In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2010 | 17 | Yes |
Popular Name: 2,2-Dimethyl-4-(4-ethylphenyl)-4-oxobutyric acid 2,2-Dimethyl-4-(4-ethylphenyl)-4…
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CAS Number: 951893-33-7
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) | 3.05 | 9.03 | -45.22 | 0 | 3 | -1 | 57 | 233.287 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.05 | 7.05 | -5.91 | 1 | 3 | 0 | 54 | 234.295 | 5 | ↓ |