aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30771 | 0.18 | 130.21 | C7H16ON | CC1CC([NH3+])CC(C)O1 |
|
AD30772 | -0.37 | 206.2 | C10H10O3N2 | O=C(NCCO)C1=Cc2cccn2C1=O |
|
AD30773 | -0.26 | 210.23 | C10H14O3N2 | COc1ccc(CC(=O)NCCO)cn1 |
|
AD30774 | 0.61 | 192.22 | C10H12O2N2 | COc1ccnc(C2(C(N)=O)CC2)c1 |
|
AD30775 | 0.61 | 192.22 | C10H12O2N2 | COc1cccnc1C1(C(N)=O)CC1 |
|
AD30776 | -0.38 | 207.23 | C10H13O2N3 | O=C(NCCO)C1(c2cnccn2)CC1 |
|
AD30777 | -0.45 | 209.25 | C10H15O2N3 | O=C(NCCO)C1CCc2nccn2C1 |
|
AD30778 | 0.61 | 192.22 | C10H12O2N2 | COc1cccc(C2(C(N)=O)CC2)n1 |
|
AD30779 | -0.14 | 209.25 | C10H15O2N3 | CC(C)(C(=O)NCCO)c1cnccn1 |
|
AD30780 | -0.38 | 207.23 | C10H13O2N3 | O=C(NCCO)C1(c2ncccn2)CC1 |