| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2008 | 17 | No |
Popular Name: 2-(4-Fluoro-benzoyl)-3-oxo-butyric acid methylester 2-(4-Fluoro-benzoyl)-3-oxo-butyr…
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CAS Number: 676348-58-6
2-(4-Fluoro-benzoyl)-3-oxo-butyric acid methyl
| 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) | 1.99 | 5.21 | -45.12 | 0 | 4 | -1 | 66 | 237.206 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 6.82 | -9.1 | 0 | 4 | 0 | 60 | 238.214 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 6.84 | -10.69 | 0 | 4 | 0 | 60 | 238.214 | 5 | ↓ |
