| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 18 | Yes |
Popular Name: 1-[(1-ethylimidazol-2-yl)methyl]-4-methyl-piperidine-4-carboxylic 1-[(1-ethylimidazol-2-yl)methyl]…
| 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) | 0.54 | 6.63 | -61.58 | 1 | 5 | 0 | 62 | 251.33 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.54 | 6.18 | -51.13 | 0 | 5 | -1 | 61 | 250.322 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.54 | 8.42 | -59.81 | 1 | 5 | 0 | 62 | 251.33 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.54 | 8.82 | -114.63 | 2 | 5 | 1 | 64 | 252.338 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
