| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 12 | Yes |
Popular Name: 5-Acetyl-2-hydroxybenzonitrile 5-Acetyl-2-hydroxybenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 39055-82-8 , [39055-82-8]
| 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) | 1.51 | 3.36 | -41.06 | 0 | 3 | -1 | 64 | 160.152 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 2.5 | -12.74 | 1 | 3 | 0 | 61 | 161.16 | 1 | ↓ |
