In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 23 | Yes |
Popular Name: (2R,3R)-2-[(1S)-1-phenylethyl]-2-(3-pyridyl)quinuclidin-3-ol (2R,3R)-2-[(1S)-1-phenylethyl]-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) | 3.35 | 7.28 | -34.07 | 2 | 3 | 1 | 38 | 309.433 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.35 | 5.6 | -6.01 | 1 | 3 | 0 | 36 | 308.425 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.35 | 7.74 | -88.13 | 3 | 3 | 2 | 39 | 310.441 | 3 | ↓ |