| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2011 | 18 | Yes |
Popular Name: 2-[methyl(2-piperazin-1-ylethyl)amino]pyridine-4-carbonitrile 2-[methyl(2-piperazin-1-ylethyl)…
| 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) | 0.17 | 4.19 | -43.39 | 2 | 5 | 1 | 60 | 246.338 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.17 | 2.83 | -6.29 | 1 | 5 | 0 | 55 | 245.33 | 4 | ↓ |
