| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2009 | 10 | No |
Popular Name: Acetonitrile, - Acetonitrile, -
Find On: PubMed — Wikipedia — Google
CAS Number: 114622-99-0
| 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) | 0.68 | 2.91 | -8.66 | 1 | 3 | 0 | 49 | 133.154 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 3.38 | -38.72 | 2 | 3 | 1 | 50 | 134.162 | 2 | ↓ |
