| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2009 | 12 | No |
Popular Name: 5-Fluoro-2-nitrobenzene-1,3-diol 5-Fluoro-2-nitrobenzene-1,3-diol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1121585-22-5 , [1121585-22-5]
| 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) | 1.48 | 0.52 | -39.11 | 1 | 5 | -1 | 89 | 172.091 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 1.27 | -103.1 | 0 | 5 | -2 | 92 | 171.083 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | -0.25 | -7.89 | 2 | 5 | 0 | 86 | 173.099 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.