In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2009 | 20 | Yes |
Popular Name: (1S,4R,7R,8S)-7-(2-acetamidoethylcarbamoyl)bicyclo[2.2.2]oct-5-ene-8-carboxylic (1S,4R,7R,8S)-7-(2-acetamidoethy…
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) | -0.89 | 3.6 | -55.27 | 2 | 6 | -1 | 98 | 279.316 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.89 | 1.4 | -17.61 | 3 | 6 | 0 | 95 | 280.324 | 5 | ↓ |