| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2009 | 16 | Yes |
Popular Name: 2-[(2S)-3-(dimethylamino)-2-hydroxy-propoxy]benzonitrile 2-[(2S)-3-(dimethylamino)-2-hydr…
| 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) | 1.09 | 4.26 | -44.7 | 2 | 4 | 1 | 58 | 221.28 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 1.75 | -11.99 | 1 | 4 | 0 | 56 | 220.272 | 5 | ↓ |
