| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 17 | Yes |
Popular Name: 1-[(3S)-1-(3-imidazol-1-ylpropyl)-3-piperidyl]-N-methyl-methanamine 1-[(3S)-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) | 0.85 | 9.05 | -166.06 | 4 | 4 | 3 | 40 | 239.387 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.85 | 7.1 | -44.97 | 2 | 4 | 1 | 34 | 237.371 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.85 | 8.54 | -110.09 | 3 | 4 | 2 | 39 | 238.379 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
