| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 20 | Yes |
Popular Name: (3S)-3-ethyl-1-(6-oxo-1H-pyrazine-3-carbonyl)piperidine-3-carboxylic (3S)-3-ethyl-1-(6-oxo-1H-pyrazin…
| 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 | 3.98 | -51.06 | 1 | 7 | -1 | 106 | 278.288 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.41 | 1.95 | -88.28 | 0 | 7 | -2 | 109 | 277.28 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
