| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 17 | Yes |
Popular Name: 1-(3-bromo-2-thienyl)-2-[(2R)-2-ethyl-1-piperidyl]ethanone 1-(3-bromo-2-thienyl)-2-[(2R)-2-…
| 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) | 3.90 | 9.17 | -35.55 | 1 | 2 | 1 | 22 | 317.272 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 7.74 | -7.42 | 0 | 2 | 0 | 20 | 316.264 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
