In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 31st, 2008 | 24 | Yes |
Popular Name: 2,3-dioxo-N-[(1S)-1-(3-pyridyl)ethyl]-1,4-dihydroquinoxaline-6-sulfonamide 2,3-dioxo-N-[(1S)-1-(3-pyridyl)e…
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) | -0.50 | 0.39 | -19.93 | 3 | 8 | 0 | 125 | 346.368 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.50 | 0.28 | -41.37 | 2 | 8 | -1 | 127 | 345.36 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.40 | -1.77 | -55.41 | 2 | 8 | -1 | 128 | 345.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.50 | 0.87 | -55.45 | 4 | 8 | 1 | 126 | 347.376 | 4 | ↓ |