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GPCR

NameC-C chemokine receptor-like 2
SpeciesHomo sapiens (Human)
GeneCCRL2
SynonymACR5
CRAM-B
CRAM-A
CKRX
Chemokine receptor X
[ Show all ]
DiseaseN/A
Length344
Amino acid sequenceMANYTLAPEDEYDVLIEGELESDEAEQCDKYDAQALSAQLVPSLCSAVFVIGVLDNLLVVLILVKYKGLKRVENIYLLNLAVSNLCFLLTLPFWAHAGGDPMCKILIGLYFVGLYSETFFNCLLTVQRYLVFLHKGNFFSARRRVPCGIITSVLAWVTAILATLPEFVVYKPQMEDQKYKCAFSRTPFLPADETFWKHFLTLKMNISVLVLPLFIFTFLYVQMRKTLRFREQRYSLFKLVFAIMVVFLLMWAPYNIAFFLSTFKEHFSLSDCKSSYNLDKSVHITKLIATTHCCINPLLYAFLDGTFSKYLCRCFHLRSNTPLQPRGQSAQGTSREEPDHSTEV
UniProtO00421
Protein Data BankN/A
GPCR-HGmod modelO00421
3D structure modelThis predicted structure model is from GPCR-EXP O00421.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2321627
IUPHARN/A
DrugBankN/A

Ligand

NameSCHEMBL9999492
Molecular formulaC25H34F3N5O2
IUPAC nameN-[1-[4-(3-hydroxypentan-3-yl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
Molecular weight493.575
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP4.5
SynonymsSCHEMBL9999493
BDBM163342
SCHEMBL15214548
US9062048, 30
CHEMBL3922024
Inchi KeyBMVAXUGUUMCPHI-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H34F3N5O2/c1-3-24(35,4-2)16-5-8-19(9-6-16)33-13-18(14-33)32-22(34)12-29-23-20-11-17(25(26,27)28)7-10-21(20)30-15-31-23/h7,10-11,15-16,18-19,35H,3-6,8-9,12-14H2,1-2H3,(H,32,34)(H,29,30,31)
PubChem CID54770832
ChEMBLCHEMBL3922024
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50209.0 nMNoneChEMBL

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