| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 7th, 2009 | 13 | No |
Popular Name: 2-Acetyl-4-methyl-3-oxo-pentanoic acid methyl ester 2-Acetyl-4-methyl-3-oxo-pentanoi…
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CAS Number: 475662-06-7
| 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) | 0.38 | 5.65 | -16.91 | 0 | 4 | 0 | 60 | 186.207 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 5.73 | -44.41 | 0 | 4 | -1 | 66 | 185.199 | 4 | ↓ |
