In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 19 | Yes |
Popular Name: 3-[4-[2-(2-methoxyethylamino)-2-oxo-ethyl]piperazin-1-yl]propanoic 3-[4-[2-(2-methoxyethylamino)-2-…
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) | -0.66 | 1.95 | -48.99 | 2 | 7 | 0 | 86 | 273.333 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.66 | -0.34 | -50.87 | 1 | 7 | -1 | 85 | 272.325 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 1.85 | -64.91 | 2 | 7 | 0 | 86 | 273.333 | 8 | ↓ |