aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15171 | 2.23 | 246.29 | C12H16ON5 | Oc1nc2c(c(NC3CCCCCC3)n1)N=C[N]2 |
|
AD15172 | 3.96 | 276.76 | C17H17O2Cl | COCCOc1ccc(Cc2ccccc2Cl)cc1 |
|
AD15173 | 5.0 | 411.63 | C27H41O2N | CC1=C2CC3C(CC=C4CC(O)CCC43C)C2CCC12OC1CC(C)CNC1C2C |
|
AD15174 | 2.69 | 371.39 | C20H21O6N | CCn1cc(C(=O)O)c(=O)c2cc(C#COCCCCCC(=O)O)ccc21 |
|
AD15175 | 4.0 | 852.12 | C45H77O12N3 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(NC(=O)CCCCCCC(=O)OC)cc3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD15176 | 1.71 | 270.27 | C13H12O2N5 | COc1ccc(CNc2ncnc3c2N=C[N]3)c(O)c1 |
|
AD15177 | 2.94 | 246.34 | C13H14ON2S | Cc1nc(NC(=O)Cc2ccccc2)sc1C |
|
AD15178 | 0.74 | 169.55 | C6H2ON4Cl | Oc1nc(Cl)nc2c1N=C[N]2 |
|
AD15179 | 2.36 | 571.75 | C30H53O9N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)O |
|
AD15180 | -1.79 | 522.54 | C20H39O8N6P | COP(=O)(O)OC1C(CO)OC(n2ccc(=O)[nH]c2=O)C1NCCCNCCCCNCCCN |