aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39621 | 1.31 | 309.36 | C15H17N8 | C1=Nc2c(ncnc2N2CCN(c3cc(C4CC4)[nH]n3)CC2)[N]1 |
|
AD39622 | 1.8 | 302.36 | C15H20O2N5 | CCOC(=O)C1(C(C)C)CCN(c2ncnc3c2N=C[N]3)C1 |
|
AD39623 | 0.17 | 291.26 | C14H13O6N | O=C(Cc1cc(=O)oc2cc3c(cc12)OCO3)NCCO |
|
AD39624 | 1.72 | 284.11 | C11H10O3NBr | COc1cc(Br)cc2c1OCC(C(N)=O)=C2 |
|
AD39625 | 0.97 | 314.37 | C15H20ON7 | CC(C)CN1CC2CN(c3ncnc4c3N=C[N]4)CCN2C1=O |
|
AD39626 | 1.8 | 303.37 | C13H15ON6S | COCCN(Cc1scnc1C)c1ncnc2c1N=C[N]2 |
|
AD39627 | 1.2 | 297.35 | C14H17N8 | Cn1nccc1N1CCCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD39628 | 0.56 | 302.37 | C14H26O5N2 | CC(C)(C)OC(=O)NC1(CC(=O)NCCO)CCOCC1 |
|
AD39629 | 0.99 | 298.38 | C15H26O4N2 | CC(C)(C)OC(=O)N1CC2C(C1C(=O)NCCO)C2(C)C |
|
AD39630 | 1.89 | 314.3 | C15H13O2N5F | COC(=O)C(CNc1ncnc2c1N=C[N]2)c1ccc(F)cc1 |