aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08341 | 2.77 | 272.33 | C13H12ON4S | CCn1nccc1NC(=O)c1ccc2scnc2c1 |
|
AD08342 | 2.13 | 110.13 | C7H7F | Cc1cccc(F)c1 |
|
AD08343 | 14.69 | 1002.66 | C45H13N4F19S | CSc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[nH]5)C=C4)C=C3)c(F)c1F |
|
AD08344 | 3.62 | 357.4 | C20H17ON6 | Cc1ccccc1NC(=O)Cc1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD08345 | 9.89 | 722.98 | C38H75O10P | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC(CO)CO)OC(=O)CCCCCCCCCCCCCCC |
|
AD08346 | 3.29 | 246.49 | C9H5ONClBr | Oc1c[nH]c2ccc(Br)c(Cl)c12 |
|
AD08347 | 3.69 | 217.34 | C13H15NS | CCCc1ccc(Cc2cscn2)cc1 |
|
AD08348 | 0.56 | 706.92 | C35H66O12N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(C)C)C2O)C(C)(O)CC(C)C(OCC(=O)NCCO)C(C)C(O)C1(C)O |
|
AD08349 | 3.8 | 221.26 | C15H11ON | ON=Cc1c2ccccc2cc2ccccc12 |
|
AD08350 | 8.11 | 498.75 | C32H50O4 | CC(=O)OC1CCC2(C)C3=C(CCC2C1(C)C)C1(C)CCC(C(CCC=C(C)C)C(=O)O)C1(C)CC3 |