aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD28861 | -0.3 | 193.27 | C7H15O3NS | O=S(=O)(CC1CCC1)NCCO |
|
AD28862 | 1.12 | 172.13 | C7H6ON2F2 | NC(=O)c1ccnc(C(F)F)c1 |
|
AD28863 | -1.0 | 198.23 | C8H14O2N4 | Cc1nc(C)n(CC(=O)NCCO)n1 |
|
AD28864 | -0.01 | 182.22 | C9H14O2N2 | O=C(CCn1cccc1)NCCO |
|
AD28865 | -0.28 | 167.17 | C7H9O2N3 | CC(=O)c1nc(C(N)=O)cn1C |
|
AD28866 | 0.25 | 165.2 | C8H11ON3 | CN(C)c1cncc(C(N)=O)c1 |
|
AD28867 | 0.56 | 192.16 | C7H6O2N5 | COC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD28868 | 0.7 | 210.15 | C7H5O2N5F | COC(=O)Nc1nc(F)nc2c1N=C[N]2 |
|
AD28869 | -0.18 | 209.17 | C7H7O3N5 | COC(=O)Nc1ncnc2[nH]c(=O)[nH]c12 |
|
AD28870 | -0.7 | 183.21 | C8H13O2N3 | Cc1ccnn1CC(=O)NCCO |