aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23841 | -0.55 | 330.38 | C15H26O6N2 | O=C(CCCCN1C(=O)CCC1=O)NCCOCCOCCO |
|
AD23842 | 1.29 | 167.12 | C7H5O4N | O=C(O)c1cccc([N+](=O)[O-])c1 |
|
AD23843 | 7.18 | 746.88 | C32H64O11N2P2S | CCCCCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD23844 | -1.16 | 141.13 | C5H7O2N3 | Nc1nc(=O)[nH]cc1CO |
|
AD23845 | -8.49 | 264.29 | C8H20O4N6 | NC(=[NH2+])NC1C(O)C(O)C(O)C(NC(N)=[NH2+])C1O |
|
AD23846 | 6.73 | 848.97 | C39H66O12N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)C(C)CCCC(C)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C |
|
AD23847 | 0.15 | 902.7 | C24H50O20N4P4S2 | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC |
|
AD23848 | -0.97 | 127.1 | C5H5O3N | CNc1c(O)c(=O)c1=O |
|
AD23849 | 17.16 | 1030.55 | C59H116O10NP | CCCCCCCCCCCCCCCCCCCNC(=O)C(CO)OP(=O)(O)OCC(COC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCC(C)C |
|
AD23850 | -2.56 | 178.18 | C7H14O5 | OCC1C(O)CC(O)C(O)C1O |