aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13481 | 3.49 | 299.4 | C16H23N6 | C1=Nc2c(nc(NC3CCCC3)nc2NC2CCCCC2)[N]1 |
|
AD13482 | 0.8 | 152.15 | C8H8O3 | O=C(O)C(O)c1ccccc1 |
|
AD13483 | -1.21 | 336.15 | C10H12O8NP2 | COP(=O)([O-])OC(CNC(=O)c1ccccc1)P(=O)([O-])[O-] |
|
AD13484 | 11.45 | 779.09 | C42H83O10P | CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC(CO)CO)OC(=O)CCCCCCCCCCCCCCCCC |
|
AD13485 | 7.31 | 635.6 | C33H30O2N7Cl2S | Nc1sc2c(c1C(=O)c1ccc(Cl)c(Cl)c1)CCN(CCCCCCOc1ccc(Nc3ncnc4c3N=C[N]4)cc1)C2 |
|
AD13486 | 5.99 | 554.54 | C29H33O5NCl2S | CC(C)C(CS(=O)(=O)C(C)C)N1C(=O)C(CC(=O)O)CC(c2cccc(Cl)c2)C1c1ccc(Cl)cc1 |
|
AD13487 | 0.53 | 429.32 | C16H20O9N3P | COC1=C(C)C(=O)c2c(c(COC(N)=O)c3n2CC(N)C3OP(=O)(O)OC)C1=O |
|
AD13488 | 2.32 | 258.32 | C15H18O2N2 | O=C(O)CCNCCNc1cccc2ccccc12 |
|
AD13489 | 1.9 | 246.78 | C13H23ON2Cl | CCCCCC1CNC1C(=O)NCC(C)Cl |
|
AD13490 | -2.54 | 436.46 | C18H32O10N2 | CCCCCC(=O)NCC(O)C(O)C1OC(OC)(C(=O)O)CC(O)C1NC(=O)CO |