01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Tolualdehydes
- Molecular Formula
- C8H8O
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC=C(C=C1)C=O
- Isomeric SMILES
- CC1=CC=C(C=C1)C=O
- InChI
- InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3
- Oral Bioavailability
- 44.177
- Drug Likeness
- 0.516
- DL Score
- No data
- Caco-2 Permeability
- No data
- ALogP
- No data
- Bioavailability Score
- No data
Identifiers
- InChI Key
- No data
- PubChem CID
- No data
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.
Active Targets
ingredient target4 Targets