aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10521 | 4.69 | 492.45 | C27H16O6N4 | O=C(O)c1ccc(NN2C(=O)c3c(c4c5cccc(O)c5[nH]c4c4[nH]c5c(O)cccc5c34)C2=O)cc1 |
|
AD10522 | 1.06 | 212.23 | C8H8O3N2S | O=C(O)NNC(=O)C=Cc1cccs1 |
|
AD10523 | 11.81 | 1801.63 | C89H169O21N7S4 | CCCCCCCCC=CCCCCCCCCOCC(COCCOCCOCCOCCNC(=O)C(CCCCNC(=O)C(CCCCNC(=O)COCCOCCS)NC(=O)COCCOCCS)NC(=O)C(CCCCNC(=O)COCCOCCS)NC(=O)COCCOCCS)OCCCCCCCCC=CCCCCCCCC |
|
AD10524 | 0.31 | 300.31 | C12H20O5N4 | Cn1cc(COCC(NC(=O)OC(C)(C)C)C(=O)O)nn1 |
|
AD10525 | 0.01 | 175.58 | C6H6O2N3Cl | COc1nc(N)c(Cl)c(=O)[nH]1 |
|
AD10526 | 3.09 | 240.3 | C16H16O2 | COc1cc(O)ccc1Cc1ccc2c(c1)CC2 |
|
AD10527 | 4.66 | 677.94 | C37H59O8NS | COC(=O)C(CCSC)NC(=O)C12CCC(C)(C(=O)OC)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(CO)C4CCC3(C)C1(C)CC2 |
|
AD10528 | 5.44 | 291.85 | C17H18NClS | Clc1ccccc1Cc1ncc(C2CCCCC2)s1 |
|
AD10529 | 1.57 | 207.66 | C8H14O2N3Cl | CC(C)CNC(=O)N(CCCl)N=O |
|
AD10530 | 4.37 | 269.31 | C18H11N3 | c1cc2ccc3ccc(-c4nc[nH]n4)c4ccc(c1)c2c34 |