aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24651 | 0.6 | 121.25 | C5H15NS | C[SH](C)CCCN |
|
AD24652 | 2.79 | 370.45 | C21H26O4N2 | CCC1C(O)OC=C(C(=O)OC)C1CC1NCCc2c1[nH]c1ccccc21 |
|
AD24653 | -0.65 | 144.16 | C4H4O2N2S | O=c1cc(S)[nH]c(=O)[nH]1 |
|
AD24654 | 0.06 | 178.28 | C7H16O2NS | CC[S+](C)CCC(N)C(=O)O |
|
AD24655 | -0.05 | 173.25 | C5H11N5S | CSCCC(N)c1nnn[nH]1 |
|
AD24656 | -0.57 | 150.22 | C5H12O2NS | CSCCC([NH3+])C(=O)O |
|
AD24657 | -2.21 | 521.51 | C20H36O9N5P | Cc1ncc(COP(=O)(O)O)c(CNCC2CCC(N)C(OC3C(N)CC(N)C(O)C3O)O2)c1O |
|
AD24658 | 0.09 | 534.39 | C17H32O13N2P2 | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCCC(=O)CCC(=O)O |
|
AD24659 | -1.14 | 535.38 | C16H31O13N3P2 | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCNC(=O)CCC(=O)O |
|
AD24660 | -1.3 | 610.44 | C19H36O16N2P2 | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(O)NCCC(=O)NCCCC(=O)CC(O)(CC(=O)O)C(=O)O |