In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 26 | Yes |
Popular Name: 1-phenyl-4-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]pyrazine-2,3-dione 1-phenyl-4-[[3-(2-pyridyl)-1,2,4…
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) | 1.09 | 7.09 | -27 | 0 | 8 | 0 | 96 | 347.334 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.09 | 7.64 | -46.25 | 1 | 8 | 1 | 97 | 348.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.