| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | Yes |
Popular Name: N-[(3S)-3-(aminomethyl)quinuclidin-3-yl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[(3S)-3-(aminomethyl)quinuclid…
| 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) | 1.02 | 4.8 | -196.76 | 5 | 4 | 3 | 40 | 285.5 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 1.32 | -45.15 | 3 | 4 | 1 | 37 | 283.484 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 3.79 | -108.13 | 4 | 4 | 2 | 39 | 284.492 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.02 | 6.04 | -82.1 | 4 | 4 | 2 | 38 | 284.492 | 7 | ↓ |
