01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-isopropylnaphthalene
- Molecular Formula
- C13H14
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)C1=CC2=CC=CC=C2C=C1
- Isomeric SMILES
- CC(C)C1=CC2=CC=CC=C2C=C1
- InChI
- InChI=1S/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3
- Oral Bioavailability
- 31.854
- Drug Likeness
- 0.607
- 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