aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31591 | 0.61 | 192.22 | C10H12O2N2 | CN1CCOc2cc(C(N)=O)ccc21 |
|
AD31592 | -0.26 | 191.19 | C9H9O2N3 | Cn1cc(C(N)=O)c(=O)c2cccn21 |
|
AD31593 | -0.91 | 209.21 | C8H11O2N5 | Cc1nc2c(C(=O)NCCO)c[nH]n2n1 |
|
AD31594 | 0.86 | 220.26 | C10H14ON5 | COCCCN(C)c1ncnc2c1N=C[N]2 |
|
AD31595 | 1.4 | 209.64 | C10H8ON3Cl | Cc1c(C(N)=O)nc2cc(Cl)ccn12 |
|
AD31596 | 1.4 | 209.64 | C10H8ON3Cl | Cc1c(C(N)=O)nc2c(Cl)cccn12 |
|
AD31597 | -0.55 | 206.21 | C9H10O2N4 | O=C(NCCO)c1nnc2ccccn12 |
|
AD31598 | 1.5 | 191.23 | C11H13O2N | CC1(C)Cc2c(cccc2C(N)=O)O1 |
|
AD31599 | -0.55 | 206.2 | C9H10O2N4 | O=C(NCCO)c1ccn2ncnc2c1 |
|
AD31600 | 1.4 | 208.24 | C9H8O2N2S | COc1ccc2sc(C(N)=O)nc2c1 |