01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Scopoline
- Molecular Formula
- C8H13NO2
- Molecular Weight
- No data
- Canonical SMILES
- CN1C2CC3CC1C(C2O)O3
- Isomeric SMILES
- CN1[C@H]2C[C@H]3C[C@@H]1[C@@H]([C@H]2O)O3
- InChI
- InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3/t4-,5-,6+,7-,8-/m0/s1
- Oral Bioavailability
- 50.032
- Drug Likeness
- 0.516
- 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.
Active Targets
ingredient target1 Targets