| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 18 | Yes |
Popular Name: N-methyl-2-[(2R)-1-[(3S)-quinuclidin-3-yl]-2-piperidyl]ethanamine N-methyl-2-[(2R)-1-[(3S)-quinucl…
| 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) | 1.94 | 5.9 | -100.05 | 3 | 3 | 2 | 24 | 253.434 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 3.47 | -39.31 | 2 | 3 | 1 | 23 | 252.426 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 5.33 | -100.47 | 3 | 3 | 2 | 24 | 253.434 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 7.76 | -199.31 | 4 | 3 | 3 | 25 | 254.442 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
