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GPCR

NameBeta-2 adrenergic receptor
SpeciesCanis lupus familiaris (Dog)
GeneADRB2
SynonymBeta-2 adrenoceptor
Beta-2 adrenoreceptor
DiseaseN/A for non-human GPCRs
Length415
Amino acid sequenceMGQPANRSVFLLAPNGSHAPDQGDSQERSEAWVVGMGIVMSLIVLAIVFGNVLVITAIARFERLQTVTNYFITSLACADLVMGLAVVPFGASHILMKMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHQEAINCYAKETCCDFFTNQAYAIASSIVSFYLPLVVMVFVYSRVFQVAQRQLQKIDRSEGRFHAQNLSQVEQDGRSGHGHRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIPKEVYILLNWVGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSLKAYGNGYSNNSNSRSDYAGEHSGCHLGQEKDSELLCEDPPGTEDRQGTVPSDSVDSQGRNCSTNDSLL
UniProtP54833
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2289
IUPHARN/A
DrugBankN/A

Ligand

Name4-Hydroxypropranolol
Molecular formulaC16H21NO3
IUPAC name4-[2-hydroxy-3-(propan-2-ylamino)propoxy]naphthalen-1-ol
Molecular weight275.348
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.6
SynonymsAC1Q7AX5
10476-53-6
4-[2-Hydroxy-3-(isopropylamino)propoxy]-1-naphthol #
BDBM50405147
4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)-1-naphthalenol
[ Show all ]
Inchi KeyCWEPACWBWIOYID-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H21NO3/c1-11(2)17-9-12(18)10-20-16-8-7-15(19)13-5-3-4-6-14(13)16/h3-8,11-12,17-19H,9-10H2,1-2H3
PubChem CID91565
ChEMBLCHEMBL1137
IUPHARN/A
BindingDB50405147
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Kd2.399 nMPMID6330358ChEMBL
Kd2.4 nMPMID6330358BindingDB
Vasodilation4.82 -PMID2861287ChEMBL

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