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GPCR

NameType-1A angiotensin II receptor
SpeciesMus musculus (Mouse)
GeneAgtr1a
SynonymAngiotensin II type-1A receptor
AT1A
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMALNSSTEDGIKRIQDDCPRAGRHSYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIHRNVYFIENTNITVCAFHYESRNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCKIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSSLSTKMSTLSYRPSDNMSSAAKKPASCSEVE
UniProtP29754
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5741
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL498497
Molecular formulaC15H13ClO2
IUPAC name(3-methylphenyl)methyl 3-chlorobenzoate
Molecular weight260.717
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP5.0
Synonyms3-Methylbenzyl 3'-chlorobenzoate
ZINC40976628
Inchi KeyGJYXFQNHDIJJEF-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H13ClO2/c1-11-4-2-5-12(8-11)10-18-15(17)13-6-3-7-14(16)9-13/h2-9H,10H2,1H3
PubChem CID44587257
ChEMBLCHEMBL498497
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC5056.2 ug.mL-1PMID18672373ChEMBL

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