In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 19 | Yes |
Popular Name: (3R)-3-ethyl-1-(4-ethyl-3-oxo-pyrazin-2-yl)pyrrolidine-3-carboxylic (3R)-3-ethyl-1-(4-ethyl-3-oxo-py…
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) | 0.68 | 6.94 | -54.9 | 0 | 6 | -1 | 78 | 264.305 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.68 | 6.92 | -43.27 | 1 | 6 | 0 | 79 | 265.313 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 7.32 | -49.68 | 1 | 6 | 0 | 80 | 265.313 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.