In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 22 | Yes |
Popular Name: 1-ethyl-4-[1-[(2-fluorophenyl)methyl]-4-piperidyl]piperazine 1-ethyl-4-[1-[(2-fluorophenyl)me…
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 | 9.56 | -81.83 | 2 | 3 | 2 | 12 | 307.457 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 9.48 | -101.76 | 2 | 3 | 2 | 12 | 307.457 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 7.25 | -34.9 | 1 | 3 | 1 | 11 | 306.449 | 4 | ↓ |