aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37431 | 1.6 | 245.08 | C8H9O2N2Br | CCOC(=O)c1cc(N)ncc1Br |
|
AD37432 | 2.24 | 251.28 | C12H10O2NFS | Nc1ccc(S(=O)(=O)c2ccccc2F)cc1 |
|
AD37433 | 1.58 | 252.9 | C4H3N3Br2 | Nc1nnc(Br)cc1Br |
|
AD37434 | 1.9 | 278.3 | C14H12N7 | CN(Cc1nc2ccccc2[nH]1)c1ncnc2c1N=C[N]2 |
|
AD37435 | 0.81 | 275.29 | C13H15O3N4 | CCOc1ccc(OC)cc1NC1=C(C(N)=O)N=C[N]1 |
|
AD37436 | 1.57 | 271.33 | C12H11N6S | CSc1cccc(-n2c(N)c3c(nc2=N)[N]C=N3)c1 |
|
AD37437 | 0.77 | 287.3 | C14H15O3N4 | CC(=O)OCc1cccc(C)c1NC1=C(C(N)=O)N=C[N]1 |
|
AD37438 | 1.5 | 284.3 | C13H14ON7 | C1=Nc2c(ncnc2Nc2cnn(CC3CCCO3)c2)[N]1 |
|
AD37439 | 1.87 | 272.31 | C12H10ON5S | CS(=O)c1ccccc1Nc1ncnc2c1N=C[N]2 |
|
AD37440 | 0.96 | 287.3 | C14H15O3N4 | CC(C)OC(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |