| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 22 | Yes |
Popular Name: 6-methoxy-4-[2-[(3R,4S)-3-vinyl-4-piperidyl]ethyl]quinoline 6-methoxy-4-[2-[(3R,4S)-3-vinyl-…
| 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) | 3.86 | 8.1 | -45.92 | 2 | 3 | 1 | 39 | 297.422 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.86 | 8.54 | -81.6 | 3 | 3 | 2 | 40 | 298.43 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0031753A1; US4433150; US4505916 | IBM Patent Data |
