In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2009 | 28 | No |
Popular Name: 3-[[3-[2-(2-carboxyethylamino)ethyl]-5-ethoxy-4-ethoxycarbonyl-5-oxo-pentyl]amino]propanoic 3-[[3-[2-(2-carboxyethylamino)et…
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) | -0.03 | 9.7 | -117.86 | 4 | 10 | 0 | 166 | 404.46 | 19 | ↓ |
Hi High (pH 8-9.5) | -0.03 | 8.39 | -93.51 | 3 | 10 | -1 | 161 | 403.452 | 19 | ↓ |