| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 22 | Yes |
Popular Name: (2S)-2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-(4-fluorophenyl)butanamide (2S)-2-[(3,5-dioxo-2H-1,2,4-tria…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.80 | 0.26 | -41.78 | 2 | 7 | -1 | 111 | 323.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 1.88 | -13.05 | 3 | 7 | 0 | 108 | 324.337 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(5-keto-4H-1,2,4-triazin-6-yl)thio]-N-phenyl-acetamide](http://zinc12.docking.org/img/rings/551814.gif)