In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2009 | 30 | Yes |
Popular Name: 6-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]sulfonyl-1,4-dihydroquinoxaline-2,3-dione 6-[4-[2-oxo-2-(1-piperidyl)ethyl…
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) | -0.83 | 1.45 | -22.16 | 2 | 10 | 0 | 127 | 435.506 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.08 | -0.68 | -58.09 | 1 | 10 | -1 | 130 | 434.498 | 4 | ↓ |