| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 20 | Yes |
Popular Name: 3-[(1S,2R)-2-amino-1-(4-fluorophenyl)propoxy]benzonitrile 3-[(1S,2R)-2-amino-1-(4-fluoroph…
| 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) | 2.68 | 6.72 | -51.1 | 3 | 3 | 1 | 61 | 271.315 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 6.72 | -8.18 | 2 | 3 | 0 | 59 | 270.307 | 4 | ↓ |
