| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2006 | 19 | No |
Popular Name: 4-[3-[4-(bromomethyl)phenyl]-1,2,4-oxadiazol-5-yl]pyridine 4-[3-[4-(bromomethyl)phenyl]-1,2…
| 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) | 3.14 | -1.07 | -7.46 | 0 | 4 | 0 | 51 | 316.158 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50600-1-O | Vaccinia Virus (cluster #1 Of 2), Other | Other | 1300 | 0.43 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50600 | Z50600 | Vaccinia Virus | 1300 | 0.43 | Functional ≤ 10μM |
