| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 3rd, 2011 | 21 | Yes |
Popular Name: 2-(diethylamino)-1-[4-(2-pyridylmethyl)piperazin-1-yl]ethanone 2-(diethylamino)-1-[4-(2-pyridyl…
| 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) | 0.56 | 5.87 | -38.56 | 1 | 5 | 1 | 41 | 291.419 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 3.87 | -10.3 | 0 | 5 | 0 | 40 | 290.411 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 6.59 | -77.95 | 2 | 5 | 2 | 42 | 292.427 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 8.08 | -94.89 | 2 | 5 | 2 | 42 | 292.427 | 6 | ↓ |
