| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 19 | Yes |
Popular Name: N-[[(2S)-1-[(5-bromo-2-thienyl)methyl]-2-piperidyl]methyl]-2-methoxy-ethanamine N-[[(2S)-1-[(5-bromo-2-thienyl)m…
| 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) | 2.89 | 6.42 | -38.38 | 2 | 3 | 1 | 29 | 348.33 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 5.16 | -2.38 | 1 | 3 | 0 | 24 | 347.322 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 8.25 | -115.91 | 3 | 3 | 2 | 30 | 349.338 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
