| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2011 | 21 | Yes |
Popular Name: 2-[4-(2-dimethylaminoethyl)piperazin-1-yl]-4,6-dimethyl-pyridine-3-carbonitrile 2-[4-(2-dimethylaminoethyl)piper…
| 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) | 1.58 | 7.42 | -38.46 | 1 | 5 | 1 | 48 | 288.419 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 4.96 | -6.92 | 0 | 5 | 0 | 46 | 287.411 | 4 | ↓ |
