| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 16 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-butyl-N-methyl-quinuclidin-3-amine (3S)-3-(aminomethyl)-N-butyl-N-m…
| 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) | 1.31 | 4.15 | -111.8 | 4 | 3 | 2 | 35 | 227.396 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 1.72 | -44.55 | 3 | 3 | 1 | 34 | 226.388 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 4.06 | -33.31 | 3 | 3 | 1 | 34 | 226.388 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | 6.03 | -214.54 | 5 | 3 | 3 | 37 | 228.404 | 5 | ↓ |
