aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32191 | 1.12 | 190.2 | C10H10O2N2 | COC(=O)c1ccc(N)cc1CC#N |
|
AD32192 | 0.69 | 199.01 | C5H3N4Br | N#Cc1nc(Br)cnc1N |
|
AD32193 | 0.16 | 219.2 | C9H9O2N5 | C=C(C)C(=O)Nc1ncnc2[nH]c(=O)[nH]c12 |
|
AD32194 | 0.78 | 240.24 | C8H7ON5FS | O=C(CCS)Nc1nc(F)nc2c1N=C[N]2 |
|
AD32195 | 1.31 | 200.65 | C7H5N4ClS | CSc1nc(N)c(C#N)c(Cl)n1 |
|
AD32196 | 0.99 | 182.2 | C7H6O2N2S | COC(=O)c1scc(C#N)c1N |
|
AD32197 | 0.65 | 184.24 | C9H16O2N2 | C=CCOC(=O)NC1CCCNC1 |
|
AD32198 | 0.93 | 176.18 | C9H8O2N2 | COC(=O)c1cc(N)cc(C#N)c1 |
|
AD32199 | 1.29 | 176.22 | C10H12ON2 | N#Cc1ccccc1OCCCN |
|
AD32200 | 1.75 | 175.22 | C8H5N3S | N#Cc1nc2ccc(N)cc2s1 |