| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | Yes |
Popular Name: (3R)-3-ethyl-1-[2-oxo-2-(thiazol-2-ylamino)ethyl]piperidine-3-carboxylic (3R)-3-ethyl-1-[2-oxo-2-(thiazol…
| 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) | 1.17 | 6.95 | -52.79 | 2 | 6 | 0 | 87 | 297.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 5.36 | -63.08 | 1 | 6 | -1 | 85 | 296.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
