In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 19 | Yes |
Popular Name: ethyl 2,2-dimethyl-4-oxo-4-(4-thiomethylphenyl)butyrate ethyl 2,2-dimethyl-4-oxo-4-(4-th…
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CAS Number: 898753-74-7
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) | 3.56 | 9.61 | -5.68 | 0 | 3 | 0 | 43 | 280.389 | 7 | ↓ |