| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: 4-[(2S)-2-hydroxy-3-(3-pyridylmethylamino)propoxy]benzonitrile 4-[(2S)-2-hydroxy-3-(3-pyridylme…
| 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) | 1.05 | 4.25 | -57.96 | 3 | 5 | 1 | 83 | 284.339 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 2.9 | -11.79 | 2 | 5 | 0 | 78 | 283.331 | 7 | ↓ |
