MRS1486

Ligand id: 472

Name: MRS1486

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 81.56
Molecular weight 385.17
XLogP 7.06
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
ethyl 4-ethyl-5-ethylsulfanylcarbonyl-2-phenyl-6-propylpyridine-3-carboxylate
Synonyms
MRS-1486
Database Links
BindingDB Ligand 50190440
ChEMBL Ligand CHEMBL322524
PubChem CID 9843120
Search Google for chemical match using the InChIKey GSMBGLUYORHXJR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GSMBGLUYORHXJR
Search UniChem for chemical match using the InChIKey GSMBGLUYORHXJR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GSMBGLUYORHXJR