aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12281 | 1.41 | 311.32 | C16H15O3N4 | CCCCn1c2c(c(=O)n(C(=O)c3ccccc3)c1=O)[N]C=N2 |
|
AD12282 | 7.02 | 681.04 | C39H74O6N3 | CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NC(CO)C(=O)NC(CCC(=O)[O-])C(=O)NC |
|
AD12283 | -0.56 | 873.87 | C38H39O17N3S2 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(=O)CO)CC3OC1CC(NC(=O)OCC2=C(C(=O)O)N3C(=O)C(NC(=O)CS)C3SC2)C(O)C(C)O1 |
|
AD12284 | 12.47 | 744.99 | C36H74O9P2S | CCCCCCCCCCCCCCCCCCSCC(COP(=O)(O)OP(=O)(O)OC)OC(=O)CCCCCCCCCCCCC |
|
AD12285 | 3.65 | 364.63 | C16H11ON3ClBr | CNn1c(-c2ccccc2Cl)nc2ccc(Br)cc2c1=O |
|
AD12286 | 1.07 | 238.24 | C12H14O5 | CC(=O)Oc1ccc(CCO)cc1OC(C)=O |
|
AD12287 | 1.72 | 278.26 | C14H14O6 | COC(=O)C=Cc1ccc(OC(C)=O)c(OC(C)=O)c1 |
|
AD12288 | 1.31 | 302.19 | C14H6O8 | O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23 |
|
AD12289 | 3.1 | 350.27 | C11H16O5N2P2S | COP(=O)(S)OP(=O)(O)NCCc1c[nH]c2ccccc12 |
|
AD12290 | -0.71 | 301.33 | C9H9O4N4S2 | NS(=O)(=O)c1ccc(-n2cc(C[S](=O)=O)nn2)cc1 |