In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: N-(m-tolyl)-2-[[(3S)-quinuclidin-3-yl]amino]acetamide N-(m-tolyl)-2-[[(3S)-quinuclidin…
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) | 2.35 | 7.07 | -118.86 | 4 | 4 | 2 | 50 | 275.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 3.48 | -9.85 | 2 | 4 | 0 | 44 | 273.38 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 4.65 | -46.78 | 3 | 4 | 1 | 49 | 274.388 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 5.9 | -42.38 | 3 | 4 | 1 | 46 | 274.388 | 4 | ↓ |