| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2009 | 18 | Yes |
Popular Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propanenitrile 3-[2-(3,4-dimethoxyphenyl)ethyl-…
| 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) | 1.25 | 7.58 | -58.85 | 1 | 4 | 1 | 47 | 249.334 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 5.25 | -11.05 | 0 | 4 | 0 | 45 | 248.326 | 7 | ↓ |
