In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | No |
Popular Name: 5-fluoro-2-[4-(2-pyridyl)piperazin-1-yl]benzaldehyde 5-fluoro-2-[4-(2-pyridyl)piperaz…
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) | 2.61 | 9.15 | -36.84 | 1 | 4 | 1 | 38 | 286.33 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 8.85 | -8.15 | 0 | 4 | 0 | 36 | 285.322 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.