In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2009 | 25 | Yes |
Popular Name: 1-phenyl-4-[4-(2-pyridyl)piperazin-1-yl]cyclohexanol 1-phenyl-4-[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) | 2.98 | 9.92 | -40.55 | 2 | 4 | 1 | 41 | 338.475 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 8.54 | -6.36 | 1 | 4 | 0 | 40 | 337.467 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 8.87 | -30.93 | 2 | 4 | 1 | 41 | 338.475 | 3 | ↓ |