In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | No |
Popular Name: 1-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-piperazin-1-yl-ethane-1,2-dione 1-(3-oxo-2,4-dihydroquinoxalin-1…
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) | -0.63 | 1.79 | -51.63 | 3 | 7 | 1 | 86 | 289.315 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.63 | 0.47 | -10.63 | 2 | 7 | 0 | 82 | 288.307 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.