Molecule card · MolClass #41878
7975225
7975225: 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
- 7975225Mitochondrial Fusion · compound_name
- MolClass ID
- 41878
- InChIKey
- KWWFSXZQXDGLHW-UHFFFAOYSA-N
- Canonical SMILES
- C=CCC2CCCCC12(NC(=O)NC1(=O))
- Standard InChI
- InChI=1S/C11H16N2O2/c1-2-5-8-6-3-4-7-11(8)9(14)12-10(15)13-11/h2,8H,1,3-7H2,(H2,12,13,14,15)
- Stored Murcko scaffold
- [CH]1N[CH]C2(N1)CCCCC2
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
- 4
- CDK 2.12 · 2026-08-19
- Hydrogen bond donors
- 2
- CDK 2.12 · 2026-08-19
- Rotatable bonds
- 2
- CDK 2.12 · 2026-08-19
- Topological polar surface area
- 58.2 Ų
- CDK 2.12 · 2026-08-19
- Molecular weight
- 208.257 g/mol
- CDK 2.12 · 2026-08-19
- XLogP
- 1.761
- 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 · 7975225