aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21611 | -0.85 | 112.14 | C4H8N4 | C=NNC1=NCCN1 |
|
AD21612 | 1.51 | 240.25 | C12H10ON5 | Nc1ncnc2c1N=C(OCc1ccccc1)[N]2 |
|
AD21613 | -0.8 | 102.09 | C3H6O2N2 | CC(=O)NC(N)=O |
|
AD21614 | 5.48 | 329.28 | C19H21Br | CCc1ccc(Cc2ccc3c(c2Br)CCCC3)cc1 |
|
AD21615 | 1.19 | 610.53 | C20H37O12N2FP2S | CCCC=CC(O)C(F)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD21616 | 5.13 | 328.87 | C19H17N2ClS | CC(Cc1nnc(Cc2ccccc2Cl)s1)c1ccccc1 |
|
AD21617 | 4.88 | 312.72 | C17H12OF3Cl | FC(F)(F)c1ccc(Cc2ccc3c(c2Cl)CCO3)cc1 |
|
AD21618 | 5.37 | 318.87 | C19H19OClS | CCOc1ccc(Cc2ccc3c(c2Cl)CC(C)S3)cc1 |
|
AD21619 | 4.4 | 264.37 | C19H20O | Cc1c(Cc2ccc(C3CC3)cc2)ccc2c1OCC2 |
|
AD21620 | 1.93 | 267.32 | C14H15N6 | Cc1ccc(CCNc2nc(N)c3c(n2)[N]C=N3)cc1 |