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GPCR

NameBeta-2 adrenergic receptor
SpeciesMus musculus (Mouse)
GeneAdrb2
Synonymbeta2-adrenoceptor
beta-2 adrenoreceptor
Beta-2 adrenoceptor
beta-2 adrenergic receptor
Adrb-2
[ Show all ]
DiseaseN/A for non-human GPCRs
Length418
Amino acid sequenceMGPHGNDSDFLLAPNGSRAPDHDVTQERDEAWVVGMAILMSVIVLAIVFGNVLVITAIAKFERLQTVTNYFIISLACADLVMGLAVVPFGASHILMKMWNFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYVAITSPFKYQSLLTKNKARVVILMVWIVSGLTSFLPIQMHWYRATHKKAIDCYTEETCCDFFTNQAYAIASSIVSFYVPLVVMVFVYSRVFQVAKRQLQKIDKSEGRFHAQNLSQVEQDGRSGHGLRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIRDNLIPKEVYILLNWLGYVNSAFNPLIYCRSPDFRIAFQELLCLRRSSSKTYGNGYSSNSNGRTDYTGEPNTCQLGQEREQELLCEDPPGMEGFVNCQGTVPSLSVDSQGRNCSTNDSPL
UniProtP18762
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3707
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL70539
Molecular formulaC27H31F3N2O3
IUPAC name(6R)-6-[[(2S)-2-hydroxy-3-naphthalen-1-yloxypropyl]amino]-N-[4-(trifluoromethyl)phenyl]heptanamide
Molecular weight488.551
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP5.4
Synonyms6-[2-Hydroxy-3-(naphthalen-1-yloxy)-propylamino]-heptanoic acid (4-trifluoromethyl-phenyl)-amide(S,R)
BDBM50010561
Inchi KeyMZPZPLOHGVBKAT-XXBNENTESA-N
Inchi IDInChI=1S/C27H31F3N2O3/c1-19(7-2-5-12-26(34)32-22-15-13-21(14-16-22)27(28,29)30)31-17-23(33)18-35-25-11-6-9-20-8-3-4-10-24(20)25/h3-4,6,8-11,13-16,19,23,31,33H,2,5,7,12,17-18H2,1H3,(H,32,34)/t19-,23+/m1/s1
PubChem CID14485430
ChEMBLCHEMBL70539
IUPHARN/A
BindingDB50010561
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Ki45900.0 nMPMID1967313BindingDB,ChEMBL
Relative potency0.017 -PMID1967313ChEMBL

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