In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 29 | Yes |
Popular Name: [4-(2-phenoxyethyl)piperazin-1-yl]-[2-(1-piperidyl)-3-pyridyl]methanone [4-(2-phenoxyethyl)piperazin-1-y…
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) | 2.54 | 9.26 | -11.42 | 0 | 6 | 0 | 49 | 394.519 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 11.5 | -49.04 | 1 | 6 | 1 | 50 | 395.527 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 11.97 | -96.58 | 2 | 6 | 2 | 51 | 396.535 | 6 | ↓ |