In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 25 | Yes |
Popular Name: 4-oxo-N-(2-pyridyl)-4-[4-(2-pyridyl)piperazin-1-yl]butanamide 4-oxo-N-(2-pyridyl)-4-[4-(2-pyri…
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) | 0.80 | 8.11 | -40.94 | 2 | 7 | 1 | 80 | 340.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 7.78 | -15.88 | 1 | 7 | 0 | 78 | 339.399 | 5 | ↓ |