Molecule card · MolClass #2384
2-[5-(4-biphenylyl)-1,2,4-oxadiazol-3-yl]pyridine
2-[5-(4-biphenylyl)-1,2,4-oxadiazol-3-yl]pyridine: molecular structure, identifiers, source datasets and 0 saved model results in MolClass.
2 source records · 0 model builds with saved results
Explore classification modelsStructure and identifiers
- Imported compound names
- 2-[5-(4-biphenylyl)-1,2,4-oxadiazol-3-yl]pyridineCompound accumulation in C. elegans · compound_name7975271Mitochondrial Fusion · compound_name
- MolClass ID
- 2384
- InChIKey
- QWGJENMOSGJVGI-UHFFFAOYSA-N
- Canonical SMILES
- c1ccc(cc1)c2ccc(cc2)c3nc(no3)c4ccccn4
- Standard InChI
- InChI=1S/C19H13N3O/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)19-21-18(22-23-19)17-8-4-5-13-20-17/h1-13H
- Stored Murcko scaffold
- n1oc(nc1-c2ncccc2)-c3ccc(cc3)-c4ccccc4
Registry normalization: MIGRATED_RAW. A registry entry does not establish drug approval or clinical use.
Molecules with the same Murcko scaffold
Exact matches to the stored ring-and-linker framework. Sharing a scaffold does not by itself establish activity or applicability to a model.
No other molecules currently have this stored scaffold.
Calculated molecular properties
Stored descriptor calculations, not measured experimental values.
- Hydrogen bond acceptors
- 2
- CDK 2.12 · 2026-08-19
- Hydrogen bond donors
- 0
- CDK 2.12 · 2026-08-19
- Rotatable bonds
- 3
- CDK 2.12 · 2026-08-19
- Topological polar surface area
- 51.81 Ų
- CDK 2.12 · 2026-08-19
- Molecular weight
- 299.327 g/mol
- CDK 2.12 · 2026-08-19
- XLogP
- 4.881
- CDK 2.12 · 2026-08-19
Saved model predictions
Computational predictions, not experimental measurements or clinical guidance. Results depend on the model build; applicability indicates similarity to its training chemistry.
No saved predictions yet. Explore classification models to choose a prediction.
Source datasets
Dataset registrations and identifiers stored in MolClass.
Compound accumulation in C. elegans
Dataset #4 · 20.2617264200224
Mitochondrial Fusion
Dataset #19 · 7975271