01
AICDA
No data
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 11
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Dur
- Molecular Formula
- C9H12N2O5
- Molecular Weight
- No data
- Canonical SMILES
- C1C(C(OC1N2C=CC(=O)NC2=O)CO)O
- Isomeric SMILES
- C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)CO)O
- InChI
- InChI=1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8+/m0/s1
- Oral Bioavailability
- 23.685
- Drug Likeness
- 0.552
- 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 target8 Targets
02
03
04
05
06
07
GABRA1
gamma-aminobutyric acid type A receptor subunit alpha1
gamma-aminobutyric acid type A receptor subunit alpha1
08