| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 18 | Yes |
Popular Name: N-[(4-bromo-2-thienyl)methyl]-1-[(3S)-3-ethyl-3-piperidyl]-N-methyl-methanamine N-[(4-bromo-2-thienyl)methyl]-1-…
| 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) | 3.16 | 8.42 | -39.72 | 2 | 2 | 1 | 20 | 332.331 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 8.65 | -101.93 | 3 | 2 | 2 | 21 | 333.339 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
