AZD6538   Click here for help

GtoPdb Ligand ID: 6440

Synonyms: AZD 6538 | AZD-6538
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 99.39
Molecular weight 291.06
XLogP 2.55
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES N#Cc1ccc(nc1)c1noc(n1)c1cc(F)cc(c1)C#N
Isomeric SMILES N#Cc1ccc(nc1)c1noc(n1)c1cc(F)cc(c1)C#N
InChI InChI=1S/C15H6FN5O/c16-12-4-10(7-18)3-11(5-12)15-20-14(21-22-15)13-2-1-9(6-17)8-19-13/h1-5,8H
InChI Key PBVKGEMPZBKZOA-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
6-[5-(3-cyano-5-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyridine-3-carbonitrile
Synonyms Click here for help
AZD 6538 | AZD-6538
Database Links Click here for help
Specialist databases
GPCRdb Ligand AZD6538
Other databases
ChEMBL Ligand CHEMBL2164552
GtoPdb PubChem SID 178103056
PubChem CID 9879103
Search Google for chemical match using the InChIKey PBVKGEMPZBKZOA-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey PBVKGEMPZBKZOA-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey PBVKGEMPZBKZOA-UHFFFAOYSA-N