| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 21 | Yes |
Popular Name: 4-[[[(1S)-1-(2-methoxyphenyl)ethyl]-methyl-amino]methyl]benzonitrile 4-[[[(1S)-1-(2-methoxyphenyl)eth…
| 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) | 3.46 | 10.33 | -45.52 | 1 | 3 | 1 | 37 | 281.379 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 8.39 | -6.55 | 0 | 3 | 0 | 36 | 280.371 | 5 | ↓ |
