| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 21 | Yes |
Popular Name: N-[(4-bromo-2-thienyl)methyl]-2-[4-(2,2-difluoroethyl)piperazin-1-yl]acetamide N-[(4-bromo-2-thienyl)methyl]-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) | 2.45 | 3.05 | -9.73 | 1 | 4 | 0 | 36 | 382.274 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.45 | 5.19 | -38.02 | 2 | 4 | 1 | 37 | 383.282 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
