aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22361 | 1.43 | 218.19 | C10H8O3N3 | O=C(O)COc1cccc(C2=C[N]N=N2)c1 |
|
AD22362 | 1.63 | 184.26 | C8H12ON2S | CCN(CC)C(=O)c1cscn1 |
|
AD22363 | 4.23 | 758.84 | C39H36O6N9S | Nc1nc(NCCc2ccc(CCC(=O)NCCNC(=S)Nc3ccc(C4c5ccc(O)cc5OC5=CC(=O)C=CC54)c(C(=O)O)c3)cc2)nc2c1N=C[N]2 |
|
AD22364 | 0.31 | 340.35 | C15H16O2N8 | O=C(NCC1=C[N]N=N1)C1C2C=CC(C2)C1C(=O)NCC1=C[N]N=N1 |
|
AD22365 | -2.38 | 247.2 | C9H13O7N | COC(=O)C1=CC(O)C(O)C(OCC(N)=O)O1 |
|
AD22366 | 4.4 | 316.31 | C20H12O4 | COc1cc2ccc(=O)c3cc(O)c4c5ccccc5oc1c4c23 |
|
AD22367 | 4.14 | 285.73 | C17H12O2NCl | Clc1cccc2[nH]cc(Cc3ccc4c(c3)OCO4)c12 |
|
AD22368 | -0.36 | 299.26 | C10H22O7NP | COP(=O)(O)OCCCNC(=O)C(O)C(C)(C)CO |
|
AD22369 | 1.51 | 751.97 | C37H65O9N7 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNc2ncnc3[nH]cnc23)C(C)C(O)C1(C)O |
|
AD22370 | 2.75 | 256.3 | C16H16O3 | Cc1ccccc1C(=O)Oc1ccc(CCO)cc1 |