01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 6
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-isopropyl-2,5-dimethyl-cyclohexanone
- Molecular Formula
- C11H20O
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCC(C(=O)C1)(C)C(C)C
- Isomeric SMILES
- CC1CCC(C(=O)C1)(C)C(C)C
- InChI
- InChI=1S/C11H20O/c1-8(2)11(4)6-5-9(3)7-10(11)12/h8-9H,5-7H2,1-4H3
- Oral Bioavailability
- 64.582
- Drug Likeness
- 0.588
- 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