aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21401 | 0.37 | 273.34 | C15H19O2N3 | CC(C#Cc1cccc(C(N)=O)c1)CCC(N)C(N)=O |
|
AD21402 | 7.23 | 456.71 | C30H48O3 | CC1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCCC(C)(C)C5CCC43C)C2C1(C)O |
|
AD21403 | 2.8 | 287.22 | C14H6N4F3 | FC(F)(F)c1ccccc1C#Cc1ncnc2c1N=C[N]2 |
|
AD21404 | 0.56 | 233.25 | C10H13ON6 | Nc1nc(NCC2CCCO2)nc2c1N=C[N]2 |
|
AD21405 | 0.35 | 543.59 | C24H33O6N9 | OCCCn1cc(COc2cc(OCc3cnnn3CCCO)cc(OCc3cnnn3CCCO)c2)nn1 |
|
AD21406 | -0.58 | 392.47 | C16H28O7N2S | COC(=O)CCC(=O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCS |
|
AD21407 | 5.01 | 311.69 | C16H9ONF3Cl | Oc1ccc(-n2ccc3cc(C(F)(F)F)ccc32)cc1Cl |
|
AD21408 | 3.02 | 322.42 | C17H16N5S | SC(CNc1ncnc2c1C(c1ccccc1)=C[N]2)=NC1CC1 |
|
AD21409 | 1.65 | 214.22 | C12H10O2N2 | NC(=O)NC(=O)c1ccc2ccccc2c1 |
|
AD21410 | 2.71 | 496.47 | C26H24O10 | O=C(CC(O)(CC(=O)OCc1ccc(O)cc1)C(=O)Oc1ccc(O)cc1)OCc1ccc(O)cc1 |