Molecule card · MolClass #35651
24803479
24803479: 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
- 24803479Mitochondrial Fusion · compound_name
- MolClass ID
- 35651
- InChIKey
- ZIXMDVZYJGLMFN-UHFFFAOYSA-N
- Canonical SMILES
- Cc1ccc2c(c1)C(C)=CC(C)(C)[N+]2(C)(C)
- Standard InChI
- InChI=1S/C15H22N/c1-11-7-8-14-13(9-11)12(2)10-15(3,4)16(14,5)6/h7-10H,1-6H3/q+1
- Stored Murcko scaffold
- c1ccc2c(c1)C=CC[NH2+]2
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.
Calculated molecular properties
Stored descriptor calculations, not measured experimental values.
- Hydrogen bond acceptors
- 0
- CDK 2.12 · 2026-08-19
- Hydrogen bond donors
- 0
- CDK 2.12 · 2026-08-19
- Rotatable bonds
- 0
- CDK 2.12 · 2026-08-19
- Topological polar surface area
- 0 Ų
- CDK 2.12 · 2026-08-19
- Molecular weight
- 216.342 g/mol
- CDK 2.12 · 2026-08-19
- XLogP
- 3.193
- 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 · 24803479