aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21231 | 2.85 | 263.38 | C15H25ON3 | Cc1ccc(NC(=O)NCCCN(C)C(C)C)cc1 |
|
AD21232 | -2.89 | 311.26 | C11H18O8NF | CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CF |
|
AD21233 | 0.18 | 212.25 | C9H10O3NS | O=C(C[S](=O)=O)NCc1ccccc1 |
|
AD21234 | 10.35 | 700.14 | C42H85O6N | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCCCCOCCCCCCCOCC |
|
AD21235 | 0.18 | 132.16 | C6H12O3 | CCC(CO)C(=O)OC |
|
AD21236 | 1.69 | 234.3 | C13H18O2N2 | CCCCCCC#Cc1c(C)[nH]c(=O)[nH]c1=O |
|
AD21237 | -1.43 | 686.74 | C32H43O8N8F | NC1CC(NC(=O)CCCc2cn(CC(O)CN3CCN(c4cc5c(cc4F)c(=O)c(C(=O)O)cn5C4CC4)CC3)nn2)C(O)C(O)C1O |
|
AD21238 | -0.88 | 138.14 | C3H6O4S | CS(=O)(=O)CC(=O)O |
|
AD21239 | 0.6 | 173.16 | C8H5ON4 | COc1ncnc2c1C(C#N)=C[N]2 |
|
AD21240 | 1.08 | 474.32 | C13H20O11N2P2S | COP(=O)(O)OP(=O)(O)OCC1OC(c2nc(C(N)=O)cs2)C2OC(C)(C)OC12 |