In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 21 | Yes |
Popular Name: 3-[4-[2-(2-furylmethylamino)-2-oxo-ethyl]piperazin-1-yl]propanoic 3-[4-[2-(2-furylmethylamino)-2-o…
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) | 0.01 | 4.01 | -49.3 | 2 | 7 | 0 | 90 | 295.339 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 1.72 | -50.78 | 1 | 7 | -1 | 89 | 294.331 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.01 | 3.92 | -66.6 | 2 | 7 | 0 | 90 | 295.339 | 7 | ↓ |