In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: (2R)-2-(4-chloro-3-fluoro-phenyl)-2-[(3S)-3-propoxy-1-piperidyl]ethanamine (2R)-2-(4-chloro-3-fluoro-phenyl…
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) | 2.75 | 5.42 | -55.38 | 3 | 3 | 1 | 40 | 315.84 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 7.51 | -131.8 | 4 | 3 | 2 | 41 | 316.848 | 6 | ↓ |