aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23001 | 3.69 | 288.39 | C17H24O2N2 | CCCn1nc(O)c(Cc2ccc(OC(C)C)cc2)c1C |
|
AD23002 | 3.05 | 238.29 | C15H14ON2 | Oc1n[nH]c2cccc(CCc3ccccc3)c12 |
|
AD23003 | 2.32 | 202.26 | C12H14ON2 | Cc1ccccc1Cc1c(O)n[nH]c1C |
|
AD23004 | 0.37 | 162.15 | C7H6ON4 | Oc1nnn(-c2ccccc2)n1 |
|
AD23005 | 7.71 | 670.94 | C42H58O5N2 | COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD23006 | 1.0 | 246.27 | C13H14O3N2 | COC(=O)C(Cc1c[nH]c2ccccc12)NC=O |
|
AD23007 | 2.21 | 452.5 | C23H32O9 | COc1cc(C(O)C(CO)Oc2c(OC)cc(CCC(C)O)cc2OC)cc(OC)c1O |
|
AD23008 | -3.51 | 442.53 | C17H34O4N10 | CNC(=O)CCC(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(N)=O |
|
AD23009 | 1.28 | 327.27 | C14H18O6NP | CNC(=O)OC(c1ccc(OC2CCCC2)cc1)P(=O)([O-])[O-] |
|
AD23010 | -0.24 | 272.23 | C10H8O2N8 | O=c1c(NCC2=C[N]N=N2)c(NCC2=C[N]N=N2)c1=O |