In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 25 | No |
Popular Name: (6S)-6-phenyl-6-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)hexanoic (6S)-6-phenyl-6-(2,4,5-trimethyl…
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) | 3.98 | 12.3 | -50.07 | 0 | 4 | -1 | 74 | 339.411 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.98 | 10.33 | -11.44 | 1 | 4 | 0 | 71 | 340.419 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.98 | 10.32 | -10.79 | 1 | 4 | 0 | 71 | 340.419 | 7 | ↓ |