In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2008 | 31 | Yes |
Popular Name: [(1S)-2-(2,2-dimethyl-3-oxo-4H-quinoxalin-1-yl)-1-methyl-2-oxo-ethyl] [(1S)-2-(2,2-dimethyl-3-oxo-4H-q…
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) | 2.44 | 7.78 | -13.05 | 2 | 8 | 0 | 109 | 419.437 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 5.65 | -56.51 | 1 | 8 | -1 | 112 | 418.429 | 4 | ↓ |