| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 15 | No |
Popular Name: 1-(4-fluorophenyl)-4-methylpentane-1,3-dione 1-(4-fluorophenyl)-4-methylpenta…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 114433-94- , 114433-94-2 , [114433-94-2]
| 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) | 2.19 | 8.67 | -15.21 | 0 | 2 | 0 | 34 | 208.232 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 7.55 | -46.59 | 0 | 2 | -1 | 40 | 207.224 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.