In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 17 | Yes |
Popular Name: [(3S)-3-(4-methyl-1-piperidyl)quinuclidin-3-yl]methanamine [(3S)-3-(4-methyl-1-piperidyl)qu…
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) | 1.02 | 3.68 | -117.47 | 4 | 3 | 2 | 35 | 239.407 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 1.9 | -45.7 | 3 | 3 | 1 | 34 | 238.399 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 1.94 | -0.58 | 2 | 3 | 0 | 32 | 237.391 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 6.08 | -95.6 | 4 | 3 | 2 | 35 | 239.407 | 2 | ↓ |