aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44461 | 2.19 | 281.36 | C12H11O3NS2 | COc1ccc(OC)c(C=C2SC(=S)NC2=O)c1 |
|
AD44462 | 3.54 | 388.41 | C20H18O2N7 | COc1cc(CN=NC2=Nc3c(N)ncnc3[N]2)ccc1OCc1ccccc1 |
|
AD44463 | 1.87 | 610.64 | C22H48O11N2P2S | CCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)CO[PH](O)(O)O[PH](O)(O)OC |
|
AD44464 | 5.69 | 425.29 | C21H14O5Cl2S | O=C1C=CC(=C(c2ccc(O)c(Cl)c2)c2ccccc2S(O)(O)O)C=C1Cl |
|
AD44465 | 3.26 | 430.12 | C10H3O2N2F13 | O=c1[nH]cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(=O)[nH]1 |
|
AD44466 | 1.17 | 205.24 | C10H7O2NS | NC1=C(S)C(=O)c2ccccc2C1=O |
|
AD44467 | 2.3 | 226.24 | C13H10O2N2 | N=Cc1ccc(OC(=O)c2cccnc2)cc1 |
|
AD44468 | 2.6 | 296.33 | C17H16O3N2 | Cc1ccc(OCCN2C(=O)C(=NO)c3ccccc32)cc1 |
|
AD44469 | 2.32 | 232.28 | C13H16O2N2 | CCCCN1C(=O)C(=NO)c2cc(C)ccc21 |
|
AD44470 | 1.93 | 218.26 | C12H14O2N2 | CCCN1C(=O)C(=NO)c2cc(C)ccc21 |