| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | No |
Popular Name: (E)-4-oxo-4-[4-[2-oxo-2-(propylamino)ethyl]piperazin-1-yl]but-2-enoic (E)-4-oxo-4-[4-[2-oxo-2-(propyla…
| 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) | -0.19 | 2.63 | -50.75 | 1 | 7 | -1 | 93 | 282.32 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 4.76 | -72.32 | 2 | 7 | 0 | 94 | 283.328 | 6 | ↓ |
