aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18771 | 1.2 | 126.18 | C5H6N2S | CSc1ncccn1 |
|
AD18772 | -0.66 | 186.21 | C8H14O3N2 | C=CC(C)C(N)C(=O)NCC(=O)O |
|
AD18773 | 1.29 | 303.37 | C15H21O2N5 | CN(C)Cc1ccc(-c2cn(CCCC(=O)NO)nn2)cc1 |
|
AD18774 | 1.69 | 264.23 | C13H12O6 | CCOC(=O)c1c(O)c2ccc(O)c(C)c2oc1=O |
|
AD18775 | 0.21 | 105.09 | C3H7O3N | CCONC(=O)O |
|
AD18776 | 0.68 | 189.21 | C8H15O4N | COC(=O)CNC(=O)OC(C)(C)C |
|
AD18777 | 2.16 | 300.3 | C14H14O3N5 | COc1cc(Nc2ncnc3c2N=C[N]3)cc(OC)c1OC |
|
AD18778 | 4.0 | 328.46 | C17H16ON2S2 | O=c1c2c3c(sc2nc(S)n1-c1ccccc1)CCCCC3 |
|
AD18779 | 4.3 | 602.77 | C32H50O7N4 | COC1=CCC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC2CC(OCc3cn(C)nn3)OC12 |
|
AD18780 | 1.74 | 1109.5 | C54H53O17N8Cl | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2)C1O |