| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 14th, 2008 | 21 | No |
Popular Name: (2S)-2-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)-N-(3-cyanophenyl)propanamide (2S)-2-(4-aza-1-azoniabicyclo[2.…
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| 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) | -2.98 | 5.65 | -42.75 | 1 | 5 | 1 | 56 | 285.371 | 3 | ↓ |
| Mid Mid (pH 6-8) | -2.98 | 8.18 | -113.98 | 2 | 5 | 2 | 57 | 286.379 | 3 | ↓ |
