In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 21 | Yes |
Popular Name: 1-(4-fluorophenyl)-4-[4-(2-hydroxyethyl)piperazin-1-yl]butan-1-one 1-(4-fluorophenyl)-4-[4-(2-hydro…
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) | 1.46 | 4.88 | -45.42 | 2 | 4 | 1 | 45 | 295.378 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 2.57 | -11.03 | 1 | 4 | 0 | 44 | 294.37 | 7 | ↓ |