Molecule card · MolClass #1592
Hydralazine hydrochloride
Hydralazine hydrochloride: 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
- Hydralazine hydrochlorideFlucanozole Synergizer · compound_name
- MolClass ID
- 1592
- InChIKey
- WPBPIIQLGGMJCS-FLIBITNWSA-N
- Canonical SMILES
- NN=C2N=NC=C1C=CC=CC12
- Standard InChI
- InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5,7H,9H2/b11-8-
- Stored Murcko scaffold
- N1=N[CH]C2C=CC=CC2=C1
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.
- NOCAS_M5#7287
- Cl.NN=C1N=NC=C2C=CC=CC21#155323
Calculated molecular properties
Stored descriptor calculations, not measured experimental values.
- Hydrogen bond acceptors
- 4
- CDK 2.12 · 2026-08-19
- Hydrogen bond donors
- 1
- CDK 2.12 · 2026-08-19
- Rotatable bonds
- 0
- CDK 2.12 · 2026-08-19
- Topological polar surface area
- 63.1 Ų
- CDK 2.12 · 2026-08-19
- Molecular weight
- 160.176 g/mol
- CDK 2.12 · 2026-08-19
- XLogP
- 0.866
- 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.
Flucanozole Synergizer
Dataset #3 · Hydralazine hydrochloride
Ames Categorization
Dataset #6 · 304-20-1