| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: 2-[4-[(1S,2R)-2-amino-1-(p-tolyl)propoxy]phenyl]acetonitrile 2-[4-[(1S,2R)-2-amino-1-(p-tolyl…
| 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) | 3.20 | 8.11 | -51.39 | 3 | 3 | 1 | 61 | 281.379 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 8.11 | -9.6 | 2 | 3 | 0 | 59 | 280.371 | 5 | ↓ |
