| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-isobutyl-N-methyl-quinuclidin-3-amine (3S)-3-(aminomethyl)-N-isobutyl-…
| 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) | 0.99 | 4.4 | -108.39 | 4 | 3 | 2 | 35 | 227.396 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.23 | -33.43 | 3 | 3 | 1 | 34 | 226.388 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 1.57 | -43.67 | 3 | 3 | 1 | 34 | 226.388 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 3.54 | -110.66 | 4 | 3 | 2 | 35 | 227.396 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.99 | 5.97 | -213.82 | 5 | 3 | 3 | 37 | 228.404 | 4 | ↓ |
