| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 15 | Yes |
Popular Name: (3S)-3-methyl-1-pyrazin-2-yl-pyrrolidine-3-carboxylic (3S)-3-methyl-1-pyrazin-2-yl-pyr…
| 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) | 0.45 | 4.58 | -48.72 | 0 | 5 | -1 | 69 | 206.225 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 5.55 | -97.05 | 2 | 5 | 1 | 72 | 208.241 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 4.69 | -43.92 | 1 | 5 | 0 | 70 | 207.233 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.45 | 5.06 | -55.47 | 1 | 5 | 0 | 70 | 207.233 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
