aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24601 | 0.18 | 176.11 | C5H9O3N2P | COP(=O)(O)c1c[nH]nc1C |
|
AD24602 | -1.76 | 244.06 | C3H8O6N3P2 | Nc1n(P(=O)(O)O)cc[n+]1P(=O)(O)O |
|
AD24603 | -1.18 | 626.47 | C18H32O16N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CC(O)(CC(=O)O)C(=O)O |
|
AD24604 | 13.26 | 722.93 | C40H68O7P2 | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O |
|
AD24605 | -0.6 | 210.19 | C8H10O3N4 | CNc1[nH]c(=O)[nH]c(=O)c1N=CC(C)=O |
|
AD24606 | -0.38 | 258.31 | C12H16N7 | CN(CC#CC1=Nc2c(N)ncnc2[N]1)CCCN |
|
AD24607 | -0.53 | 116.16 | C5H12ON2 | CNC(=O)CCCN |
|
AD24608 | 1.33 | 397.5 | C18H27O5N3S | OCCOCCOCCOCCn1cc(COc2ccc(CS)cc2)nn1 |
|
AD24609 | 0.89 | 224.15 | C7H13O6P | COP(=O)(O)OC(=O)C(=O)CC(C)C |
|
AD24610 | -0.45 | 115.13 | C5H9O2N | C=CC(O)C(=N)CO |