In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 17 | Yes |
Popular Name: 1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-4-carbonitrile 1-(6-oxo-1H-pyridine-3-carbonyl)…
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) | -0.11 | 3.79 | -19.71 | 1 | 5 | 0 | 77 | 231.255 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.