| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 21 | Yes |
Popular Name: 1-(5-oxo-1-phenyl-4H-1,2,4-triazole-3-carbonyl)piperidin-4-one 1-(5-oxo-1-phenyl-4H-1,2,4-triaz…
| 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) | -0.05 | 4.23 | -44.65 | 0 | 7 | -1 | 91 | 285.283 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.51 | 5.4 | -11.35 | 1 | 7 | 0 | 88 | 286.291 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
