In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2011 | 23 | Yes |
Popular Name: 2-[(2R)-2-benzylpyrrolidin-1-yl]-1-[(2S,6S)-2,6-dimethyl-1-piperidyl]ethanone 2-[(2R)-2-benzylpyrrolidin-1-yl]…
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) | 3.46 | 11.83 | -31.83 | 1 | 3 | 1 | 25 | 315.481 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 10.06 | -6.35 | 0 | 3 | 0 | 24 | 314.473 | 4 | ↓ |