In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | No |
Popular Name: (E)-4-[4-[2-(dimethylamino)-2-oxo-ethyl]piperazin-1-yl]-4-oxo-but-2-enoic (E)-4-[4-[2-(dimethylamino)-2-ox…
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) | -1.77 | 2.91 | -51.36 | 0 | 7 | -1 | 84 | 268.293 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.77 | 5.06 | -71.88 | 1 | 7 | 0 | 85 | 269.301 | 4 | ↓ |