| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2009 | 17 | Yes |
Popular Name: 2-[(2S)-3-[ethyl(methyl)amino]-2-hydroxy-propoxy]benzonitrile 2-[(2S)-3-[ethyl(methyl)amino]-2…
| 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) | 1.46 | 4.94 | -44.33 | 2 | 4 | 1 | 58 | 235.307 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 2.56 | -11.97 | 1 | 4 | 0 | 56 | 234.299 | 6 | ↓ |
