Molecule card · MolClass #36073
24810967
24810967: molecular structure, identifiers, source datasets and 0 saved model results in MolClass.
1 source records · 0 model builds with saved results
Explore classification modelsStructure and identifiers
- Imported compound names
- 24810967Mitochondrial Fusion · compound_name
- MolClass ID
- 36073
- InChIKey
- OZXRPFRWXFYYMZ-UHFFFAOYSA-N
- Canonical SMILES
- c1ccc2cc(ccc2(c1))C3N4CCCN34
- Standard InChI
- InChI=1S/C14H14N2/c1-2-5-12-10-13(7-6-11(12)4-1)14-15-8-3-9-16(14)15/h1-2,4-7,10,14H,3,8-9H2
- Stored Murcko scaffold
- c1ccc2cc(ccc2c1)C3N4N3CCC4
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
- 1
- CDK 2.12 · 2026-08-19
- Topological polar surface area
- 6.02 Ų
- CDK 2.12 · 2026-08-19
- Molecular weight
- 210.275 g/mol
- CDK 2.12 · 2026-08-19
- XLogP
- 2.548
- 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.
Mitochondrial Fusion
Dataset #19 · 24810967