aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21791 | 8.72 | 625.9 | C37H59O5N3 | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCOc1ccc(N=Nc2ccccc2)cc1 |
|
AD21792 | 2.75 | 315.36 | C18H15N6 | Nc1ncnc2c1N=C(NCc1ccccc1-c1ccccc1)[N]2 |
|
AD21793 | -1.47 | 468.14 | C9H15O14N2P3 | O=c1ccn(C2CC(OP(=O)(O)OP(=O)(O)O)C(COP(=O)(O)O)O2)c(=O)[nH]1 |
|
AD21794 | -0.27 | 403.42 | C18H22O3N7F | Nc1nc(O)c2c(n1)[nH]c(=O)n2CC(O)CN1CCN(c2ccc(F)cc2)CC1 |
|
AD21795 | -1.07 | 212.21 | C6H6O2N5S | Nc1nc2c(c(S(N)(=O)=O)n1)C=C[N]2 |
|
AD21796 | 0.58 | 235.33 | C13H21ON3 | CN(C)CCC(N)C(=O)NCc1ccccc1 |
|
AD21797 | -0.65 | 196.22 | C6H6ON5S | C[S+]([O-])C1=N[N]c2ncnc(N)c21 |
|
AD21798 | 1.15 | 203.2 | C11H9O3N | CNC(=O)c1coc2ccccc2c1=O |
|
AD21799 | 0.49 | 218.24 | C10H12ON5 | O=c1[nH]cnc2c1N=C(N1CCCCC1)[N]2 |
|
AD21800 | 1.97 | 238.27 | C13H12N5 | Nc1ncnc2c1N=C(CCc1ccccc1)[N]2 |