aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11501 | 1.74 | 170.24 | C5H4N3S2 | CSC1=Nc2sncc2[N]1 |
|
AD11502 | 2.84 | 197.24 | C13H11ON | CC(=O)C=Cc1ccc2ccccc2n1 |
|
AD11503 | 1.48 | 166.18 | C9H10O3 | COC(=O)c1ccccc1OC |
|
AD11504 | 1.77 | 227.25 | C12H11ON4 | CN(C)c1ncnc2c1C(c1ccoc1)=C[N]2 |
|
AD11505 | 1.42 | 188.23 | C9H6N3S | C#CC1=C[N]c2ncnc(SC)c21 |
|
AD11506 | 2.12 | 224.24 | C13H10ON3 | COc1ncnc2c1C(c1ccccc1)=C[N]2 |
|
AD11507 | -1.23 | 128.09 | C4H4O3N2 | O=c1[nH]cc(O)c(=O)[nH]1 |
|
AD11508 | 2.8 | 526.63 | C30H38O8 | CC(=O)C1(O)CCC2(O)C3(O)CC=C4CC(O)CCC4(C)C3CC(OC(=O)C=Cc3ccc(O)cc3)C12C |
|
AD11509 | 4.64 | 337.81 | C21H16O2NCl | O=C(NCc1ccccc1)c1cc(O)ccc1-c1ccccc1Cl |
|
AD11510 | 1.77 | 250.3 | C13H18O3N2 | Cc1ccc(C(=O)NCCCCNC(=O)O)cc1 |