aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16891 | 0.92 | 301.07 | C2H8O9P3S | COP(=O)([O-])OP(=O)(S)OP(=O)(O)OC |
|
AD16892 | 1.48 | 228.29 | C11H20O3N2 | O=C(O)NCCCC(=O)NC1CCCCC1 |
|
AD16893 | 1.62 | 184.17 | C9H9O3F | COC(=O)c1ccc(F)c(OC)c1 |
|
AD16894 | 0.88 | 168.15 | C8H8O4 | COC(=O)c1cccc(O)c1O |
|
AD16895 | 2.54 | 420.46 | C22H28O8 | CC(=O)OC1CC(O)C2CCC3C(=O)OC(c4ccoc4)CC3(C)C2C1OC(C)=O |
|
AD16896 | -1.19 | 584.66 | C25H48O13N2 | COC(=O)CCCCC(=O)NCC(=O)NC(COCOCCCO)(COCOCCCO)COCOCCCO |
|
AD16897 | 3.98 | 343.32 | C20H10O2N3F | O=C1NC(=O)c2c1c1c3ccccc3[nH]c1c1[nH]c3cc(F)ccc3c21 |
|
AD16898 | 1.62 | 311.47 | C17H33O2N3 | CN(CCC(N)C(=O)O)CC1CN(CCCC2CCCC2)C1 |
|
AD16899 | 1.28 | 319.45 | C18H29O2N3 | CN(CCC(N)C(=O)O)CC1CN(CCCc2ccccc2)C1 |
|
AD16900 | 0.02 | 178.2 | C6H4N5S | NC(=S)c1ncnc2c1N=C[N]2 |