tryptanthrin

Ligand id: 8224

Name: tryptanthrin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 0
Topological polar surface area 37.38
Molecular weight 248.06
XLogP 3.18
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
Indolo[2,1-b]quinazoline-6,12-dione
Synonyms
couroupitine a
GNF-PF-2691
Database Links
CAS Registry No. 13220-57-0
ChEBI CHEBI:9768
ChEMBL Ligand CHEMBL306946
PubChem CID 73549
Search Google for chemical match using the InChIKey VQQVWGVXDIPORV-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VQQVWGVXDIPORV
Comments
Tryptanthrin acts as an inhibitor of indoleamine 2,3-dioxygenase 1 (IDO1) [1]. Tryptanthrin is found in plants used in traditional Chinese medicine (Persicaria tinctorium and Isatis tinctoria).