MRS1067

Ligand id: 466

Name: MRS1067

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 35.53
Molecular weight 362.05
XLogP 5.6
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3,6-dichloro-2-(4-methyl-2-propan-2-yloxyphenyl)chromen-4-one
Synonyms
MRS-1067
Database Links
BindingDB Ligand 50053924
CAS Registry No. 70460-45-6
ChEMBL Ligand CHEMBL89093
PubChem CID 252716
Search Google for chemical match using the InChIKey PWGZOUCWGRTPSM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PWGZOUCWGRTPSM
Search UniChem for chemical match using the InChIKey PWGZOUCWGRTPSM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PWGZOUCWGRTPSM