| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: 1-[(4-bromo-2-thienyl)methyl]-4-(pyrrolidin-1-ylmethyl)piperidine 1-[(4-bromo-2-thienyl)methyl]-4-…
| 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) | 3.58 | 11.17 | -96.55 | 2 | 2 | 2 | 9 | 345.35 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 8.92 | -34.22 | 1 | 2 | 1 | 8 | 344.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
