| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 23 | Yes |
Popular Name: (5-bromo-3-methyl-benzofuran-2-yl)-(4-isobutylpiperazin-1-yl)methanone (5-bromo-3-methyl-benzofuran-2-y…
| 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) | 4.12 | 10.46 | -41.59 | 1 | 4 | 1 | 38 | 380.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 8.52 | -5.38 | 0 | 4 | 0 | 37 | 379.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
