MRS1065

Ligand id: 395

Name: MRS1065

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 48.67
Molecular weight 318.09
XLogP 5.5
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-methoxy-7-[(E)-2-phenylethenyl]pyrano[3,2-f][1]benzoxol-5-one
Synonyms
MRS 1065
Database Links
BindingDB Ligand 50051344
ChEMBL Ligand CHEMBL75590
PubChem CID 10710647
Search Google for chemical match using the InChIKey HTBFQFPYNPJVLO-BQYQJAHWSA-N
Search Google for chemicals with the same backbone HTBFQFPYNPJVLO
Search UniChem for chemical match using the InChIKey HTBFQFPYNPJVLO-BQYQJAHWSA-N
Search UniChem for chemicals with the same backbone HTBFQFPYNPJVLO