aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11941 | -0.29 | 138.13 | C6H6O2N2 | C=Cc1c[nH]c(=O)[nH]c1=O |
|
AD11942 | -3.63 | 288.28 | C11H18O6N3 | CC(O)C(=O)NC(C)C(=O)NC(CCC(=O)[O-])C(N)=O |
|
AD11943 | 1.92 | 471.41 | C24H15O7N4 | COc1nc(O)nc(N=C2C=CC(=C3c4ccc(O)cc4Oc4cc(O)ccc43)C(C(=O)[O-])=C2)n1 |
|
AD11944 | 0.54 | 163.24 | C6H13O2NS | CSCCCC(N)C(=O)O |
|
AD11945 | 0.25 | 169.55 | C6H2ON4Cl | O=c1[nH]cnc2c1N=C(Cl)[N]2 |
|
AD11946 | -0.11 | 103.15 | C3H5ONS | S=C1NCCO1 |
|
AD11947 | 0.22 | 129.09 | C5H4O2NF | O=c1[nH]ccc(O)c1F |
|
AD11948 | 3.08 | 590.76 | C32H50O8N2 | CCC(=O)OC1CC(=O)NCCCN(CCCCc2ccccc2)CC(OC(C)=O)C(C)CC(CC=O)C(O)C1OC |
|
AD11949 | 3.03 | 633.78 | C34H51O10N | CCC(=O)OC1CC(=O)OC(C)CC(O)C(N(C)CCc2ccccc2)C=CC(OC(C)=O)C(C)CC(CC=O)C(O)C1OC |
|
AD11950 | -1.47 | 146.15 | C5H10O3N2 | CNC(=O)CC(N)C(=O)O |