aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40421 | -1.74 | 116.14 | C4H10ON3 | [NH3+]C1CCNC(=O)N1 |
|
AD40422 | -1.34 | 274.04 | C2H13O9P3 | CO[PH](O)(O)O[PH](O)(O)CP(=O)(O)O |
|
AD40423 | -0.54 | 315.31 | C12H18O4N5F | NC(=O)NCCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O |
|
AD40424 | -4.87 | 321.44 | C14H33O4N4 | CC[NH2+]C1CC(N)C(OC2OC(C[NH3+])CCC2[NH3+])C(O)C1O |
|
AD40425 | 0.12 | 298.25 | C13H14O8 | O=C(O)CC(O)(CC(=O)OCc1ccc(O)cc1)C(=O)O |
|
AD40426 | -0.92 | 210.06 | C2H12O7P2 | CO[PH](O)(O)O[PH](O)(O)OC |
|
AD40427 | -2.19 | 270.11 | C4H16O9P2 | CO[PH](O)(O)O[PH](O)(O)OCC(O)CO |
|
AD40428 | 0.74 | 306.28 | C13H12ON6F2 | OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F |
|
AD40429 | -0.82 | 98.11 | C4H6ON2 | O=C1C=CNCN1 |
|
AD40430 | 0.42 | 316.33 | C13H16O7S | COC(=O)C1=COC(O)C2C(COC(=O)SC)=CC(O)C12 |