01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 7
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Bufothionine
- Molecular Formula
- C12H15N2O3S+
- Molecular Weight
- No data
- Canonical SMILES
- C[N+]1(CCC2=CNC3=C2C1=C(C=C3)OS(=O)O)C
- Isomeric SMILES
- C[N+]1(CCC2=CNC3=C2C1=C(C=C3)OS(=O)O)C
- InChI
- InChI=1S/C12H14N2O3S/c1-14(2)6-5-8-7-13-9-3-4-10(17-18(15)16)12(14)11(8)9/h3-4,7,13H,5-6H2,1-2H3/p+1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.644
- 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 target4 Targets