| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 16 | Yes |
Popular Name: 5-[2-dimethylaminoethyl(isobutyl)amino]pentanenitrile 5-[2-dimethylaminoethyl(isobutyl…
| 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) | 1.73 | 7.07 | -43.62 | 1 | 3 | 1 | 31 | 226.388 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 7.96 | -39.82 | 1 | 3 | 1 | 31 | 226.388 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 9.39 | -117.89 | 2 | 3 | 2 | 33 | 227.396 | 9 | ↓ |
