aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39631 | 2.21 | 292.37 | C10H10N7S2 | CCCNc1nnc(Sc2ncnc3c2N=C[N]3)s1 |
|
AD39632 | 1.83 | 296.31 | C15H14O2N5 | COC(=O)c1ccc(CCNc2ncnc3c2N=C[N]3)cc1 |
|
AD39633 | 2.09 | 264.32 | C14H20O3N2 | CN(C(=O)OC(C)(C)C)c1ccc(CC(N)=O)cc1 |
|
AD39634 | 2.31 | 267.35 | C13H17O3NS | CC1(C)OCC(C(=O)Nc2ccc(S)cc2)CO1 |
|
AD39635 | 2.45 | 274.32 | C15H18O3N2 | CC(C)(C)OC(=O)n1cc(CC(N)=O)c2ccccc21 |
|
AD39636 | 1.42 | 295.33 | C15H15ON6 | Oc1cccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)c1 |
|
AD39637 | 1.9 | 311.35 | C13H11N8S | Cc1nc2nc(Sc3ncnc4c3N=C[N]4)nn2c(C)c1C |
|
AD39638 | 0.31 | 296.06 | C7H9O3N2I | Cc1nc(I)oc1C(=O)NCCO |
|
AD39639 | 1.75 | 270.53 | C7H5O2NClSBr | NS(=O)(=O)c1ccc(Br)cc1Cl |
|
AD39640 | 2.28 | 278.53 | C10H9O2NClBr | Cc1cc(Br)cc(Cl)c1OCC(N)=O |