aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00931 | 0.58 | 580.7 | C27H40O3N12 | Cn1cc(-c2cc(C(=O)NCCCCCCCC(=O)NC(CCCNC(=N)N)C(N)=O)cc(-c3cn(C)nn3)c2)nn1 |
|
AD00932 | 0.63 | 403.48 | C21H29O5N3 | CC(C)(C)c1ccc(CNCC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1 |
|
AD00933 | 1.88 | 188.27 | C10H20O3 | COC(=O)CCCCCCCCO |
|
AD00934 | 0.8 | 181.19 | C9H11O3N | COc1ccc(C(N)=O)cc1OC |
|
AD00935 | 1.4 | 172.22 | C9H16O3 | O=C(O)C(O)CC1CCCCC1 |
|
AD00936 | 0.78 | 74.12 | C4H10O | CCCCO |
|
AD00937 | 4.74 | 258.32 | C18H14N2 | C=Nc1ccc(C=Cc2ccnc3ccccc23)cc1 |
|
AD00938 | 1.72 | 256.29 | C12H14N7 | Nc1nc(NN=CC2CC=CCC2)nc2c1N=C[N]2 |
|
AD00939 | 6.39 | 438.59 | C22H47O6P | CCCCCCCCCCCCCCCCCCOCC(O)COP(=O)(O)OC |
|
AD00940 | -0.45 | 109.13 | C2H5O3S | CCS(=O)(=O)[O-] |