| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 25 | Yes |
Popular Name: 4-oxo-N-(3-pyridyl)-4-[4-(2-pyridyl)piperazin-1-yl]butanamide 4-oxo-N-(3-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) | 0.63 | 5.13 | -13.69 | 1 | 7 | 0 | 78 | 339.399 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.63 | 5.42 | -43.39 | 2 | 7 | 1 | 80 | 340.407 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.63 | 5.59 | -77.6 | 3 | 7 | 2 | 81 | 341.415 | 5 | ↓ |
