01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 14
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Benzylacetone
- Molecular Formula
- C10H12O
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)CCC1=CC=CC=C1
- Isomeric SMILES
- CC(=O)CCC1=CC=CC=C1
- InChI
- InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
- Oral Bioavailability
- 25.779
- Drug Likeness
- 0.642
- 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 target6 Targets