In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (2R)-2-(2,6-difluorophenyl)-2-[(2S)-2-ethyl-1-piperidyl]ethanamine (2R)-2-(2,6-difluorophenyl)-2-[(…
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) | 2.73 | 7.27 | -112.98 | 4 | 2 | 2 | 32 | 270.367 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 7.31 | -21.91 | 3 | 2 | 1 | 30 | 269.359 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 5.9 | -43.32 | 3 | 2 | 1 | 31 | 269.359 | 4 | ↓ |