aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08601 | 3.29 | 417.49 | C23H25O2N6 | Nc1ncnc2c1N=C(NCc1ccc(-c3ccccc3)c(OCCCCCO)c1)[N]2 |
|
AD08602 | 1.87 | 368.47 | C20H32O6 | CC1CC(C)C(O)C(C)C=CC(=O)OC(C)C(CO)C2OC2CCC1=O |
|
AD08603 | -2.4 | 787.66 | C25H35O16N5P2S2 | COCC1OC2C(n3ccc(=O)[nH]c3=O)OC1(COP(O)(=S)OC1C3OC(COC)C1(COP(O)(=S)OC)OC3n1ccc(N)nc1=O)C2O |
|
AD08604 | -3.06 | 773.63 | C24H33O16N5P2S2 | COCC1OC2C(n3ccc(=O)[nH]c3=O)OC1(COP(O)(=S)OC1C3OC(COC)C1(COP(O)(O)=S)OC3n1ccc(N)nc1=O)C2O |
|
AD08605 | 3.0 | 388.41 | C20H18O2N7 | COc1cc(C=NNc2nc(N)c3c(n2)[N]C=N3)ccc1OCc1ccccc1 |
|
AD08606 | 7.69 | 1652.52 | C82H84O23N12Cl2 | CCCCCCCCOCc1cn(CCOCCOCCOCCOCc2cn(C3C(=O)NC4Cc5ccc(c(Cl)c5)Oc5cc6cc(c5O)Oc5ccc(cc5Cl)C(O)C5NC(=O)C(NC(O)C6NC(=O)C(NC4=O)c4cc(O)cc(c4)Oc4cc3ccc4O)c3ccc(O)c(c3)-c3c(O)cc(O)cc3C(C(=O)O)NC5=O)nn2)nn1 |
|
AD08607 | 1.12 | 250.31 | C9H12N7S | CSCCC=NNc1nc(N)c2c(n1)[N]C=N2 |
|
AD08608 | 4.16 | 418.57 | C25H38O5 | CCC1CC=C(C)C=C(C)C(O)C(CC)C=C(C)C(O)CC=CC=C(CO)C(=O)O1 |
|
AD08609 | 2.08 | 217.28 | C10H9N4S | CSc1ncnc2c1-c1ccn(C)c1[N]2 |
|
AD08610 | 1.2 | 173.16 | C8H5ON4 | Nc1ncnc2c1-c1occc1[N]2 |