In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 24 | Yes |
Popular Name: 3-phenyl-4-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]-1,2,4-oxadiazol-5-one 3-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) | 1.88 | 6.22 | -18.82 | 0 | 8 | 0 | 100 | 321.296 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.88 | 6.78 | -40.46 | 1 | 8 | 1 | 101 | 322.304 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.