| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2013 | 12 | Yes |
Popular Name: 2-(PIPERIDINOMETHYL)ACRYLONITRILE 2-(PIPERIDINOMETHYL)ACRYLONITRILE
Find On: PubMed — Wikipedia — Google
CAS Number: 27315-95-3
| 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) | 0.59 | 0.81 | -50.88 | 4 | 3 | 1 | 55 | 171.264 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.59 | -1.39 | -25.47 | 3 | 3 | 0 | 54 | 170.256 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.