In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-1-[4-(hydroxymethyl)-1-piperidyl]-2-phenyl-ethanone (2S)-2-amino-1-[4-(hydroxymethyl…
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) | -1.08 | 1.79 | -45.61 | 4 | 4 | 1 | 68 | 249.334 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.08 | 1.46 | -10.39 | 3 | 4 | 0 | 67 | 248.326 | 3 | ↓ |