01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 4
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
- Molecular Formula
- C10H7NO3
- Molecular Weight
- No data
- Canonical SMILES
- C1=CC=C2C(=C1)C(=CNC2=O)C(=O)O
- Isomeric SMILES
- C1=CC=C2C(=C1)C(=CNC2=O)C(=O)O
- InChI
- InChI=1S/C10H7NO3/c12-9-7-4-2-1-3-6(7)8(5-11-9)10(13)14/h1-5H,(H,11,12)(H,13,14)
- Oral Bioavailability
- No data
- Drug Likeness
- 0.708
- 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