aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00531 | 3.52 | 254.4 | C10H10N2S3 | S=c1[nH]c(S)nc2sc3c(c12)CCCC3 |
|
AD00532 | 0.62 | 168.57 | C6H3N5Cl | Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD00533 | 0.91 | 175.14 | C5H3N8 | [N-]=[N+]=Nc1nc(N)c2c(n1)[N]C=N2 |
|
AD00534 | -0.04 | 271.98 | CH7O10P3 | COP(=O)(O)OP(=O)(O)OP(=O)(O)O |
|
AD00535 | 1.01 | 132.15 | C7H6N3 | Cc1ncnc2c1C=C[N]2 |
|
AD00536 | -0.56 | 418.19 | C6H17O11N2P3S | NC(CCSCCNP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(=O)O |
|
AD00537 | -1.28 | 136.14 | C5H6N5 | NC1N=CNC2=C1N=C[N]2 |
|
AD00538 | 0.72 | 260.28 | C12H14O2N5 | CCOC(C#Cc1nc(N)c2c(n1)[N]C=N2)OCC |
|
AD00539 | 4.08 | 332.48 | C21H32O3 | CC12CCC(O)CC1CCC1C2CCC2(C)C3CCC12OC(=O)C3 |
|
AD00540 | 2.34 | 316.32 | C18H12O2N4 | O=c1[nH]c(=O)c2ncc(-c3ccc(-c4ccccc4)cc3)nc2[nH]1 |