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GPCR

NameType-1B angiotensin II receptor
SpeciesRattus norvegicus (Rat)
GeneAgtr1b
SynonymAngiotensin II type-1B receptor
AT1B
AT3
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMTLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIYRNVYFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFVFPFLIILTSYTLIWKALKKAYKIQKNTPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGIIRDCEIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPTAKSHAGLSTKMSTLSYRPSDNMSSSAKKSASFFEVE
UniProtP29089
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL263
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL326049
Molecular formulaC29H38N2O
IUPAC name1-[2-[4-[(2-butyl-1,3-diazaspiro[4.4]non-1-en-3-yl)methyl]phenyl]phenyl]-2,2-dimethylpropan-1-one
Molecular weight430.636
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP6.0
Synonyms1-[4''-(2-Butyl-1,3-diaza-spiro[4.4]non-1-en-3-ylmethyl)-biphenyl-2-yl]-2,2-dimethyl-propan-1-one
BDBM50042260
Inchi KeyDYURUOUOBVIGCU-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H38N2O/c1-5-6-13-26-30-29(18-9-10-19-29)21-31(26)20-22-14-16-23(17-15-22)24-11-7-8-12-25(24)27(32)28(2,3)4/h7-8,11-12,14-17H,5-6,9-10,13,18-21H2,1-4H3
PubChem CID44341639
ChEMBLCHEMBL326049
IUPHARN/A
BindingDB50042260
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50<10000.0 nMPMID8230127BindingDB,ChEMBL

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