AZD1981

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Ligands
AZD1981

Ligand id: 7680

Name: AZD1981

Structure and Physico-chemical Properties

2D Structure

Calculated Physico-chemical Properties
Hydrogen bond acceptors	5
Hydrogen bond donors	2
Rotatable bonds	6
Topological polar surface area	96.63
Molecular weight	388.06
XLogP	3.92
No. Lipinski's rules broken	0

Molecular properties generated using the CDK

Classification
Compound class	Synthetic organic

IUPAC Name
2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid

IUPAC Name

2-[4-acetamido-3-(4-chlorophenyl)sulfanyl-2-methylindol-1-yl]acetic acid

Synonyms
AZD 1981 \| AZD-1981

Synonyms

AZD 1981 | AZD-1981

Database Links
CAS Registry No.	802904-66-1 (source: SciFinder)
ChEMBL Ligand	CHEMBL1914489
GtoPdb PubChem SID	223366015
PubChem CID	11292191
Search Google for chemical match using the InChIKey	JWYIGNODXSRKGP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone	JWYIGNODXSRKGP
Search UniChem for chemical match using the InChIKey	JWYIGNODXSRKGP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone	JWYIGNODXSRKGP

Comments
AZD1981 was an investigational compound being assessed as a potential treatment for asthma. This compound is now included for repurposing in the AstaZeneca's Open Innovation Pharmacology Toolbox. It was also Case Study (2) in the AZ 2014 review paper[1].

Comments

AZD1981 was an investigational compound being assessed as a potential treatment for asthma. This compound is now included for repurposing in the AstaZeneca's Open Innovation Pharmacology Toolbox. It was also Case Study (2) in the AZ 2014 review paper[1].