| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2010 | 20 | Yes |
Popular Name: 4-[(2S)-2-hydroxy-3-[[(1R)-2-methoxy-1-methyl-ethyl]-methyl-amino]propoxy]benzonitrile 4-[(2S)-2-hydroxy-3-[[(1R)-2-met…
| 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) | 1.45 | 4.68 | -43.66 | 2 | 5 | 1 | 67 | 279.36 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 2.3 | -9.52 | 1 | 5 | 0 | 66 | 278.352 | 8 | ↓ |
