| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 18 | Yes |
Popular Name: (3S)-1-(2-cyano-3-fluoro-phenyl)-5-oxo-pyrrolidine-3-carboxylic (3S)-1-(2-cyano-3-fluoro-phenyl)…
| 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) | 0.47 | 7.06 | -46.54 | 0 | 5 | -1 | 84 | 247.205 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.47 | 5.09 | -14.46 | 1 | 5 | 0 | 81 | 248.213 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
