| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 17 | Yes |
Popular Name: 4-Oxo-4-(4-trifluoromethylphenyl)butyric acid 4-Oxo-4-(4-trifluoromethylphenyl…
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CAS Number: 58457-56-0
| 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) | 2.14 | 7.46 | -42.77 | 0 | 3 | -1 | 57 | 245.176 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.14 | 5.49 | -7.73 | 1 | 3 | 0 | 54 | 246.184 | 5 | ↓ |
