In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: [(3R)-3-[(2S)-2-ethylmorpholin-4-yl]quinuclidin-3-yl]methanamine [(3R)-3-[(2S)-2-ethylmorpholin-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) | 0.58 | 2.73 | -106.13 | 4 | 4 | 2 | 45 | 255.406 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 2.89 | -36.53 | 3 | 4 | 1 | 43 | 254.398 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 0.3 | -45.27 | 3 | 4 | 1 | 43 | 254.398 | 3 | ↓ |