01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2,3,4-trimethylpentane
- Molecular Formula
- C8H18
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)C(C)C(C)C
- Isomeric SMILES
- CC(C)C(C)C(C)C
- InChI
- InChI=1S/C8H18/c1-6(2)8(5)7(3)4/h6-8H,1-5H3
- Oral Bioavailability
- 39.071
- Drug Likeness
- 0.517
- 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.
Source Herbs
herb ingredient1 Herbs