aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00191 | 3.79 | 316.34 | C18H14ON5 | C1=Nc2c(ncnc2NCc2ccc(Oc3ccccc3)cc2)[N]1 |
|
AD00192 | 0.73 | 263.3 | C13H17O3N3 | CNC(=O)c1ccc2c(c1)[nH]c(=O)n2CCCOC |
|
AD00193 | 1.34 | 589.69 | C30H43O9N3 | COC1C=CC=C(C)C(=O)NC2=CC(=O)C(NCCO)=C(CC(C)CC(OC)C(O)C(C)C=C(C)C1OC(N)=O)C2=O |
|
AD00194 | 3.08 | 360.45 | C21H28O5 | CC12OC=C3CCC4C(CC=C5CC(O)CCC54C)C(=O)OC(CO1)C32 |
|
AD00195 | 2.05 | 72.15 | C5H12 | CCC(C)C |
|
AD00196 | 2.82 | 299.37 | C18H21O3N | COC1=CC23CCCN2CCc2cc4c(cc2C3C1)OCO4 |
|
AD00197 | 0.52 | 236.64 | C10H7ON5Cl | NC(=O)C1=NC(Nc2ccc(Cl)cc2)=N[N]1 |
|
AD00198 | 4.84 | 406.46 | C22H18O4N2S | CCOC(=O)c1c(-c2ccccc2)[nH]c(=S)c(C#N)c1-c1ccc(OC)c(O)c1 |
|
AD00199 | 1.33 | 372.42 | C20H24O5N2 | CC(c1ccccc1)N1C(=O)C2CCC3C(=NO)CC(O)C(O)C3C2C1=O |
|
AD00200 | 0.29 | 151.55 | C4H6O2N3Cl | NC(=O)N(CCCl)N=O |