| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 12 | Yes |
Popular Name: Acetonitrile, - Acetonitrile, -
Find On: PubMed — Wikipedia — Google
CAS Number: 219312-05-7
| 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) | 1.64 | 3.15 | -8.48 | 2 | 3 | 0 | 59 | 162.192 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.