In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 18 | Yes |
Popular Name: [(3S)-3-[(3R,5R)-3,5-dimethyl-1-piperidyl]quinuclidin-3-yl]methanamine [(3S)-3-[(3R,5R)-3,5-dimethyl-1-…
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) | 1.49 | 5.35 | -112.75 | 4 | 3 | 2 | 35 | 253.434 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 2.93 | -44.26 | 3 | 3 | 1 | 34 | 252.426 | 2 | ↓ |