In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 32 | Yes |
Popular Name: 6-[[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]sulfonyl]-1,4-dihydroquinoxaline-2,3-dione 6-[[4-[2-(4-ethoxyphenyl)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) | 2.73 | 6.75 | -21.58 | 2 | 8 | 0 | 112 | 457.552 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 5.69 | -50.6 | 1 | 8 | -1 | 115 | 456.544 | 7 | ↓ |