aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23301 | 1.66 | 275.33 | C13H13O2N3S | CC(=NNC(N)=S)c1c(C)c2ccccc2oc1=O |
|
AD23302 | 2.11 | 340.2 | C12H10O2N3SBr | CC(=NNC(N)=S)c1cc2cc(Br)ccc2oc1=O |
|
AD23303 | -0.16 | 139.16 | C6H9ON3 | CN(C)c1cc[nH]c(=O)n1 |
|
AD23304 | 1.77 | 295.38 | C15H25O3N3 | CC1CCC(C(C)C)C(OC(=O)Cn2cc(CO)nn2)C1 |
|
AD23305 | 2.43 | 309.41 | C16H27O3N3 | COCc1cn(CC(=O)OC2CC(C)CCC2C(C)C)nn1 |
|
AD23306 | 1.77 | 100.16 | C6H12O | CCCCCC=O |
|
AD23307 | 1.44 | 309.35 | C16H17ON6 | O=C(NCCNc1ncnc2c1N=C[N]2)C1=CC2C=CC1CC2 |
|
AD23308 | 8.47 | 545.85 | C37H55O2N | CC1(C)CCC2(C(=O)NCc3ccccc3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD23309 | 0.6 | 571.58 | C29H33O11N | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(=O)CO)CC3OC1CC(N(C)C)C(O)C(C)O1 |
|
AD23310 | 2.53 | 258.27 | C15H14O4 | COc1ccc(C(=O)Cc2ccc(O)cc2)c(O)c1 |