aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00411 | -1.42 | 144.17 | C6H12O2N2 | NC1CCC(O)CNC1=O |
|
AD00412 | 7.28 | 456.71 | C27H52O5 | CCCCCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCCCCC |
|
AD00413 | -0.84 | 95.1 | CH3O3S | CS(=O)(=O)[O-] |
|
AD00414 | 2.59 | 288.38 | C15H28O5 | CCCCCC(=O)OCC(O)COC(=O)CCCCC |
|
AD00415 | -4.61 | 1028.18 | C44H61O12N13S2 | NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)C1CCCN1C(=O)C1CSSCCC(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2ccccc2)C(=O)NC(CO)C(=O)NC(CC(N)=O)C(=O)N1 |
|
AD00416 | -0.89 | 187.24 | C8H17O2N3 | CCCCC(N)C(=O)NCC(N)=O |
|
AD00417 | 2.28 | 225.23 | C12H9ON4 | O=Cc1cn(CC2=C[N]N=N2)c2ccccc12 |
|
AD00418 | 0.69 | 133.13 | C6H5N4 | Cc1ncnc2c1N=C[N]2 |
|
AD00419 | 1.24 | 172.21 | C7H8O3S | Cc1ccc(S(=O)(=O)O)cc1 |
|
AD00420 | 1.29 | 686.78 | C34H42O11N2S | CC(=O)NC(CSCC1OC(=O)C2(C1=O)C(=O)C1(C)C(C=CC3C(O)C(C)C(OC(C)=O)CC31)CC2C=CC=CC=CC(=O)O)C(N)=O |