| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2006 | 18 | Yes |
Popular Name: 2-(4-hydroxy-3-methoxy-phenyl)-2-(1-piperidyl)acetonitrile 2-(4-hydroxy-3-methoxy-phenyl)-2…
| 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) | 1.96 | 5.66 | -43.54 | 2 | 4 | 1 | 58 | 247.318 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 3.73 | -7.59 | 1 | 4 | 0 | 56 | 246.31 | 3 | ↓ |
