aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00461 | -2.04 | 232.24 | C8H16O4N4 | NC(=O)NCCCC(N)C(=O)NCC(=O)O |
|
AD00462 | 5.53 | 625.8 | C36H51O8N | CC1=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C4COC(C1=NO)C42O)OC1(CCC(C)C(C2CCCCC2)O1)C3 |
|
AD00463 | 7.12 | 339.61 | C22H45ON | CCCCCCCCCCCC(=O)N(C)CCCCCCCCC |
|
AD00464 | 2.9 | 316.31 | C17H16O6 | CC(=O)Oc1cc(C)c2c(=O)cc(C(C(C)=O)=C(C)O)oc2c1 |
|
AD00465 | 3.63 | 322.39 | C18H14O2N2S | CC(=O)C1=C(c2ccccc2)NC(S)=C(C#N)C1c1ccco1 |
|
AD00466 | 0.35 | 166.19 | C5H4N5S | NSc1ncnc2c1N=C[N]2 |
|
AD00467 | -0.17 | 239.26 | C9H9O3N3S | CNS(=O)(=O)c1n[nH]c2ccccc2c1=O |
|
AD00468 | 3.16 | 477.65 | C24H43O3N7 | CCCCCCCCCCCCCC(=O)NC(CCCNC(=N)N)C(=O)Nc1cc[nH]c(=O)n1 |
|
AD00469 | 2.5 | 310.34 | C16H16O2N5 | COc1cc2c(cc1OC)C(Nc1ncnc3c1N=C[N]3)CC2 |
|
AD00470 | 2.49 | 250.28 | C14H12N5 | C1=Nc2c(ncnc2NC2CCc3ccccc32)[N]1 |