aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01091 | -0.2 | 234.23 | C11H12O3N3 | COC(=O)C1=N[N]C(C#CC2(O)CCCC2)=N1 |
|
AD01092 | 2.29 | 316.27 | C16H12O7 | COc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1 |
|
AD01093 | 1.14 | 266.02 | C5H5O2N3I | CCOC(=O)C1=C(I)[N]N=N1 |
|
AD01094 | -2.8 | 955.12 | C43H74O14N10 | CC(NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)O)C(C)C)C(C)C)C(C)C |
|
AD01095 | 1.76 | 240.27 | C11H6N5S | N#CC1=C(c2cccs2)[N]c2ncnc(N)c21 |
|
AD01096 | 1.29 | 224.2 | C11H6ON5 | N#CC1=C(c2ccco2)[N]c2ncnc(N)c21 |
|
AD01097 | 1.2 | 285.34 | C17H19O3N | CN1CCC23c4c5ccc(O)c4OC2C(O)C=CC3C1C5 |
|
AD01098 | 4.47 | 342.4 | C21H18ON4 | O=C(Nc1ccc2[nH]cnc2c1)NC(c1ccccc1)c1ccccc1 |
|
AD01099 | -0.56 | 189.17 | C7H11O5N | CC(=O)NC(CCC(=O)O)C(=O)O |
|
AD01100 | 3.05 | 316.35 | C18H20O5 | CC1CC=CCCC=CC(=O)Cc2cc(O)cc(O)c2C(=O)O1 |