| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2011 | 18 | No |
Popular Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridine-2-thiol 3-(3-phenyl-1,2,4-oxadiazol-5-yl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1325306-73-7 , [1325306-73-7]
None
| 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) | 2.44 | 6.49 | -28.86 | 1 | 4 | 0 | 55 | 255.302 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6.17 | -51.16 | 0 | 4 | -1 | 52 | 254.294 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
