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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

NameCHEMBL41218
Molecular formulaC30H48N2O6
IUPAC name(2S)-1-[4-[6-[4-[(2S)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenoxy]hexoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
Molecular weight532.722
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP4.4
SynonymsN/A
Inchi KeyLDUAFBWPXSAQIM-UIOOFZCWSA-N
Inchi IDInChI=1S/C30H48N2O6/c1-23(2)31-19-25(33)21-37-29-13-9-27(10-14-29)35-17-7-5-6-8-18-36-28-11-15-30(16-12-28)38-22-26(34)20-32-24(3)4/h9-16,23-26,31-34H,5-8,17-22H2,1-4H3/t25-,26-/m0/s1
PubChem CID13208893
ChEMBLCHEMBL41218
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
ED502.56 mg.kg-1PMID6138434ChEMBL

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