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GPCR

NameType-1A angiotensin II receptor
SpeciesRattus norvegicus (Rat)
GeneAgtr1
SynonymAngiotensin II type-1A receptor
AT1A
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMALNSSAEDGIKRIQDDCPKAGRHSYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIHRNVYFIENTNITVCAFHYESRNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCKISDIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSSLSTKMSTLSYRPSDNMSSSAKKPASCFEVE
UniProtP25095
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL329
IUPHAR34
DrugBankN/A

Ligand

NameSCHEMBL6447967
Molecular formulaC25H26BrN3O5S
IUPAC namemethyl 2-[2-(6-bromo-4-methyl-2-propylbenzimidazol-1-yl)ethoxy]-5-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]benzoate
Molecular weight560.463
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.3
Synonymsmethyl 2-(2-(6-bromo-4-methyl-2-propyl-1H-benzo[d]imidazol-1-yl)ethoxy)-5-((2,4-dioxothiazolidin-5-yl)methyl)benzoate
OQMNGYMSUWNTIE-UHFFFAOYSA-N
CHEMBL2260186
Inchi KeyOQMNGYMSUWNTIE-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26BrN3O5S/c1-4-5-21-27-22-14(2)10-16(26)13-18(22)29(21)8-9-34-19-7-6-15(11-17(19)24(31)33-3)12-20-23(30)28-25(32)35-20/h6-7,10-11,13,20H,4-5,8-9,12H2,1-3H3,(H,28,30,32)
PubChem CID59984621
ChEMBLCHEMBL2260186
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Ki<10000.0 nMMed Chem Res, (2009) 18:7:589ChEMBL

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