01
- Entity Type
- Ingredients
- Relation Groups
- 4
- Relation Preview
- 25
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2-methyl-butanol-1-ol
- Molecular Formula
- C5H12O2
- Molecular Weight
- No data
- Canonical SMILES
- CCC(C)C(O)O
- Isomeric SMILES
- CC[C@@H](C)C(O)O
- InChI
- InChI=1S/C5H12O2/c1-3-4(2)5(6)7/h4-7H,3H2,1-2H3/t4-/m1/s1
- Oral Bioavailability
- 84.217
- Drug Likeness
- 0.496
- 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