aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14771 | 3.04 | 320.3 | C19H12O5 | Cc1cc(O)c2c(O)c3c(cc2c1)C(=O)c1cccc(O)c1C3=O |
|
AD14772 | 3.75 | 376.41 | C22H20O4N2 | COC(=O)Cc1c(-c2[nH]c3ccccc3c2CC(=O)OC)[nH]c2ccccc12 |
|
AD14773 | 3.9 | 547.64 | C31H31O2N8 | O=C(NCCNC(=O)c1nc2c(c(NCC(c3ccccc3)c3ccccc3)n1)N=C[N]2)NCCc1ccccc1 |
|
AD14774 | -1.06 | 156.15 | C5H8O2N4 | COc1nc(N)c(N)c(=O)[nH]1 |
|
AD14775 | 4.39 | 871.5 | C41H66O9N4F3ClS | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)C(C)C(O)C1(C)O |
|
AD14776 | 2.26 | 733.78 | C28H55O12N4P2S | CCCCCCCCCCCCC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)(O)OC)C(=O)NCC(N)=O |
|
AD14777 | 0.85 | 186.25 | C9H18O2N2 | CCOC(=O)NCC=CCN(C)C |
|
AD14778 | 0.03 | 380.39 | C19H24O8 | CC1CCC2C(C(=O)OC3C4C=COC(O)C4C4(CO)OC34)=COC(O)C12 |
|
AD14779 | 1.6 | 255.33 | C14H17N5 | CCc1nc(N)nc(NC2Cc3ccccc3C2)n1 |
|
AD14780 | 2.6 | 201.06 | C8H9OBr | COCc1ccc(Br)cc1 |