| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2009 | 21 | Yes |
Popular Name: 4-[[[(1S)-1-(4-methoxyphenyl)propyl]amino]methyl]benzonitrile 4-[[[(1S)-1-(4-methoxyphenyl)pro…
| 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) | 2.87 | 9.45 | -53.71 | 2 | 3 | 1 | 50 | 281.379 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 8.26 | -7.07 | 1 | 3 | 0 | 45 | 280.371 | 6 | ↓ |
