| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 24 | No |
Popular Name: 1-(2,2-difluoroethyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]piperazine 1-(2,2-difluoroethyl)-4-[(6-nitr…
| 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) | 1.88 | 4.5 | -9.71 | 0 | 7 | 0 | 71 | 343.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 6.77 | -44.3 | 1 | 7 | 1 | 72 | 344.338 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
