| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2010 | 18 | Yes |
Popular Name: 2,2-Dimethyl-4-oxo-4-(4-n-propylphenyl)butyric acid 2,2-Dimethyl-4-oxo-4-(4-n-propyl…
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CAS Number: 951893-45-1
| 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) | 3.44 | 9.81 | -45.05 | 0 | 3 | -1 | 57 | 247.314 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 7.83 | -5.81 | 1 | 3 | 0 | 54 | 248.322 | 6 | ↓ |
