| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: (3R)-1-(4-tert-butyl-3-oxo-pyrazin-2-yl)-3-methyl-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) | 1.15 | 7.27 | -50.67 | 0 | 6 | -1 | 78 | 278.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 7.68 | -47.29 | 1 | 6 | 0 | 80 | 279.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 7.34 | -42.2 | 1 | 6 | 0 | 79 | 279.34 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
