| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 26 | Yes |
Popular Name: [4-[2-(3-chlorophenyl)ethyl]piperazin-1-yl]-[2-(dimethylamino)-3-pyridyl]methanone [4-[2-(3-chlorophenyl)ethyl]pipe…
| 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) | 2.41 | 8.99 | -11.77 | 0 | 5 | 0 | 40 | 372.9 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 11.17 | -55.07 | 1 | 5 | 1 | 41 | 373.908 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.41 | 12.12 | -98.85 | 2 | 5 | 2 | 42 | 374.916 | 5 | ↓ |
