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GPCR

NameType-1 angiotensin II receptor
SpeciesOryctolagus cuniculus (Rabbit)
GeneAGTR1
SynonymAngiotensin II type-1 receptor
AT1
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMMLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLAVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSSKKPVPCFEVE
UniProtP34976
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3948
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL26277
Molecular formulaC30H26N2O3
IUPAC name2-[4-[(2-butyl-4-oxobenzo[g]quinazolin-3-yl)methyl]phenyl]benzoic acid
Molecular weight462.549
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50281936
4''-(2-Butyl-4-oxo-4H-benzo[g]quinazolin-3-ylmethyl)-biphenyl-2-carboxylic acid
Inchi KeyAZRVZCUDKUWNBE-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H26N2O3/c1-2-3-12-28-31-27-18-23-9-5-4-8-22(23)17-26(27)29(33)32(28)19-20-13-15-21(16-14-20)24-10-6-7-11-25(24)30(34)35/h4-11,13-18H,2-3,12,19H2,1H3,(H,34,35)
PubChem CID44459856
ChEMBLCHEMBL26277
IUPHARN/A
BindingDB50281936
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50380.0 nM, Bioorg. Med. Chem. Lett., (1993) 3:6:1293BindingDB,ChEMBL

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