In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: [(3S)-3-(3,3-dimethylmorpholin-4-yl)quinuclidin-3-yl]methanamine [(3S)-3-(3,3-dimethylmorpholin-4…
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) | 0.53 | 1.18 | -114.85 | 4 | 4 | 2 | 45 | 255.406 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.53 | 0.35 | -38.3 | 3 | 4 | 1 | 43 | 254.398 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.53 | -1.26 | -46.16 | 3 | 4 | 1 | 43 | 254.398 | 2 | ↓ |