| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 18 | Yes |
Popular Name: (3R)-3-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperidine-3-carboxylic (3R)-3-methyl-1-[2-(2-methylimid…
| 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) | 0.38 | 8.72 | -61.45 | 1 | 5 | 0 | 62 | 251.33 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | 6.86 | -50.19 | 0 | 5 | -1 | 61 | 250.322 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.38 | 9.19 | -101.06 | 2 | 5 | 1 | 64 | 252.338 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
