| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 15 | Yes |
Popular Name: 1-[(3S)-1-(1H-imidazol-4-ylmethyl)-3-piperidyl]-N-methyl-methanamine 1-[(3S)-1-(1H-imidazol-4-ylmethy…
| 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) | 0.53 | 3.89 | -81.59 | 4 | 4 | 2 | 50 | 210.325 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.53 | 3.75 | -43.65 | 3 | 4 | 1 | 49 | 209.317 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.53 | 6.46 | -176.71 | 5 | 4 | 3 | 51 | 211.333 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
