| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2010 | 33 | Yes |
Popular Name: (2S,3S)-2-benzhydryl-N-[(5-ethyl-2-methoxy-phenyl)methyl]quinuclidin-3-amine (2S,3S)-2-benzhydryl-N-[(5-ethyl…
| 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) | 6.22 | 16.1 | -33.16 | 2 | 3 | 1 | 26 | 441.639 | 8 | ↓ |
| Mid Mid (pH 6-8) | 6.22 | 14.28 | -30.91 | 2 | 3 | 1 | 29 | 441.639 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0790825A1; US5340826; US5393762; US5519033; US5576317; US5990125; WO1996014845A1; WO1997013514A1; WO2000071107A2 | IBM Patent Data |
