aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11361 | 1.68 | 1377.68 | C64H88O16N12S3 | COS(=O)(=O)NC(=O)CNC(=O)C(C)NC(=O)C(CC(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)CNC(=O)C(NC(=O)C(CCCNC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CC(C)(C)O2)NC(=O)C(CCSC)NC=O)C(C)OC(C)(C)C |
|
AD11362 | -3.48 | 464.46 | C18H26O6N9 | CC(O)C(=O)NC(CO)C(=O)NC(CCC(=O)NCCNc1ncnc2c1N=C[N]2)C(N)=O |
|
AD11363 | -0.13 | 149.13 | C6H5ON4 | Nc1cc2c(c(=O)[nH]1)N=C[N]2 |
|
AD11364 | 2.48 | 564.42 | C25H24O3N8Br | O=C(CBr)NCCNC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1 |
|
AD11365 | 0.91 | 272.3 | C15H16O3N2 | NC(Cc1ccc2ccccc2c1)C(=O)NCC(=O)O |
|
AD11366 | 2.21 | 600.8 | C27H44O7N4S2 | CCCC1CC(C(=O)NCC(C)SCCOCCSCC(=O)NC(CO)C(O)c2ccc([N+](=O)[O-])cc2)N(C)C1 |
|
AD11367 | 0.33 | 132.12 | C5H8O4 | O=C(O)CCCC(=O)O |
|
AD11368 | 3.27 | 450.66 | C27H46O5 | CC(CO)CCC(O)C(C)C1C(O)CC2C3CC=C4CC(O)CCC4(C)C3C(O)CC21C |
|
AD11369 | 2.93 | 496.6 | C26H40O9 | COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(OC(=O)C(C)C)C(C)CC(CC=O)C1O |
|
AD11370 | -0.81 | 280.27 | C10H8O4N4S | O=C1NS(=O)(=O)c2cc(-n3cc(CO)nn3)ccc21 |