| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 4-[[6-(4-acetylpiperazin-1-yl)-3-pyridyl]amino]-4-oxo-butanoic 4-[[6-(4-acetylpiperazin-1-yl)-3…
| 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) | -0.47 | 3.45 | -55.13 | 1 | 8 | -1 | 106 | 319.341 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.47 | 3.74 | -76.02 | 2 | 8 | 0 | 107 | 320.349 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.47 | 2.62 | -52.06 | 3 | 8 | 1 | 104 | 321.357 | 5 | ↓ |
