01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 3,4,5-hemimellitenol
- Molecular Formula
- C9H12O
- Molecular Weight
- No data
- Canonical SMILES
- CC1=CC(=CC(=C1C)C)O
- Isomeric SMILES
- CC1=CC(=CC(=C1C)C)O
- InChI
- InChI=1S/C9H12O/c1-6-4-9(10)5-7(2)8(6)3/h4-5,10H,1-3H3
- Oral Bioavailability
- 39.879
- Drug Likeness
- 0.580
- 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.