aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19631 | 3.02 | 389.35 | C19H13O4N6 | N#CC1=C(N)Oc2cc(OCC3=C[N]N=N3)ccc2C1c1ccc([N+](=O)[O-])cc1 |
|
AD19632 | -1.05 | 169.12 | C5H5O3N4 | CC1=C([N+](=O)[O-])C(C(N)=O)=N[N]1 |
|
AD19633 | 8.19 | 630.89 | C39H55O2N4F | CC1(C)CCC2(C(=O)NCc3cn(-c4ccc(F)cc4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD19634 | 3.17 | 238.24 | C15H10O3 | O=c1cc(-c2ccccc2)oc2cccc(O)c12 |
|
AD19635 | 8.48 | 643.91 | C40H57O4N3 | COc1ccc(-n2cc(COC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C3(C)CC4)nn2)cc1 |
|
AD19636 | -0.65 | 283.99 | C2H7O10P3 | COP(=O)([O-])OP(=O)(O)OP(=O)([O-])OC |
|
AD19637 | 3.4 | 222.29 | C16H14O | COc1ccc(C#Cc2ccc(C)cc2)cc1 |
|
AD19638 | -1.26 | 257.25 | C12H11O2N5 | NC1=NC(=O)C2NC(c3ccccc3)=NC2C(=O)N1 |
|
AD19639 | 4.19 | 239.4 | C15H29ON | CC(C)CCCCCCCCCC=CC(N)=O |
|
AD19640 | 4.67 | 280.34 | C13H29O4P | CCCCCCCCCCCCOP(=O)(O)OC |