AC-98170

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Ligands
AC-98170

Ligand id: 9457

Name: AC-98170

Structure and Physico-chemical Properties

2D Structure

Calculated Physico-chemical Properties
Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	5
Topological polar surface area	98.8
Molecular weight	327.1
XLogP	5.17
No. Lipinski's rules broken	1

Molecular properties generated using the CDK

Classification
Compound class	Synthetic organic

IUPAC Name
(3S,4R)-2-oxo-4-phenyl-N-[(E)-1-thiophen-2-ylethylideneamino]pyrrolidine-3-carboxamide

IUPAC Name

(3S,4R)-2-oxo-4-phenyl-N-[(E)-1-thiophen-2-ylethylideneamino]pyrrolidine-3-carboxamide

Synonyms
AC98170

Synonyms

AC98170

Database Links
BindingDB Ligand	50412716
ChEMBL Ligand	CHEMBL494303
GtoPdb PubChem SID	329968397
PubChem CID	9696680
Search Google for chemical match using the InChIKey	GNFXCDMTRHENBV-CJINARDKSA-N
Search Google for chemicals with the same backbone	GNFXCDMTRHENBV
Search UniChem for chemical match using the InChIKey	GNFXCDMTRHENBV-CJINARDKSA-N
Search UniChem for chemicals with the same backbone	GNFXCDMTRHENBV

Comments
AC-98170 is a potent and selective small-molecule PAR2 agonist [1]. The compound is a metabolically stable pharmacological tool for studying PAR2 receptors.

Comments

AC-98170 is a potent and selective small-molecule PAR2 agonist [1]. The compound is a metabolically stable pharmacological tool for studying PAR2 receptors.