aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31331 | 0.21 | 196.21 | C9H12O3N2 | COCCOc1ccnc(C(N)=O)c1 |
|
AD31332 | -0.4 | 211.22 | C9H13O3N3 | CCOc1ncc(C(=O)NCCO)cn1 |
|
AD31333 | 0.78 | 188.13 | C7H6O2N2F2 | NC(=O)c1cncc(OC(F)F)c1 |
|
AD31334 | -0.4 | 197.19 | C8H11O3N3 | COCCOc1ncc(C(N)=O)cn1 |
|
AD31335 | 0.78 | 188.13 | C7H6O2N2F2 | NC(=O)c1cccc(OC(F)F)n1 |
|
AD31336 | 0.78 | 188.13 | C7H6O2N2F2 | NC(=O)c1cc(OC(F)F)ccn1 |
|
AD31337 | 0.78 | 188.13 | C7H6O2N2F2 | NC(=O)c1cnccc1OC(F)F |
|
AD31338 | -0.75 | 213.24 | C9H15O3N3 | COCCn1ccnc1C(=O)NCCO |
|
AD31339 | 0.37 | 188.19 | C9H8ON4 | NC(=O)c1cncn1-c1cccnc1 |
|
AD31340 | 0.02 | 209.25 | C10H15O2N3 | O=C(NCCO)c1nccn1CC1CC1 |