| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 19 | Yes |
Popular Name: 1-[3-(azepan-1-ylmethyl)-5-fluoro-2-hydroxy-phenyl]ethanone 1-[3-(azepan-1-ylmethyl)-5-fluor…
| 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) | 2.85 | 8.03 | -38.73 | 2 | 3 | 1 | 42 | 266.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 9.01 | -32.26 | 1 | 3 | 0 | 45 | 265.328 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
