In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-[(3S)-3-ethoxy-1-piperidyl]-1-(4-fluorophenyl)butan-2-amine (1S,2R)-1-[(3S)-3-ethoxy-1-piper…
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) | 2.58 | 6.31 | -44.72 | 3 | 3 | 1 | 40 | 295.422 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 7.52 | -34.56 | 3 | 3 | 1 | 40 | 295.422 | 6 | ↓ |