In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 18 | Yes |
Popular Name: [(3R)-3-[(3S)-3-ethylmorpholin-4-yl]quinuclidin-3-yl]methanamine [(3R)-3-[(3S)-3-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 | 2.35 | -109.42 | 4 | 4 | 2 | 45 | 255.406 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.58 | 2.32 | -33.42 | 3 | 4 | 1 | 43 | 254.398 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.58 | -0.08 | -41.79 | 3 | 4 | 1 | 43 | 254.398 | 3 | ↓ |