aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23501 | 5.26 | 377.59 | C19H39O4NS | CCCCCCCCCCCCCCCCCC(=O)NS(=O)(=O)OC |
|
AD23502 | 1.85 | 308.44 | C13H28O4N2S | COS(=O)(=O)NC(=O)CCCCCCCCCCCN |
|
AD23503 | 3.72 | 389.49 | C18H28O5NFS | COS(=O)(=O)NC(=O)CCCCCCCCCCOc1ccc(F)cc1 |
|
AD23504 | 1.85 | 262.65 | C12H6N5FCl | Nc1ncnc2c1C(c1ccc(F)c(Cl)c1)=N[N]2 |
|
AD23505 | 6.75 | 857.09 | C45H76O15 | CCCCCC1CCCCCCCCCC(=O)OC2C(OC(C)C(O)C2OC2OC(C)C(OC(=O)C(C)CC)C3OC(C)(C)OC23)OC2C(O1)OC(C)C1OC(C)(C)OC12 |
|
AD23506 | 0.44 | 215.21 | C11H9O2N3 | O=C(N=c1cc[nH]c(=O)[nH]1)c1ccccc1 |
|
AD23507 | 0.13 | 190.2 | C10H10O2N2 | Cc1[nH]c(=O)[nH]c(=O)c1C#CC1CC1 |
|
AD23508 | 0.91 | 297.42 | C14H23O2N3S | CN(CCC(N)C(=O)O)CC1CN(Cc2cccs2)C1 |
|
AD23509 | 2.15 | 414.46 | C21H26O5N4 | CC(C)C(=O)Nc1ccc(C(=O)Nc2ccn(C3CCC(O)C(C)O3)c(=O)n2)cc1 |
|
AD23510 | 1.79 | 165.22 | C8H7ONS | OCc1nc2ccccc2s1 |