| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: 3-[ethyl-[2-(2-methylimidazol-1-yl)ethyl]amino]propanenitrile 3-[ethyl-[2-(2-methylimidazol-1-…
| 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) | -0.05 | 5.98 | -34.27 | 1 | 4 | 1 | 46 | 207.301 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 7.66 | -60.8 | 1 | 4 | 1 | 46 | 207.301 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 5.51 | -11.45 | 0 | 4 | 0 | 45 | 206.293 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 8.13 | -111.43 | 2 | 4 | 2 | 47 | 208.309 | 6 | ↓ |
