aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12051 | 2.28 | 260.23 | C12H8N5F2 | Fc1ccc(CNc2ncnc3c2N=C[N]3)c(F)c1 |
|
AD12052 | 1.41 | 155.22 | C7H9ONS | CCc1ccc(C(N)=O)s1 |
|
AD12053 | -2.56 | 202.17 | C7H10O5N2 | O=C(O)CC1NC(=O)C(CO)NC1=O |
|
AD12054 | 5.1 | 635.76 | C31H27O2N10S2 | O=C(Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1)NCCN=C(S)Nc1ccc(N=C=S)cc1 |
|
AD12055 | 5.86 | 416.55 | C25H30ON5 | CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD12056 | -0.14 | 218.22 | C10H10O2N4 | NC(=O)c1ccccc1-n1cc(CO)nn1 |
|
AD12057 | 0.79 | 209.2 | C10H11O4N | C=NC(Cc1ccc(O)c(O)c1)C(=O)O |
|
AD12058 | 0.07 | 103.12 | C4H9O2N | CCCONC=O |
|
AD12059 | 2.57 | 202.14 | C8H5ON2F3 | Oc1ccc(C2(C(F)(F)F)N=N2)cc1 |
|
AD12060 | -1.69 | 154.17 | C6H10ON4 | OC1CN=CNC2NC=NC12 |