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GPCR

NameBeta-2 adrenergic receptor
SpeciesCavia porcellus (Guinea pig)
GeneAdrb2
SynonymBeta-2 adrenoceptor
Beta-2 adrenoreceptor
DiseaseN/A for non-human GPCRs
Length418
Amino acid sequenceMGHLGNGSDFLLAPNASHAPDHNVTRERDEAWVVGMAIVMSLIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMNMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVVILMVWVVSGLTSFLPIQMHWYRATHKDAINCYAEETCCDFFTNQAYAIASSIVSFYLPLVVMVFVYSRVFQVAKKQLQKIDRSEGRFHTQNLSQVEQDGRSGHGLRRSSKFYLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIPKEVYILLNWVGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSALKAYGNDCSSNSNGKTDYTGEPNVCHQGQEKERELLCEDPPGTEDLVSCPGTVPSDSIDSQGRNYSTNDSLL
UniProtQ8K4Z4
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5414
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL320491
Molecular formulaC23H30N2O5S2
IUPAC name4-hydroxy-7-[2-[2-[3-(3-phenylpropoxy)propylsulfonyl]ethylamino]ethyl]-3H-1,3-benzothiazol-2-one
Molecular weight478.622
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP3.1
SynonymsN/A
Inchi KeyBYRVHAVDWNACIF-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H30N2O5S2/c26-20-10-9-19(22-21(20)25-23(27)31-22)11-12-24-13-17-32(28,29)16-5-15-30-14-4-8-18-6-2-1-3-7-18/h1-3,6-7,9-10,24,26H,4-5,8,11-17H2,(H,25,27)
PubChem CID44338897
ChEMBLCHEMBL320491
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
Beta2 duration157.0 minPMID12852752ChEMBL
Intrinsic activity0.36 -PMID12852752ChEMBL
p[A]507.35 -PMID12852752ChEMBL

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