| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 22 | Yes |
Popular Name: 1-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-1,4-diazepan-1-yl]ethanone 1-[4-[(6-fluoro-4H-1,3-benzodiox…
| 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) | 1.14 | 7.55 | -41.31 | 1 | 5 | 1 | 43 | 309.361 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 5.63 | -11.6 | 0 | 5 | 0 | 42 | 308.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
