| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (3R)-1-(4-tert-butyl-3-oxo-pyrazin-2-yl)-3-ethyl-pyrrolidine-3-carboxylic (3R)-1-(4-tert-butyl-3-oxo-pyraz…
| 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) | 1.49 | 7.84 | -54.37 | 0 | 6 | -1 | 78 | 292.359 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 7.83 | -41.02 | 1 | 6 | 0 | 79 | 293.367 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.49 | 8.22 | -47.96 | 1 | 6 | 0 | 80 | 293.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
