| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 13 | Yes |
Popular Name: 4-(4-Hydroxyphenyl)-4-oxobutanenitrile 4-(4-Hydroxyphenyl)-4-oxobutanen…
Find On: PubMed — Wikipedia — Google
CAS Number: 7182-43-6
| 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) | 0.71 | 3.41 | -12.04 | 1 | 3 | 0 | 61 | 175.187 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.71 | 4.21 | -44.1 | 0 | 3 | -1 | 64 | 174.179 | 3 | ↓ |
