| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[5-(4-ethylphenyl)-4-methyl-1H-imidazol-2-yl]piperidine (2S)-2-[5-(4-ethylphenyl)-4-meth…
None
| 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) | 3.49 | 8.32 | -35.66 | 3 | 3 | 1 | 45 | 270.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 7.48 | -25.08 | 3 | 3 | 1 | 42 | 270.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 7.26 | -7.21 | 2 | 3 | 0 | 41 | 269.392 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 8.77 | -105.24 | 4 | 3 | 2 | 47 | 271.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
