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GPCR

NameC5a anaphylatoxin chemotactic receptor 1
SpeciesRattus norvegicus (Rat)
GeneC5ar1
SynonymC5A
complement C5a receptor
CD88
C5R1
C5aR1
[ Show all ]
DiseaseN/A for non-human GPCRs
Length352
Amino acid sequenceMDPISNDSSEITYDYSDGTPNPDMPADGVYIPKMEPGDIAALIIYLAVFLVGVTGNALVVWVTAFEAKRTVNAIWFLNLAVADLLSCLALPILFTSIVKHNHWPFGDQACIVLPSLILLNMYSSILLLATISADRFLLVFKPIWCQKFRRPGLAWMACGVTWVLALLLTIPSFVFRRIHKDPYSDSILCNIDYSKGPFFIEKAIAILRLMVGFVLPLLTLNICYTFLLIRTWSRKATRSTKTLKVVMAVVTCFFVFWLPYQVTGVILAWLPRSSSTFQSVERLNSLCVSLAYINCCVNPIIYVMAGQGFHGRLRRSLPSIIRNVLSEDSLGRDSKSFTRSTMDTSTQKSQAV
UniProtP97520
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5770
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL595990
Molecular formulaC22H24N2O4S2
IUPAC nameN,4-dimethyl-N-[2-[methyl-(4-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
Molecular weight444.564
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.1
SynonymsBDBM50305735
N,4-dimethyl-N-[2-[methyl-(4-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
Oprea1_370376
n,n'-1,2-phenylenebis(n,4-dimethylbenzenesulfonamide)
ZINC636919
[ Show all ]
Inchi KeyWOBGBOUAUABUFZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N2O4S2/c1-17-9-13-19(14-10-17)29(25,26)23(3)21-7-5-6-8-22(21)24(4)30(27,28)20-15-11-18(2)12-16-20/h5-16H,1-4H3
PubChem CID265219
ChEMBLCHEMBL595990
IUPHARN/A
BindingDB50305735
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC50<60000.0 nMPMID20004096BindingDB,ChEMBL

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