MRS1042

Ligand id: 393

Name: MRS1042

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 53.99
Molecular weight 396.19
XLogP 6.08
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-phenyl-3,5,7-tripropoxychromen-4-one
Synonyms
MRS-1042
Database Links
BindingDB Ligand 50051337
ChEMBL Ligand CHEMBL76273
PubChem CID 10500941
Search Google for chemical match using the InChIKey ABZJCSJCNNCZRY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ABZJCSJCNNCZRY
Search UniChem for chemical match using the InChIKey ABZJCSJCNNCZRY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ABZJCSJCNNCZRY