In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 22 | Yes |
Popular Name: (1R,4S,5S,6R)-5-(2-morpholinoethylcarbamoyl)bicyclo[2.2.2]oct-2-ene-6-carboxylic (1R,4S,5S,6R)-5-(2-morpholinoeth…
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) | -0.16 | 3.15 | -60.45 | 1 | 6 | -1 | 82 | 307.37 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.16 | 5.49 | -68.63 | 2 | 6 | 0 | 83 | 308.378 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.16 | 4.3 | -52.04 | 3 | 6 | 1 | 80 | 309.386 | 5 | ↓ |