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GPCR

NameBeta-1 adrenergic receptor
SpeciesSus scrofa (Pig)
GeneADRB1
SynonymBeta-1 adrenoceptor
Beta-1 adrenoreceptor
DiseaseN/A for non-human GPCRs
Length468
Amino acid sequenceMGAGALALGASEPCNLSSAAPLPDGAATAARLLVPASPPASLLTPASEGSVQLSQQWTAGMGLLMALIVLLIVAGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVVWGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITSPFRYQSLLTRAARALVCTVWAISALVSFLPILMHWWRDKGAEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIMAFVYLRVFREAQKQVKKIDSCERRFLGSPARPPSPAPSPGSPLPAAAAAAPVANGRTSKRRPSRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRDLVPDRLFVFFNWLGYANSAFNPIIYCRSPDFRKAFQRLLCCARRVARGSCAAAGDGPRASGCLAVARPPPSPGAASDDDDDEEDVGAAPPAPLLEPWAGYNGGAARDSDSSLDERTPGGRASESKV
UniProtQ28998
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4351
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL1203618
Molecular formulaC27H32ClNO3
IUPAC name(2S,3S)-3-(3,3-diphenylpropylamino)-6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol;hydrochloride
Molecular weight454.007
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogPNone
SynonymsBDBM50452419
Inchi KeyCTECFHYOZGEUNI-DKIIUIKKSA-N
Inchi IDInChI=1S/C27H31NO3.ClH/c1-30-26-17-21-15-24(25(29)16-22(21)18-27(26)31-2)28-14-13-23(19-9-5-3-6-10-19)20-11-7-4-8-12-20;/h3-12,17-18,23-25,28-29H,13-16H2,1-2H3;1H/t24-,25-;/m0./s1
PubChem CID49861084
ChEMBLCHEMBL1203618
IUPHARN/A
BindingDB50452419
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Experimental Data

ParameterValueReferenceDatabase source
ED503.0 mg.kg-1PMID2435902ChEMBL

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