01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (2s)-heptan-2-amine
- Molecular Formula
- C7H17N
- Molecular Weight
- No data
- Canonical SMILES
- CCCCCC(C)N
- Isomeric SMILES
- CCCCC[C@H](C)N
- InChI
- InChI=1S/C7H17N/c1-3-4-5-6-7(2)8/h7H,3-6,8H2,1-2H3/t7-/m0/s1
- Oral Bioavailability
- 46.442
- Drug Likeness
- 0.556
- 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