| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 25 | Yes |
Popular Name: (2R,3R)-1-(3-imidazol-1-ylpropyl)-2-(m-tolyl)-6-oxo-piperidine-3-carboxylic (2R,3R)-1-(3-imidazol-1-ylpropyl…
| 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) | 1.64 | 12.47 | -57.68 | 1 | 6 | 0 | 80 | 341.411 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 11.96 | -48.4 | 0 | 6 | -1 | 78 | 340.403 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 10.32 | -34.74 | 2 | 6 | 1 | 77 | 342.419 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
