64 | 356.81 | C20H17O3N2Cl | Oc1cnccc1CCCOc1cccnc1Oc1cccc(Cl)c1 |
|
AD19520 | 2.69 | 155.28 | C10H21N | CC(N)CCC1CCCCC1 |