| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 16 | Yes |
Popular Name: [1-[(1-ethylimidazol-2-yl)methyl]-4-piperidyl]methanamine [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) | -0.14 | 3.82 | -81.55 | 4 | 4 | 2 | 50 | 224.352 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | 3.37 | -49.07 | 3 | 4 | 1 | 49 | 223.344 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.14 | 6.01 | -180.88 | 5 | 4 | 3 | 51 | 225.36 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.14 | 5.6 | -104.58 | 4 | 4 | 2 | 50 | 224.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
