| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 31st, 2010 | 10 | No |
Popular Name: Acetonitrile, - Acetonitrile, -
Find On: PubMed — Wikipedia — Google
CAS Number: 178483-44-8
| 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) | -0.39 | 4.15 | -8.57 | 0 | 3 | 0 | 30 | 137.186 | 0 | ↓ |
| Mid Mid (pH 6-8) | -0.39 | 4.57 | -27.22 | 1 | 3 | 0 | 31 | 138.194 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.