In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: N-(3-bromophenyl)-2-[[(3S)-quinuclidin-3-yl]amino]acetamide N-(3-bromophenyl)-2-[[(3S)-quinu…
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) | 2.71 | 7.02 | -120.87 | 4 | 4 | 2 | 50 | 340.265 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.71 | 3.44 | -8.31 | 2 | 4 | 0 | 44 | 338.249 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.71 | 4.61 | -48.24 | 3 | 4 | 1 | 49 | 339.257 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.71 | 5.85 | -42.07 | 3 | 4 | 1 | 46 | 339.257 | 4 | ↓ |