01
- Entity Type
- Ingredients
- Relation Groups
- 5
- Relation Preview
- 27
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- TERT-BUTYLTOLUENE
- Molecular Formula
- No data
- Molecular Weight
- 442.800
- Canonical SMILES
- CC1=CC=CC=C1C(C)(C)C
- Isomeric SMILES
- No data
- InChI
- No data
- Oral Bioavailability
- 53.965
- Drug Likeness
- No data
- DL Score
- No data
- Caco-2 Permeability
- No data
- ALogP
- No data
- Bioavailability Score
- No data
Identifiers
- InChI Key
- No data
- PubChem CID
- 92802
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.
Related TCM Symptoms
ingredient tcm symptom8 TCM Symptoms
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