aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06601 | 2.37 | 288.26 | C15H12O6 | COc1cc(O)c2c(=O)c3cc(O)ccc3oc2c1OC |
|
AD06602 | 2.86 | 326.79 | C18H15ON4Cl | NNC(=O)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccccc1 |
|
AD06603 | 4.83 | 1409.21 | C71H63O20N9Cl2 | CC(C)CC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NCC(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD06604 | 2.11 | 278.46 | C7H2N3ClI | Clc1ncnc2c1C(I)=C[N]2 |
|
AD06605 | 3.68 | 330.8 | C6H3OBr3 | Oc1c(Br)cc(Br)cc1Br |
|
AD06606 | 2.09 | 364.36 | C14H21O7PS | COP(=O)(OCCSC(=O)C(C)(CO)CO)Oc1ccccc1 |
|
AD06607 | -0.41 | 274.32 | C12H22O5N2 | CCN(CC(=O)NCCO)C(=O)CCCCC(=O)O |
|
AD06608 | 4.17 | 377.38 | C19H24O5NP | CC(NP(=O)(O)Oc1cccc2ccccc12)C(=O)OC1CCCCC1 |
|
AD06609 | 2.52 | 627.77 | C32H53O11N | CC(=O)OC1C(C)C(=O)C2(CO2)CC(C)C(OC2OC(C)CC(N(C)C)C2OC(C)=O)C(C)C(O)C(C)C(=O)OC(C)C1C |
|
AD06610 | 3.89 | 292.71 | C12H8N2F3ClS | FC(F)(F)Cc1nnc(Cc2ccccc2Cl)s1 |