MRS1041

Ligand id: 392

Name: MRS1041

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 53.99
Molecular weight 354.15
XLogP 5.01
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3,5,7-triethoxy-2-phenylchromen-4-one
Synonyms
3,5,7-triethoxyflavone | MRS-1041
Database Links
BindingDB Ligand 50051347
ChEMBL Ligand CHEMBL72862
PubChem CID 10247549
Search Google for chemical match using the InChIKey YMQQPRDUZIXHBJ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YMQQPRDUZIXHBJ
Search UniChem for chemical match using the InChIKey YMQQPRDUZIXHBJ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YMQQPRDUZIXHBJ