| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 18 | Yes |
Popular Name: 3-[2-[2-hydroxyethyl(propyl)amino]ethoxy]benzonitrile 3-[2-[2-hydroxyethyl(propyl)amin…
| 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) | 2.00 | 5.42 | -41.42 | 2 | 4 | 1 | 58 | 249.334 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 3.25 | -7.46 | 1 | 4 | 0 | 56 | 248.326 | 8 | ↓ |
