| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2012 | 20 | Yes |
Popular Name: 2-ethyl-1-[4-(3-pyridylmethyl)piperazin-1-yl]butan-1-one 2-ethyl-1-[4-(3-pyridylmethyl)pi…
| 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) | 1.84 | 5.65 | -9.78 | 0 | 4 | 0 | 36 | 275.396 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 7.61 | -50.31 | 1 | 4 | 1 | 38 | 276.404 | 5 | ↓ |
