| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 20 | Yes |
Popular Name: 2-[(2S)-3-[2-cyanoethyl(ethyl)amino]-2-hydroxy-propoxy]benzonitrile 2-[(2S)-3-[2-cyanoethyl(ethyl)am…
| 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) | 0.92 | 3.92 | -16.1 | 1 | 5 | 0 | 80 | 273.336 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 6.29 | -57.9 | 2 | 5 | 1 | 81 | 274.344 | 8 | ↓ |
