aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11891 | -0.29 | 294.26 | C14H14O7 | CC(O)C1=CC2(C=CC3C(C(=O)O)=COC(O)C32)OC1=O |
|
AD11892 | 4.95 | 479.37 | C20H26ON5I | CCCCCCCCn1cnc2c(OCc3cccc(I)c3)nc(N)nc21 |
|
AD11893 | 5.38 | 441.58 | C25H25N6S | CSc1ccc2c(c1)c(CCNc1ncnc3c1N=C[N]3)cn2Cc1cc(C)ccc1C |
|
AD11894 | 3.49 | 324.43 | C17H18N5S | c1ccc(CSc2ncnc3c2N=C(N2CCCCC2)[N]3)cc1 |
|
AD11895 | 4.18 | 274.78 | C15H11N2ClS | Clc1ccccc1Cc1ccc(-n2cccn2)s1 |
|
AD11896 | 2.04 | 376.49 | C22H32O5 | CC12CCC3C(CC=C4CC(O)CC(O)C43C)C1CC1OC(=O)C(CO)C12 |
|
AD11897 | 0.61 | 210.19 | C9H10O4N2 | COc1ccc(C(=O)NNC(=O)O)cc1 |
|
AD11898 | 0.61 | 210.19 | C9H10O4N2 | COc1ccccc1C(=O)NNC(=O)O |
|
AD11899 | 0.62 | 240.21 | C10H12O5N2 | COc1ccc(C(=O)NNC(=O)O)cc1OC |
|
AD11900 | 0.45 | 153.1 | C4H2N6F | Nc1nc(F)nc2c1N=N[N]2 |